A0A096N209_PAPAN Loading...

Ankyrin repeat domain-containing protein 37

AlphaFold DB , UniProt , Accession A0A096N209, Species PAPAN (Papio anubis, Olive baboon), Gene ANKRD37, Length 158 aa.

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	36.8	Very low	41.2	Very low	249 Å²	249	132 Å²	132	100%	1.227	71%	0.712	S	S	*	*				0	88.7	0	-159.1	155.6	174.7	0	0	105.9
2	L	40	Very low	42	Very low	169 Å²	169	123.2 Å²	123.2	89%	0.885	68%	0.675	S	S	*	*			trans	-91.4	127.1	177.8	-72.4	169.4	0	0	0	107.3
3	L	32.5	Very low	42.6	Very low	138 Å²	138	118.8 Å²	118.8	72%	0.723	65%	0.65	S	S	*	*			trans	155.7	79.1	152	-93.7	138.5	0	0	0	107.5	D5	L3-D5 VanDerWaalsContact CD2-CG 3.49Å; L3-D5 WeakPolarHBondContact CD2-OD1 3.05Å; L3-D5 WeakPolarHBondContact CD2-OD2 3.39Å; L3-D5 PolarHBondContact O-N 3.2Å; L3-D5 VanDerWaalsContact O-N 3.13Å
4	L	35.4	Very low	43	Very low	162 Å²	162	119.1 Å²	119.1	85%	0.848	64%	0.642	S	S	*	*			trans	-72	87.9	146.8	-76.8	165.8	0	0	0	104.5	C6	L4-C6 PolarHBondContact O-N 2.84Å
5	D	35.6	Very low	43.5	Very low	121 Å²	121	119.7 Å²	119.7	65%	0.647	64%	0.639	S	S	*	*			trans	-66.6	75	160	-78.2	-49.2	0	0	0	107.1	L3 N7	L3-D5 VanDerWaalsContact CD2-CG 3.49Å; L3-D5 WeakPolarHBondContact CD2-OD1 3.05Å; L3-D5 WeakPolarHBondContact CD2-OD2 3.39Å; L3-D5 PolarHBondContact O-N 3.2Å; L3-D5 VanDerWaalsContact O-N 3.13Å; D5-N7 PolarHBondContact O-N 3.44Å
6	C	35.8	Very low	43.9	Very low	100 Å²	100	113.6 Å²	113.6	68%	0.676	61%	0.606	S	S	*	*			trans	-66	91	160	-67	0	0	0	0	105.8	L4 P8	L4-C6 PolarHBondContact O-N 2.84Å; C6-P8 WeakPolarHBondContact O-CD 3.07Å
7	N	43.5	Very low	44.4	Very low	104 Å²	104	114.9 Å²	114.9	56%	0.556	61%	0.612	S	S	*	*			trans	-93.9	81.3	159.4	-95.6	-25.9	0	0	0	107.7	D5 E9	D5-N7 PolarHBondContact O-N 3.44Å; N7-E9 PolarHBondContact O-N 3.15Å; N7-E9 VanDerWaalsContact O-N 3.13Å
8	P	51.1	Low	44.6	Very low	88 Å²	88	115.7 Å²	115.7	57%	0.571	61%	0.612	S	S	*	*	H	α-helix	trans	-65.2	-12.4	-179.3	29.4	-37.8	0	0	0	113.3	C6	C6-P8 WeakPolarHBondContact O-CD 3.07Å
9	E	45.8	Very low	44.8	Very low	117 Å²	117	114.6 Å²	114.6	55%	0.547	61%	0.61	S	S	.	*	H	α-helix	trans	-72.4	-32.1	-177.9	-67.3	-170.6	157.4	0	0	113.5	N7	N7-E9 PolarHBondContact O-N 3.15Å; N7-E9 VanDerWaalsContact O-N 3.13Å
10	V	46.9	Very low	44.8	Very low	94 Å²	94	112 Å²	112	57%	0.57	61%	0.612	S	S	*	*	H	α-helix	trans	-96.1	-36.8	-169.5	-160.5	0	0	0	0	112.1	K14	V10-K14 PolarHBondContact O-N 3.49Å; V10-K14 VanDerWaalsContact O-N 3.16Å
11	D	49.8	Very low	45.1	Very low	110 Å²	110	107.9 Å²	107.9	59%	0.588	59%	0.593	S	S	*	*	H	α-helix	trans	-73.6	-34.1	179.1	-74.7	-32.7	0	0	0	112.3	K14 H15	D11-K14 PolarHBondContact O-N 3.36Å; D11-H15 WeakPolarHBondContact O-CB 3.49Å; D11-H15 PolarHBondContact O-N 3.02Å
12	G	50.8	Low	45.6	Very low	26 Å²	26	99.8 Å²	99.8	27%	0.268	56%	0.56	S	S	.	*	H	α-helix	trans	-64	-43.8	174.8	0	0	0	0	0	112.6	L16	G12-L16 VanDerWaalsContact O-CB 3.24Å; G12-L16 WeakPolarHBondContact O-CB 3.06Å; G12-L16 PolarHBondContact O-N 3.09Å; G12-L16 VanDerWaalsContact O-N 3.09Å
13	L	49.3	Very low	46.1	Very low	67 Å²	67	93.2 Å²	93.2	35%	0.351	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-45.3	174.7	-90.5	171.6	0	0	0	112	L16 L17 L43	L13-L16 PolarHBondContact O-N 2.97Å; L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 PolarHBondContact O-N 2.95Å; L13-L43 HydrophobicContact CD1-CD1 4.46Å; L13-L43 HydrophobicContact CD1-CD2 3.63Å; L13-L43 HydrophobicContact CD2-CD1 3.68Å; L13-L43 HydrophobicContact CD2-CD2 4.18Å; L13-L43 HydrophobicContact CD2-CG 4.48Å; L13-L43 HydrophobicContact CG-CD1 3.56Å; L13-L43 HydrophobicContact CG-CD2 3.68Å; L13-L43 HydrophobicContact CG-CG 4.26Å
14	K	48.3	Very low	46.9	Very low	122 Å²	122	93.7 Å²	93.7	53%	0.53	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-45.9	-177.6	-171.1	-179.7	173	-167.6	0	111.4	V10 D11 L16 E18	V10-K14 PolarHBondContact O-N 3.49Å; V10-K14 VanDerWaalsContact O-N 3.16Å; D11-K14 PolarHBondContact O-N 3.36Å; K14-L16 VanDerWaalsContact C-N 3.31Å; K14-L16 PolarHBondContact O-N 3.01Å; K14-E18 WeakPolarHBondContact CE-OE1 3.41Å; K14-E18 HydrophobicContact CG-CG 4.45Å; K14-E18 VanDerWaalsContact O-CB 3.26Å; K14-E18 WeakPolarHBondContact O-CB 3.41Å; K14-E18 WeakPolarHBondContact O-CG 3.39Å; K14-E18 PolarHBondContact O-N 3.18Å
15	H	50.4	Low	47.6	Very low	129 Å²	129	87.9 Å²	87.9	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-61.9	-37.8	175.7	-95.5	-80.2	0	0	0	112.9	D11 T19	D11-H15 WeakPolarHBondContact O-CB 3.49Å; D11-H15 PolarHBondContact O-N 3.02Å; H15-T19 WeakPolarHBondContact O-CB 3.11Å; H15-T19 WeakPolarHBondContact O-CG2 3.37Å; H15-T19 PolarHBondContact O-N 2.86Å; H15-T19 VanDerWaalsContact O-N 3.14Å; H15-T19 PolarHBondContact O-OG1 2.71Å
16	L	50.2	Low	48.2	Very low	22 Å²	22	87.5 Å²	87.5	12%	0.115	51%	0.51	C	S	.	.	H	α-helix	trans	-77.6	-34.4	-177.1	-161.2	62.2	0	0	0	113.5	G12 L13 K14 T19 A21 L37 F46	G12-L16 VanDerWaalsContact O-CB 3.24Å; G12-L16 WeakPolarHBondContact O-CB 3.06Å; G12-L16 PolarHBondContact O-N 3.09Å; G12-L16 VanDerWaalsContact O-N 3.09Å; L13-L16 PolarHBondContact O-N 2.97Å; K14-L16 VanDerWaalsContact C-N 3.31Å; K14-L16 PolarHBondContact O-N 3.01Å; L16-T19 WeakPolarHBondContact CA-OG1 3.36Å; L16-T19 PolarHBondContact O-OG1 2.96Å; L16-A21 HydrophobicContact CD1-CB 3.91Å; L16-A21 HydrophobicContact CG-CB 4.44Å; L16-L37 HydrophobicContact CD1-CD1 3.78Å; L16-L37 HydrophobicContact CD2-CB 4.5Å; L16-F46 HydrophobicContact CD2-CD1 3.85Å; L16-F46 HydrophobicContact CD2-CE1 3.11Å; L16-F46 HydrophobicContact CD2-CZ 3.65Å; L16-F46 HydrophobicContact CG-CE1 4.05Å; L16-F46 HydrophobicContact CG-CZ 4.1Å
17	L	52.4	Low	49	Very low	136 Å²	136	86.2 Å²	86.2	71%	0.712	50%	0.501	S	S	*	.	H	α-helix	trans	-71.2	-39.7	172	-126.2	83	0	0	0	111.6	L13 T19 G20	L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 PolarHBondContact O-N 2.95Å; L17-T19 VanDerWaalsContact C-N 3.31Å; L17-T19 PolarHBondContact O-N 2.94Å; L17-G20 PolarHBondContact O-N 3.45Å
18	E	48.5	Very low	49.6	Very low	129 Å²	129	86 Å²	86	60%	0.603	50%	0.499	S	S	*	.	H	α-helix	trans	-68.3	-29.2	179.4	-76.8	176.8	175.3	0	0	112.6	K14 G20	K14-E18 WeakPolarHBondContact CE-OE1 3.41Å; K14-E18 HydrophobicContact CG-CG 4.45Å; K14-E18 VanDerWaalsContact O-CB 3.26Å; K14-E18 WeakPolarHBondContact O-CB 3.41Å; K14-E18 WeakPolarHBondContact O-CG 3.39Å; K14-E18 PolarHBondContact O-N 3.18Å; E18-G20 VanDerWaalsContact C-N 3.33Å; E18-G20 PolarHBondContact O-N 2.77Å
19	T	47.3	Very low	49.7	Very low	95 Å²	95	87.8 Å²	87.8	58%	0.583	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-2.8	179	42.5	0	0	0	0	114.4	H15 L16 L17 A21	H15-T19 WeakPolarHBondContact O-CB 3.11Å; H15-T19 WeakPolarHBondContact O-CG2 3.37Å; H15-T19 PolarHBondContact O-N 2.86Å; H15-T19 VanDerWaalsContact O-N 3.14Å; H15-T19 PolarHBondContact O-OG1 2.71Å; L16-T19 WeakPolarHBondContact CA-OG1 3.36Å; L16-T19 PolarHBondContact O-OG1 2.96Å; L17-T19 VanDerWaalsContact C-N 3.31Å; L17-T19 PolarHBondContact O-N 2.94Å; T19-A21 PolarHBondContact O-N 3.48Å
20	G	45.3	Very low	50.2	Low	62 Å²	62	85.1 Å²	85.1	64%	0.639	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	39	177.3	0	0	0	0	0	112.1	L17 E18 S22	L17-G20 PolarHBondContact O-N 3.45Å; E18-G20 VanDerWaalsContact C-N 3.33Å; E18-G20 PolarHBondContact O-N 2.77Å; G20-S22 PolarHBondContact O-N 3.39Å
21	A	50.8	Low	51.1	Low	26 Å²	26	85.4 Å²	85.4	22%	0.215	50%	0.5	C	S	.	.			trans	-55.8	99.8	-173.4	0	0	0	0	0	110.3	L16 T19 V23	L16-A21 HydrophobicContact CD1-CB 3.91Å; L16-A21 HydrophobicContact CG-CB 4.44Å; T19-A21 PolarHBondContact O-N 3.48Å; A21-V23 PolarHBondContact O-N 3.17Å
22	S	48.2	Very low	51.7	Low	78 Å²	78	82.5 Å²	82.5	55%	0.545	48%	0.483	S	S	.	.			trans	-54.9	136.6	164.7	-167.1	0	0	0	0	107	G20 N24 A25	G20-S22 PolarHBondContact O-N 3.39Å; S22-N24 PolarHBondContact O-N 3.32Å; S22-A25 WeakPolarHBondContact O-CB 3.35Å; S22-A25 PolarHBondContact O-N 3.18Å
23	V	50.8	Low	52.6	Low	32 Å²	32	81.8 Å²	81.8	19%	0.194	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-22.3	179	-179.2	0	0	0	0	111.5	A21 W49 T53 A55	A21-V23 PolarHBondContact O-N 3.17Å; V23-W49 HydrophobicContact CG2-CH2 3.83Å; V23-W49 HydrophobicContact CG2-CZ3 3.87Å; V23-T53 WeakPolarHBondContact CG1-OG1 3.32Å; V23-T53 HydrophobicContact CG2-CG2 4.01Å; V23-T53 WeakPolarHBondContact CG2-OG1 3.45Å; V23-A55 HydrophobicContact CG1-CB 4.19Å
24	N	48	Very low	53.7	Low	148 Å²	148	79.1 Å²	79.1	79%	0.791	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	29.8	175	-84.4	-35.4	0	0	0	113.7	S22	S22-N24 PolarHBondContact O-N 3.32Å
25	A	50.2	Low	55.1	Low	39 Å²	39	73.4 Å²	73.4	32%	0.322	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-55.1	136.7	173.5	0	0	0	0	0	109.1	S22	S22-A25 WeakPolarHBondContact O-CB 3.35Å; S22-A25 PolarHBondContact O-N 3.18Å
26	P	48.2	Very low	56.4	Low	113 Å²	113	67.3 Å²	67.3	73%	0.734	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-55.6	138.2	179.7	22.8	-31.8	0	0	0	108.7	D28	P26-D28 PolarHBondContact O-N 3.33Å
27	P	52.4	Low	57.6	Low	74 Å²	74	68.7 Å²	68.7	48%	0.481	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-48.5	127.9	-179.8	7.9	-19.9	0	0	0	110.3	E31	P27-E31 VanDerWaalsContact CB-CA 3.49Å; P27-E31 HydrophobicContact CB-CB 4.12Å; P27-E31 HydrophobicContact CB-CG 4.22Å
28	D	56.6	Low	58.9	Low	98 Å²	98	62.2 Å²	62.2	52%	0.524	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-49	165.6	163.8	-88.2	-57.7	0	0	0	110.1	P26 C30 E31	P26-D28 PolarHBondContact O-N 3.33Å; D28-C30 PolarHBondContact O-N 3.29Å; D28-E31 WeakPolarHBondContact O-CA 3.4Å; D28-E31 PolarHBondContact O-N 3.01Å
29	P	54.5	Low	60.6	Low	127 Å²	127	56.1 Å²	56.1	83%	0.825	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-11.8	176	21	-33.9	0	0	0	114.8
30	C	56.4	Low	62.1	Low	61 Å²	61	53 Å²	53	41%	0.412	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	10.8	172.8	-64.1	0	0	0	0	114.5	D28 Q32 V62	D28-C30 PolarHBondContact O-N 3.29Å; C30-Q32 HydrophobicContact CB-CG 3.84Å; C30-Q32 WeakPolarHBondContact O-CG 3.42Å; C30-Q32 PolarHBondContact O-N 2.98Å; C30-Q32 VanDerWaalsContact O-N 3.11Å; C30-V62 HydrophobicContact CB-CG2 4.14Å; C30-V62 WeakPolarHBondContact O-CG1 3.4Å; C30-V62 WeakPolarHBondContact O-CG2 3.41Å; C30-V62 PolarHBondContact O-N 3.26Å
31	E	63.8	Low	63.4	Low	99 Å²	99	51.5 Å²	51.5	46%	0.463	32%	0.319	S	S	.	.			trans	52.7	28.1	-177.3	-60.6	173.9	-170.1	0	0	115.1	P27 D28 S33 V62	P27-E31 VanDerWaalsContact CB-CA 3.49Å; P27-E31 HydrophobicContact CB-CB 4.12Å; P27-E31 HydrophobicContact CB-CG 4.22Å; D28-E31 WeakPolarHBondContact O-CA 3.4Å; D28-E31 PolarHBondContact O-N 3.01Å; E31-S33 PolarHBondContact O-N 3.11Å; E31-V62 HydrophobicContact CB-CG1 3.78Å; E31-V62 HydrophobicContact CG-CG1 3.63Å
32	Q	63.3	Low	64.7	Low	50 Å²	50	51.2 Å²	51.2	23%	0.234	32%	0.318	C	S	.	.			trans	-87.2	115.7	-176.4	-60.4	-158.8	-61.6	0	0	111.1	C30 H36 L37 D61	C30-Q32 HydrophobicContact CB-CG 3.84Å; C30-Q32 WeakPolarHBondContact O-CG 3.42Å; C30-Q32 PolarHBondContact O-N 2.98Å; C30-Q32 VanDerWaalsContact O-N 3.11Å; Q32-H36 HydrophobicContact CB-CB 4.29Å; Q32-L37 HydrophobicContact CB-CD2 4.43Å; Q32-D61 HydrophobicContact CG-CB 4.1Å; Q32-D61 PolarHBondContact NE2-OD2 3.09Å
33	S	70.3	Confident	66.1	Low	10 Å²	10	48.6 Å²	48.6	7%	0.07	30%	0.298	C	S	.	.			trans	-73.1	159.1	168.3	-34.7	0	0	0	0	111.1	E31 V35 H36 L37 Q59	E31-S33 PolarHBondContact O-N 3.11Å; S33-V35 PolarHBondContact O-N 3.09Å; S33-H36 WeakPolarHBondContact CB-ND1 3.45Å; S33-H36 PolarHBondContact N-ND1 3Å; S33-H36 VanDerWaalsContact N-ND1 3.19Å; S33-H36 WeakPolarHBondContact O-CB 3.31Å; S33-H36 PolarHBondContact O-N 2.93Å; S33-H36 PolarHBondContact OG-ND1 3.2Å; S33-L37 PolarHBondContact O-N 3.25Å; S33-Q59 PolarHBondContact OG-NE2 3Å; S33-Q59 VanDerWaalsContact OG-NE2 3.08Å; S33-Q59 PolarHBondContact OG-OE1 2.74Å
34	P	72.6	Confident	67.4	Low	11 Å²	11	48 Å²	48	7%	0.071	30%	0.297	C	S	.	.	H	α-helix	trans	-52.2	-29.2	175.2	-28.1	36.1	0	0	0	114.1	L37 A38 Q50	P34-L37 PolarHBondContact O-N 2.9Å; P34-A38 WeakPolarHBondContact O-CB 3.5Å; P34-A38 PolarHBondContact O-N 2.92Å; P34-Q50 PolarHBondContact O-NE2 3.44Å; P34-Q50 PolarHBondContact O-OE1 2.98Å
35	V	77.1	Confident	68.7	Low	2 Å²	2	46.3 Å²	46.3	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-70	-35.6	176.4	-167.4	0	0	0	0	113	S33 L37 A38 A39 L47 Q50 A55 L57 P67	S33-V35 PolarHBondContact O-N 3.09Å; V35-L37 VanDerWaalsContact C-N 3.3Å; V35-L37 PolarHBondContact O-N 2.93Å; V35-A38 PolarHBondContact O-N 3.07Å; V35-A39 WeakPolarHBondContact O-CB 3.33Å; V35-A39 PolarHBondContact O-N 3.39Å; V35-L47 HydrophobicContact CG1-CD1 4.15Å; V35-Q50 HydrophobicContact CG2-CB 4.19Å; V35-A55 HydrophobicContact CG2-CB 3.31Å; V35-L57 HydrophobicContact CG1-CD2 3.85Å; V35-P67 HydrophobicContact CB-CB 4.49Å; V35-P67 HydrophobicContact CB-CG 3.98Å; V35-P67 HydrophobicContact CG1-CB 3.75Å; V35-P67 HydrophobicContact CG1-CG 3.64Å
36	H	78.3	Confident	69.8	Low	2 Å²	2	46.2 Å²	46.2	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-42.1	174.7	-67.3	88.9	0	0	0	110.8	Q32 S33 G40 Q59 E65 P67	Q32-H36 HydrophobicContact CB-CB 4.29Å; S33-H36 WeakPolarHBondContact CB-ND1 3.45Å; S33-H36 PolarHBondContact N-ND1 3Å; S33-H36 VanDerWaalsContact N-ND1 3.19Å; S33-H36 WeakPolarHBondContact O-CB 3.31Å; S33-H36 PolarHBondContact O-N 2.93Å; S33-H36 PolarHBondContact OG-ND1 3.2Å; H36-G40 PolarHBondContact O-N 3.46Å; H36-Q59 PolarHBondContact CE1-O 2.83Å; H36-Q59 PolarHBondContact NE2-O 2.83Å; H36-E65 PolarHBondContact CD2-O 2.89Å; H36-E65 PolarHBondContact NE2-O 3.15Å; H36-P67 WeakPolarHBondContact NE2-CD 3.33Å
37	L	75.7	Confident	71.2	Confident	51 Å²	51	40.8 Å²	40.8	27%	0.267	25%	0.252	S	S	.	.	H	α-helix	trans	-67.1	-46.1	177.9	-60.1	176.8	0	0	0	110.6	L16 Q32 S33 P34 V35 A39 G40 S41	L16-L37 HydrophobicContact CD1-CD1 3.78Å; L16-L37 HydrophobicContact CD2-CB 4.5Å; Q32-L37 HydrophobicContact CB-CD2 4.43Å; S33-L37 PolarHBondContact O-N 3.25Å; P34-L37 PolarHBondContact O-N 2.9Å; V35-L37 VanDerWaalsContact C-N 3.3Å; V35-L37 PolarHBondContact O-N 2.93Å; L37-A39 PolarHBondContact O-N 3.36Å; L37-G40 CarbonylContact O-C 3.58Å; L37-G40 PolarHBondContact O-N 2.85Å; L37-S41 WeakPolarHBondContact O-CB 3.34Å; L37-S41 PolarHBondContact O-N 3.44Å; L37-S41 PolarHBondContact O-OG 2.91Å
38	A	79.7	Confident	72.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.2	-48	176.9	0	0	0	0	0	112.4	P34 V35 S41 G42 L43 F46 L47 Q50	P34-A38 WeakPolarHBondContact O-CB 3.5Å; P34-A38 PolarHBondContact O-N 2.92Å; V35-A38 PolarHBondContact O-N 3.07Å; A38-S41 PolarHBondContact O-N 2.68Å; A38-G42 PolarHBondContact O-N 3.33Å; A38-L43 PolarHBondContact O-N 3.27Å; A38-F46 HydrophobicContact CB-CD1 3.65Å; A38-F46 HydrophobicContact CB-CE1 4.28Å; A38-L47 HydrophobicContact CB-CB 4.06Å; A38-L47 HydrophobicContact CB-CD1 4.21Å; A38-Q50 VanDerWaalsContact CB-OE1 3.32Å
39	A	82.4	Confident	73.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.8	-39.2	178	0	0	0	0	0	112.5	V35 L37 S41 G42 L47 P67 K70 A71 L83	V35-A39 WeakPolarHBondContact O-CB 3.33Å; V35-A39 PolarHBondContact O-N 3.39Å; L37-A39 PolarHBondContact O-N 3.36Å; A39-S41 PolarHBondContact O-N 3.29Å; A39-G42 PolarHBondContact O-N 3.19Å; A39-L47 HydrophobicContact CB-CD1 3.76Å; A39-P67 HydrophobicContact CB-CB 4Å; A39-P67 WeakPolarHBondContact CB-O 3.17Å; A39-K70 HydrophobicContact CB-CB 4.1Å; A39-A71 HydrophobicContact CB-CB 4.17Å; A39-L83 HydrophobicContact CB-CD1 4.42Å
40	G	78.7	Confident	74.3	Confident	31 Å²	31	36.4 Å²	36.4	32%	0.32	21%	0.208	S	C	.	.	H	α-helix	trans	-72.6	-13.7	177.3	0	0	0	0	0	114.6	H36 L37 V74	H36-G40 PolarHBondContact O-N 3.46Å; L37-G40 CarbonylContact O-C 3.58Å; L37-G40 PolarHBondContact O-N 2.85Å; G40-V74 WeakPolarHBondContact O-CG2 3.38Å
41	S	74.4	Confident	75.2	Confident	30 Å²	30	35 Å²	35	21%	0.21	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-1.8	173.6	-62.7	0	0	0	0	113.1	L37 A38 A39 L43	L37-S41 WeakPolarHBondContact O-CB 3.34Å; L37-S41 PolarHBondContact O-N 3.44Å; L37-S41 PolarHBondContact O-OG 2.91Å; A38-S41 PolarHBondContact O-N 2.68Å; A39-S41 PolarHBondContact O-N 3.29Å; S41-L43 VanDerWaalsContact C-N 3.27Å; S41-L43 PolarHBondContact O-N 3.16Å
42	G	76.3	Confident	75.8	Confident	19 Å²	19	37.6 Å²	37.6	20%	0.196	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	17	-177.6	0	0	0	0	0	114.5	A38 A39 A44	A38-G42 PolarHBondContact O-N 3.33Å; A39-G42 PolarHBondContact O-N 3.19Å; G42-A44 PolarHBondContact O-N 3.07Å
43	L	78.7	Confident	76.1	Confident	23 Å²	23	38.1 Å²	38.1	12%	0.12	22%	0.215	C	C	.	.			trans	-85.2	72.1	-171.9	-62.6	170.8	0	0	0	112	L13 A38 S41 C45 F46 L47	L13-L43 HydrophobicContact CD1-CD1 4.46Å; L13-L43 HydrophobicContact CD1-CD2 3.63Å; L13-L43 HydrophobicContact CD2-CD1 3.68Å; L13-L43 HydrophobicContact CD2-CD2 4.18Å; L13-L43 HydrophobicContact CD2-CG 4.48Å; L13-L43 HydrophobicContact CG-CD1 3.56Å; L13-L43 HydrophobicContact CG-CD2 3.68Å; L13-L43 HydrophobicContact CG-CG 4.26Å; A38-L43 PolarHBondContact O-N 3.27Å; S41-L43 VanDerWaalsContact C-N 3.27Å; S41-L43 PolarHBondContact O-N 3.16Å; L43-C45 VanDerWaalsContact C-N 3.3Å; L43-C45 PolarHBondContact O-N 2.99Å; L43-F46 HydrophobicContact CB-CB 4.04Å; L43-F46 PolarHBondContact O-N 3.49Å; L43-L47 PolarHBondContact O-N 2.66Å
44	A	77.9	Confident	76.2	Confident	21 Å²	21	40.8 Å²	40.8	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-53.1	-42.1	-176.7	0	0	0	0	0	113.8	G42 F46 L47 L48 E78 L82	G42-A44 PolarHBondContact O-N 3.07Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 3.07Å; A44-L47 PolarHBondContact O-N 2.9Å; A44-L48 WeakPolarHBondContact O-CB 3.47Å; A44-L48 PolarHBondContact O-N 3.12Å; A44-E78 HydrophobicContact CB-CB 3.93Å; A44-L82 HydrophobicContact CB-CD1 3.68Å; A44-L82 VanDerWaalsContact O-CD1 3.25Å; A44-L82 WeakPolarHBondContact O-CD1 3.4Å
45	C	74.9	Confident	76.4	Confident	112 Å²	112	41.1 Å²	41.1	76%	0.757	25%	0.248	S	C	*	.	H	α-helix	trans	-63.2	-38.2	178.7	-62.5	0	0	0	0	112.8	L43 W49	L43-C45 VanDerWaalsContact C-N 3.3Å; L43-C45 PolarHBondContact O-N 2.99Å; C45-W49 PolarHBondContact O-N 3.46Å
46	F	72.7	Confident	76.5	Confident	36 Å²	36	45.2 Å²	45.2	16%	0.158	27%	0.27	C	S	.	.	H	α-helix	trans	-76.9	-37.7	179.9	-174.4	-114	0	0	0	111.1	L16 A38 L43 A44 L48 W49 Q50	L16-F46 HydrophobicContact CD2-CD1 3.85Å; L16-F46 HydrophobicContact CD2-CE1 3.11Å; L16-F46 HydrophobicContact CD2-CZ 3.65Å; L16-F46 HydrophobicContact CG-CE1 4.05Å; L16-F46 HydrophobicContact CG-CZ 4.1Å; A38-F46 HydrophobicContact CB-CD1 3.65Å; A38-F46 HydrophobicContact CB-CE1 4.28Å; L43-F46 HydrophobicContact CB-CB 4.04Å; L43-F46 PolarHBondContact O-N 3.49Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 3.07Å; F46-L48 VanDerWaalsContact C-N 3.32Å; F46-L48 PolarHBondContact O-N 3.31Å; F46-W49 HydrophobicContact CD2-CE3 4.23Å; F46-W49 AromaticContact CE2-CE3 3.83Å; F46-W49 HydrophobicContact CE2-CE3 3.83Å; F46-W49 HydrophobicContact CE2-CZ3 4.04Å; F46-W49 HydrophobicContact CZ-CZ3 4.49Å; F46-W49 PolarHBondContact O-N 3.02Å; F46-Q50 HydrophobicContact CE1-CG 4.28Å; F46-Q50 HydrophobicContact CZ-CG 4.37Å; F46-Q50 VanDerWaalsContact CZ-NE2 3.33Å; F46-Q50 WeakPolarHBondContact O-CG 3.18Å; F46-Q50 PolarHBondContact O-N 3.4Å
47	L	78.9	Confident	76.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-41.8	171	-168.8	129	0	0	0	111.6	V35 A38 A39 L43 A44 W49 Q50 L51 L82 L83	V35-L47 HydrophobicContact CG1-CD1 4.15Å; A38-L47 HydrophobicContact CB-CB 4.06Å; A38-L47 HydrophobicContact CB-CD1 4.21Å; A39-L47 HydrophobicContact CB-CD1 3.76Å; L43-L47 PolarHBondContact O-N 2.66Å; A44-L47 PolarHBondContact O-N 2.9Å; L47-W49 PolarHBondContact O-N 2.88Å; L47-Q50 PolarHBondContact O-N 3.46Å; L47-L51 HydrophobicContact CD2-CD1 3.71Å; L47-L51 HydrophobicContact CD2-CG 4.45Å; L47-L51 WeakPolarHBondContact O-CB 3.42Å; L47-L51 VanDerWaalsContact O-CG 3.26Å; L47-L51 WeakPolarHBondContact O-CG 3.35Å; L47-L51 PolarHBondContact O-N 3.46Å; L47-L82 HydrophobicContact CD2-CB 3.66Å; L47-L82 HydrophobicContact CD2-CD1 4.12Å; L47-L83 HydrophobicContact CD1-CD1 4.33Å; L47-L83 HydrophobicContact CD1-CD2 4.1Å; L47-L83 HydrophobicContact CD1-CG 4.19Å; L47-L83 HydrophobicContact CD2-CD2 3.99Å; L47-L83 HydrophobicContact CD2-CG 3.95Å; L47-L83 HydrophobicContact CG-CD2 4.42Å
48	L	78.9	Confident	76.9	Confident	82 Å²	82	45.9 Å²	45.9	43%	0.429	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-42.3	174.2	-177.7	65.1	0	0	0	112.5	A44 F46 Q50 L51 Q52 L82	A44-L48 WeakPolarHBondContact O-CB 3.47Å; A44-L48 PolarHBondContact O-N 3.12Å; F46-L48 VanDerWaalsContact C-N 3.32Å; F46-L48 PolarHBondContact O-N 3.31Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 3.35Å; L48-Q52 WeakPolarHBondContact O-CG 3.36Å; L48-Q52 PolarHBondContact O-N 3.41Å; L48-L82 HydrophobicContact CB-CD1 4.37Å; L48-L82 HydrophobicContact CD1-CD2 4.2Å
49	W	75.9	Confident	77.1	Confident	124 Å²	124	49.2 Å²	49.2	47%	0.47	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-41.5	175.9	179.7	78.4	0	0	0	111.6	V23 C45 F46 L47 L51 Q52 T53	V23-W49 HydrophobicContact CG2-CH2 3.83Å; V23-W49 HydrophobicContact CG2-CZ3 3.87Å; C45-W49 PolarHBondContact O-N 3.46Å; F46-W49 HydrophobicContact CD2-CE3 4.23Å; F46-W49 AromaticContact CE2-CE3 3.83Å; F46-W49 HydrophobicContact CE2-CE3 3.83Å; F46-W49 HydrophobicContact CE2-CZ3 4.04Å; F46-W49 HydrophobicContact CZ-CZ3 4.49Å; F46-W49 PolarHBondContact O-N 3.02Å; L47-W49 PolarHBondContact O-N 2.88Å; W49-L51 PolarHBondContact O-N 2.9Å; W49-Q52 WeakPolarHBondContact O-CB 3.44Å; W49-Q52 PolarHBondContact O-N 3.2Å; W49-T53 HydrophobicContact CH2-CG2 4.49Å; W49-T53 HydrophobicContact CZ2-CG2 4.23Å; W49-T53 PolarHBondContact O-N 3.19Å
50	Q	73.2	Confident	77.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-66.8	-36.7	177.4	-69.9	171.8	-21.4	0	0	113.4	P34 V35 A38 F46 L47 L48 Q52 T53 G54 A55	P34-Q50 PolarHBondContact O-NE2 3.44Å; P34-Q50 PolarHBondContact O-OE1 2.98Å; V35-Q50 HydrophobicContact CG2-CB 4.19Å; A38-Q50 VanDerWaalsContact CB-OE1 3.32Å; F46-Q50 HydrophobicContact CE1-CG 4.28Å; F46-Q50 HydrophobicContact CZ-CG 4.37Å; F46-Q50 VanDerWaalsContact CZ-NE2 3.33Å; F46-Q50 WeakPolarHBondContact O-CG 3.18Å; F46-Q50 PolarHBondContact O-N 3.4Å; L47-Q50 PolarHBondContact O-N 3.46Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; Q50-Q52 VanDerWaalsContact C-N 3.29Å; Q50-Q52 PolarHBondContact O-N 2.95Å; Q50-T53 VanDerWaalsContact C-OG1 3.28Å; Q50-T53 VanDerWaalsContact CA-OG1 3.25Å; Q50-T53 WeakPolarHBondContact CA-OG1 3.42Å; Q50-T53 PolarHBondContact O-N 3.09Å; Q50-T53 VanDerWaalsContact O-N 3.08Å; Q50-T53 PolarHBondContact O-OG1 2.85Å; Q50-G54 PolarHBondContact O-N 2.85Å; Q50-A55 HydrophobicContact CB-CB 4.31Å; Q50-A55 WeakPolarHBondContact O-CB 3.41Å; Q50-A55 PolarHBondContact O-N 2.85Å
51	L	75.5	Confident	77.3	Confident	31 Å²	31	51.5 Å²	51.5	16%	0.162	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-44	172.4	-79.1	166.1	0	0	0	111.4	L47 L48 W49 T53 G54 L57 L82 S86	L47-L51 HydrophobicContact CD2-CD1 3.71Å; L47-L51 HydrophobicContact CD2-CG 4.45Å; L47-L51 WeakPolarHBondContact O-CB 3.42Å; L47-L51 VanDerWaalsContact O-CG 3.26Å; L47-L51 WeakPolarHBondContact O-CG 3.35Å; L47-L51 PolarHBondContact O-N 3.46Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 3.35Å; W49-L51 PolarHBondContact O-N 2.9Å; L51-T53 PolarHBondContact O-N 3.02Å; L51-G54 PolarHBondContact O-N 3.39Å; L51-G54 VanDerWaalsContact O-N 3.12Å; L51-L57 HydrophobicContact CD2-CD1 3.31Å; L51-L57 HydrophobicContact CD2-CD2 3.42Å; L51-L57 VanDerWaalsContact CD2-CD2 3.42Å; L51-L57 HydrophobicContact CD2-CG 3.8Å; L51-L57 HydrophobicContact CG-CD2 4.28Å; L51-L82 HydrophobicContact CD1-CB 4.42Å; L51-S86 VanDerWaalsContact CD1-OG 3.31Å; L51-S86 WeakPolarHBondContact CD1-OG 3.21Å; L51-S86 VanDerWaalsContact CD2-CB 3.45Å; L51-S86 WeakPolarHBondContact CD2-OG 3.48Å
52	Q	76.1	Confident	77.5	Confident	153 Å²	153	52.1 Å²	52.1	72%	0.715	29%	0.294	S	S	*	.	H	α-helix	trans	-64.6	-26.6	176.6	-69.2	178.3	-21.6	0	0	113.1	L48 W49 Q50 G54	L48-Q52 WeakPolarHBondContact O-CG 3.36Å; L48-Q52 PolarHBondContact O-N 3.41Å; W49-Q52 WeakPolarHBondContact O-CB 3.44Å; W49-Q52 PolarHBondContact O-N 3.2Å; Q50-Q52 VanDerWaalsContact C-N 3.29Å; Q50-Q52 PolarHBondContact O-N 2.95Å; Q52-G54 VanDerWaalsContact C-N 3.28Å
53	T	70.8	Confident	77.7	Confident	62 Å²	62	55.5 Å²	55.5	38%	0.38	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	1.8	177.1	56.7	0	0	0	0	114.1	V23 W49 Q50 L51	V23-T53 WeakPolarHBondContact CG1-OG1 3.32Å; V23-T53 HydrophobicContact CG2-CG2 4.01Å; V23-T53 WeakPolarHBondContact CG2-OG1 3.45Å; W49-T53 HydrophobicContact CH2-CG2 4.49Å; W49-T53 HydrophobicContact CZ2-CG2 4.23Å; W49-T53 PolarHBondContact O-N 3.19Å; Q50-T53 VanDerWaalsContact C-OG1 3.28Å; Q50-T53 VanDerWaalsContact CA-OG1 3.25Å; Q50-T53 WeakPolarHBondContact CA-OG1 3.42Å; Q50-T53 PolarHBondContact O-N 3.09Å; Q50-T53 VanDerWaalsContact O-N 3.08Å; Q50-T53 PolarHBondContact O-OG1 2.85Å; L51-T53 PolarHBondContact O-N 3.02Å
54	G	70.7	Confident	78	Confident	66 Å²	66	54.5 Å²	54.5	68%	0.68	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	30.9	175.5	0	0	0	0	0	114.2	Q50 L51 Q52	Q50-G54 PolarHBondContact O-N 2.85Å; L51-G54 PolarHBondContact O-N 3.39Å; L51-G54 VanDerWaalsContact O-N 3.12Å; Q52-G54 VanDerWaalsContact C-N 3.28Å
55	A	77	Confident	78.5	Confident	17 Å²	17	53.9 Å²	53.9	14%	0.14	30%	0.296	C	S	.	.			trans	-67.6	144.8	178.3	0	0	0	0	0	112.3	V23 V35 Q50 L57	V23-A55 HydrophobicContact CG1-CB 4.19Å; V35-A55 HydrophobicContact CG2-CB 3.31Å; Q50-A55 HydrophobicContact CB-CB 4.31Å; Q50-A55 WeakPolarHBondContact O-CB 3.41Å; Q50-A55 PolarHBondContact O-N 2.85Å; A55-L57 PolarHBondContact O-N 3.13Å
56	D	78.9	Confident	79.2	Confident	88 Å²	88	48.6 Å²	48.6	47%	0.471	26%	0.261	S	S	.	.			trans	-77.6	116.1	177.6	-171.9	-6.4	0	0	0	110.8	N58 Q59	D56-N58 PolarHBondContact OD1-N 3.25Å; D56-Q59 HydrophobicContact CB-CB 4.14Å; D56-Q59 PolarHBondContact OD1-N 3.33Å
57	L	80.4	Confident	79.9	Confident	15 Å²	15	46.9 Å²	46.9	8%	0.079	25%	0.253	C	S	.	.	S	Bend	trans	-86.4	-11.3	-178.1	-51.6	178.3	0	0	0	113.6	V35 L51 A55 P67 L83 S86 A88	V35-L57 HydrophobicContact CG1-CD2 3.85Å; L51-L57 HydrophobicContact CD2-CD1 3.31Å; L51-L57 HydrophobicContact CD2-CD2 3.42Å; L51-L57 VanDerWaalsContact CD2-CD2 3.42Å; L51-L57 HydrophobicContact CD2-CG 3.8Å; L51-L57 HydrophobicContact CG-CD2 4.28Å; A55-L57 PolarHBondContact O-N 3.13Å; L57-P67 WeakPolarHBondContact O-CD 3.04Å; L57-L83 HydrophobicContact CB-CD2 4.44Å; L57-L83 HydrophobicContact CD1-CD2 4.37Å; L57-L83 HydrophobicContact CD2-CD2 3.83Å; L57-L83 HydrophobicContact CG-CD2 4.43Å; L57-S86 VanDerWaalsContact CD1-CB 3.47Å; L57-A88 HydrophobicContact CB-CB 4.02Å; L57-A88 HydrophobicContact CD1-CB 4.21Å
58	N	83.8	Confident	80.5	Confident	53 Å²	53	47 Å²	47	28%	0.283	25%	0.254	S	S	.	.	S	Bend	trans	-104.4	-5.1	-179.9	-58.2	-44.3	0	0	0	111.6	D56 Q60 Q89 L92	D56-N58 PolarHBondContact OD1-N 3.25Å; N58-Q60 PolarHBondContact O-N 3.45Å; N58-Q89 WeakPolarHBondContact OD1-CB 3.18Å; N58-Q89 PolarHBondContact OD1-N 2.66Å; N58-L92 HydrophobicContact CB-CD1 4.12Å
59	Q	82.9	Confident	81.1	Confident	69 Å²	69	43.2 Å²	43.2	32%	0.322	23%	0.234	S	C	.	.			trans	-55.7	134.1	172.4	-171.2	174.7	-3.7	0	0	109.1	S33 H36 D56 A66 P67	S33-Q59 PolarHBondContact OG-NE2 3Å; S33-Q59 VanDerWaalsContact OG-NE2 3.08Å; S33-Q59 PolarHBondContact OG-OE1 2.74Å; H36-Q59 PolarHBondContact CE1-O 2.83Å; H36-Q59 PolarHBondContact NE2-O 2.83Å; D56-Q59 HydrophobicContact CB-CB 4.14Å; D56-Q59 PolarHBondContact OD1-N 3.33Å; Q59-A66 WeakPolarHBondContact O-CA 3.35Å; Q59-P67 WeakPolarHBondContact O-CD 3.45Å
60	Q	85.3	Confident	81.6	Confident	75 Å²	75	38.3 Å²	38.3	35%	0.35	22%	0.216	S	C	.	.			trans	-106.9	142.9	178.8	-66.4	-174.9	-40.6	0	0	109.8	N58 G64 A66 C93	N58-Q60 PolarHBondContact O-N 3.45Å; Q60-G64 PolarHBondContact NE2-O 3.01Å; Q60-A66 HydrophobicContact CG-CB 4.41Å; Q60-C93 PolarHBondContact NE2-O 3.19Å
61	D	80.3	Confident	82.4	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	22%	0.216	C	C	.	.			trans	-81.2	-173.9	173.7	74.9	4.2	0	0	0	112.8	Q32 L63 G64 E65 K70	Q32-D61 HydrophobicContact CG-CB 4.1Å; Q32-D61 PolarHBondContact NE2-OD2 3.09Å; D61-L63 PolarHBondContact O-N 3.28Å; D61-L63 WeakPolarHBondContact OD1-CA 3.48Å; D61-L63 WeakPolarHBondContact OD1-CB 3.32Å; D61-L63 PolarHBondContact OD1-N 2.88Å; D61-G64 WeakPolarHBondContact O-CA 3.37Å; D61-G64 PolarHBondContact O-N 3.42Å; D61-G64 PolarHBondContact OD1-N 3.21Å; D61-E65 PolarHBondContact N-O 3.37Å; D61-E65 VanDerWaalsContact N-O 3.15Å; D61-E65 WeakPolarHBondContact OD1-CB 3.31Å; D61-E65 PolarHBondContact OD1-N 3.48Å; D61-K70 WeakPolarHBondContact OD2-CE 3.33Å; D61-K70 IonicContact OD2-NZ 2.68Å; D61-K70 PolarHBondContact OD2-NZ 3.36Å
62	V	79.1	Confident	83.1	Confident	44 Å²	44	36.8 Å²	36.8	27%	0.267	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.3	178.2	-67.8	0	0	0	0	114.3	C30 E31 K95	C30-V62 HydrophobicContact CB-CG2 4.14Å; C30-V62 WeakPolarHBondContact O-CG1 3.4Å; C30-V62 WeakPolarHBondContact O-CG2 3.41Å; C30-V62 PolarHBondContact O-N 3.26Å; E31-V62 HydrophobicContact CB-CG1 3.78Å; E31-V62 HydrophobicContact CG-CG1 3.63Å; V62-K95 WeakPolarHBondContact O-CD 3.32Å; V62-K95 WeakPolarHBondContact O-CE 3.33Å; V62-K95 PolarHBondContact O-NZ 2.99Å
63	L	80.4	Confident	83.6	Confident	89 Å²	89	33.1 Å²	33.1	47%	0.466	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	1.8	175	-58.2	178.6	0	0	0	111.9	D61 E65 K95	D61-L63 PolarHBondContact O-N 3.28Å; D61-L63 WeakPolarHBondContact OD1-CA 3.48Å; D61-L63 WeakPolarHBondContact OD1-CB 3.32Å; D61-L63 PolarHBondContact OD1-N 2.88Å; L63-E65 HydrophobicContact CB-CG 3.97Å; L63-E65 PolarHBondContact O-N 2.9Å; L63-K95 VanDerWaalsContact O-CB 3.32Å; L63-K95 WeakPolarHBondContact O-CB 3.44Å; L63-K95 WeakPolarHBondContact O-CG 3.08Å; L63-K95 PolarHBondContact O-N 3.28Å
64	G	85.4	Confident	84.4	Confident	3 Å²	3	33 Å²	33	3%	0.031	19%	0.189	C	C	.	.	S	Bend	trans	73.5	8.9	-169.5	0	0	0	0	0	112.4	Q60 D61 A66 N94	Q60-G64 PolarHBondContact NE2-O 3.01Å; D61-G64 WeakPolarHBondContact O-CA 3.37Å; D61-G64 PolarHBondContact O-N 3.42Å; D61-G64 PolarHBondContact OD1-N 3.21Å; G64-A66 PolarHBondContact O-N 3.11Å; G64-N94 WeakPolarHBondContact O-CA 3.44Å
65	E	87.1	Confident	85.1	Confident	8 Å²	8	31 Å²	31	4%	0.037	17%	0.167	C	C	.	.			trans	-84.6	113.1	-176.6	-67.8	-174.2	162.3	0	0	109.1	H36 D61 L63 H69 K70 K73 N94	H36-E65 PolarHBondContact CD2-O 2.89Å; H36-E65 PolarHBondContact NE2-O 3.15Å; D61-E65 PolarHBondContact N-O 3.37Å; D61-E65 VanDerWaalsContact N-O 3.15Å; D61-E65 WeakPolarHBondContact OD1-CB 3.31Å; D61-E65 PolarHBondContact OD1-N 3.48Å; L63-E65 HydrophobicContact CB-CG 3.97Å; L63-E65 PolarHBondContact O-N 2.9Å; E65-H69 HydrophobicContact CB-CB 3.92Å; E65-H69 HydrophobicContact CG-CB 4.16Å; E65-K70 WeakPolarHBondContact OE2-CD 3.47Å; E65-K70 WeakPolarHBondContact OE2-CE 3.24Å; E65-K70 IonicContact OE2-NZ 2.74Å; E65-K70 PolarHBondContact OE2-NZ 2.96Å; E65-K73 VanDerWaalsContact CD-NZ 3.25Å; E65-K73 WeakPolarHBondContact OE1-CD 3.33Å; E65-K73 IonicContact OE1-NZ 2.7Å; E65-K73 PolarHBondContact OE1-NZ 3.41Å; E65-K73 IonicContact OE2-NZ 2.92Å; E65-K73 PolarHBondContact OE2-NZ 2.99Å; E65-N94 HydrophobicContact CG-CB 3.91Å
66	A	90.1	Very high	85.6	Confident	1 Å²	1	31 Å²	31	1%	0.008	17%	0.167	C	C	.	.			trans	-70.3	163.8	165.4	0	0	0	0	0	111.8	Q59 Q60 G64 L68 H69 K70 L92	Q59-A66 WeakPolarHBondContact O-CA 3.35Å; Q60-A66 HydrophobicContact CG-CB 4.41Å; G64-A66 PolarHBondContact O-N 3.11Å; A66-L68 PolarHBondContact O-N 2.9Å; A66-H69 PolarHBondContact N-ND1 2.98Å; A66-H69 VanDerWaalsContact O-CB 3.31Å; A66-H69 WeakPolarHBondContact O-CB 3.34Å; A66-H69 PolarHBondContact O-N 3.38Å; A66-K70 PolarHBondContact O-N 3.39Å; A66-L92 HydrophobicContact CB-CD1 3.8Å
67	P	88.1	Confident	86.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-50.6	-35.7	176.5	-28.6	35	0	0	0	114.1	V35 H36 A39 L57 Q59 H69 K70 A71 L83	V35-P67 HydrophobicContact CB-CB 4.49Å; V35-P67 HydrophobicContact CB-CG 3.98Å; V35-P67 HydrophobicContact CG1-CB 3.75Å; V35-P67 HydrophobicContact CG1-CG 3.64Å; H36-P67 WeakPolarHBondContact NE2-CD 3.33Å; A39-P67 HydrophobicContact CB-CB 4Å; A39-P67 WeakPolarHBondContact CB-O 3.17Å; L57-P67 WeakPolarHBondContact O-CD 3.04Å; Q59-P67 WeakPolarHBondContact O-CD 3.45Å; P67-H69 VanDerWaalsContact C-N 3.32Å; P67-H69 PolarHBondContact O-N 3.07Å; P67-K70 WeakPolarHBondContact O-CB 3.5Å; P67-K70 PolarHBondContact O-N 3.35Å; P67-K70 VanDerWaalsContact O-N 3.12Å; P67-A71 PolarHBondContact O-N 3.16Å; P67-L83 HydrophobicContact CB-CD1 4.16Å; P67-L83 HydrophobicContact CB-CD2 4.23Å
68	L	90.6	Very high	86.4	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-37.7	176.9	-163.6	77.5	0	0	0	112.8	A66 K70 A71 A72 L80 L83 V84 I90 A100 L116	A66-L68 PolarHBondContact O-N 2.9Å; L68-K70 VanDerWaalsContact C-N 3.34Å; L68-A71 PolarHBondContact O-N 3.47Å; L68-A72 WeakPolarHBondContact O-CB 3.32Å; L68-A72 PolarHBondContact O-N 3.02Å; L68-L80 HydrophobicContact CD1-CD2 3.54Å; L68-L80 HydrophobicContact CG-CD2 3.97Å; L68-L83 HydrophobicContact CB-CD1 4.29Å; L68-L83 HydrophobicContact CD1-CB 3.72Å; L68-L83 HydrophobicContact CD1-CD1 3.93Å; L68-L83 HydrophobicContact CD1-CG 4.49Å; L68-V84 HydrophobicContact CD1-CG2 4.37Å; L68-I90 HydrophobicContact CD2-CB 4.04Å; L68-I90 HydrophobicContact CD2-CG2 3.84Å; L68-A100 HydrophobicContact CB-CB 4.48Å; L68-A100 HydrophobicContact CD2-CB 3.91Å; L68-A100 HydrophobicContact CG-CB 3.96Å; L68-L116 HydrophobicContact CD1-CD2 4.42Å; L68-L116 HydrophobicContact CD2-CD2 4.2Å; L68-L116 HydrophobicContact CG-CD2 4.48Å
69	H	90.8	Very high	86.6	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-64.7	-39.7	174.6	-61.7	92.5	0	0	0	111.3	E65 A66 P67 A72 K73 L92 Q98 A100 L103	E65-H69 HydrophobicContact CB-CB 3.92Å; E65-H69 HydrophobicContact CG-CB 4.16Å; A66-H69 PolarHBondContact N-ND1 2.98Å; A66-H69 VanDerWaalsContact O-CB 3.31Å; A66-H69 WeakPolarHBondContact O-CB 3.34Å; A66-H69 PolarHBondContact O-N 3.38Å; P67-H69 VanDerWaalsContact C-N 3.32Å; P67-H69 PolarHBondContact O-N 3.07Å; H69-A72 PolarHBondContact O-N 3Å; H69-K73 WeakPolarHBondContact O-CG 3.24Å; H69-K73 PolarHBondContact O-N 3.33Å; H69-L92 PolarHBondContact CE1-O 3.08Å; H69-L92 PolarHBondContact NE2-O 3.38Å; H69-Q98 PolarHBondContact NE2-O 3.48Å; H69-A100 PolarHBondContact CD2-N 3.12Å; H69-L103 HydrophobicContact CB-CD1 3.62Å
70	K	87.9	Confident	86.9	Confident	22 Å²	22	29.1 Å²	29.1	10%	0.096	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-47	177.5	-60.4	-63.4	-171.9	-169.4	0	111.2	A39 D61 E65 A66 P67 L68 A72 K73 V74	A39-K70 HydrophobicContact CB-CB 4.1Å; D61-K70 WeakPolarHBondContact OD2-CE 3.33Å; D61-K70 IonicContact OD2-NZ 2.68Å; D61-K70 PolarHBondContact OD2-NZ 3.36Å; E65-K70 WeakPolarHBondContact OE2-CD 3.47Å; E65-K70 WeakPolarHBondContact OE2-CE 3.24Å; E65-K70 IonicContact OE2-NZ 2.74Å; E65-K70 PolarHBondContact OE2-NZ 2.96Å; A66-K70 PolarHBondContact O-N 3.39Å; P67-K70 WeakPolarHBondContact O-CB 3.5Å; P67-K70 PolarHBondContact O-N 3.35Å; P67-K70 VanDerWaalsContact O-N 3.12Å; L68-K70 VanDerWaalsContact C-N 3.34Å; K70-A72 VanDerWaalsContact C-N 3.29Å; K70-A72 PolarHBondContact O-N 2.96Å; K70-K73 PolarHBondContact O-N 3.39Å; K70-V74 WeakPolarHBondContact O-CG2 3.02Å; K70-V74 PolarHBondContact O-N 3.44Å; K70-V74 VanDerWaalsContact O-N 3.09Å
71	A	89.4	Confident	87.1	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-40.2	176.3	0	0	0	0	0	112.1	A39 P67 L68 V74 G75 S76 C79 L80 L83	A39-A71 HydrophobicContact CB-CB 4.17Å; P67-A71 PolarHBondContact O-N 3.16Å; L68-A71 PolarHBondContact O-N 3.47Å; A71-V74 PolarHBondContact O-N 2.92Å; A71-G75 PolarHBondContact O-N 3.4Å; A71-S76 PolarHBondContact O-N 3.09Å; A71-S76 VanDerWaalsContact O-N 3.09Å; A71-C79 HydrophobicContact CB-CB 3.83Å; A71-L80 HydrophobicContact CB-CD2 3.71Å; A71-L80 HydrophobicContact CB-CG 3.97Å; A71-L83 HydrophobicContact CB-CD1 4.15Å
72	A	90.3	Very high	87.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-39.3	175.9	0	0	0	0	0	113.5	L68 H69 K70 V74 G75 L80 A100 A104 L116	L68-A72 WeakPolarHBondContact O-CB 3.32Å; L68-A72 PolarHBondContact O-N 3.02Å; H69-A72 PolarHBondContact O-N 3Å; K70-A72 VanDerWaalsContact C-N 3.29Å; K70-A72 PolarHBondContact O-N 2.96Å; A72-V74 VanDerWaalsContact C-N 3.3Å; A72-V74 PolarHBondContact O-N 2.91Å; A72-G75 PolarHBondContact O-N 3.29Å; A72-L80 HydrophobicContact CB-CD2 4.35Å; A72-A100 HydrophobicContact CB-CB 4.05Å; A72-A100 WeakPolarHBondContact CB-O 3.26Å; A72-A104 HydrophobicContact CB-CB 4.18Å; A72-L116 HydrophobicContact CB-CD1 4.36Å
73	K	86.9	Confident	87.9	Confident	75 Å²	75	27.2 Å²	27.2	33%	0.326	15%	0.149	S	C	.	.	H	α-helix	trans	-67.2	-30	176.3	-75.7	170.5	71.5	169.4	0	113.3	E65 H69 K70 L103 F109	E65-K73 VanDerWaalsContact CD-NZ 3.25Å; E65-K73 WeakPolarHBondContact OE1-CD 3.33Å; E65-K73 IonicContact OE1-NZ 2.7Å; E65-K73 PolarHBondContact OE1-NZ 3.41Å; E65-K73 IonicContact OE2-NZ 2.92Å; E65-K73 PolarHBondContact OE2-NZ 2.99Å; H69-K73 WeakPolarHBondContact O-CG 3.24Å; H69-K73 PolarHBondContact O-N 3.33Å; K70-K73 PolarHBondContact O-N 3.39Å; K73-L103 HydrophobicContact CD-CD1 4.03Å; K73-L103 HydrophobicContact CG-CB 4.06Å; K73-L103 HydrophobicContact CG-CD1 4.06Å; K73-L103 HydrophobicContact CG-CD2 4.49Å; K73-L103 HydrophobicContact CG-CG 4.44Å; K73-F109 VanDerWaalsContact O-CE2 3.24Å; K73-F109 WeakPolarHBondContact O-CE2 3.25Å
74	V	86.1	Confident	88.2	Confident	61 Å²	61	23.8 Å²	23.8	37%	0.37	13%	0.131	S	C	.	.	H	α-helix	trans	-83.7	-23.9	176.4	176.9	0	0	0	0	111.3	G40 K70 A71 A72 F109	G40-V74 WeakPolarHBondContact O-CG2 3.38Å; K70-V74 WeakPolarHBondContact O-CG2 3.02Å; K70-V74 PolarHBondContact O-N 3.44Å; K70-V74 VanDerWaalsContact O-N 3.09Å; A71-V74 PolarHBondContact O-N 2.92Å; A72-V74 VanDerWaalsContact C-N 3.3Å; A72-V74 PolarHBondContact O-N 2.91Å; V74-F109 WeakPolarHBondContact O-CZ 3.49Å
75	G	86.8	Confident	88.3	Confident	22 Å²	22	27.6 Å²	27.6	23%	0.227	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	24.4	-174	0	0	0	0	0	113.4	A71 A72 L77 F109 C112	A71-G75 PolarHBondContact O-N 3.4Å; A72-G75 PolarHBondContact O-N 3.29Å; G75-L77 PolarHBondContact O-N 2.89Å; G75-F109 VanDerWaalsContact CA-CG 3.47Å; G75-C112 PolarHBondContact O-SG 2.9Å; G75-C112 VanDerWaalsContact O-SG 3.35Å
76	S	87.4	Confident	88.2	Confident	18 Å²	18	29.4 Å²	29.4	13%	0.126	18%	0.176	C	C	.	.			trans	-83.8	98.2	179.5	-177.2	0	0	0	0	110.8	A71 C79 L80	A71-S76 PolarHBondContact O-N 3.09Å; A71-S76 VanDerWaalsContact O-N 3.09Å; S76-C79 PolarHBondContact O-N 3.42Å; S76-C79 WeakPolarHBondContact OG-CB 3.21Å; S76-C79 PolarHBondContact OG-N 3.17Å; S76-C79 PolarHBondContact OG-SG 2.68Å; S76-L80 WeakPolarHBondContact O-CG 3.32Å; S76-L80 PolarHBondContact O-N 2.7Å
77	L	88.3	Confident	87.8	Confident	64 Å²	64	36 Å²	36	34%	0.335	21%	0.211	S	C	.	.	H	α-helix	trans	-66.1	-38.5	179.8	-163.7	139.3	0	0	0	111.9	G75 C79 L80 S81 F115	G75-L77 PolarHBondContact O-N 2.89Å; L77-C79 PolarHBondContact O-N 3.16Å; L77-L80 PolarHBondContact O-N 2.92Å; L77-S81 WeakPolarHBondContact O-CB 3.35Å; L77-S81 PolarHBondContact O-N 3.09Å; L77-F115 HydrophobicContact CD1-CB 4.37Å
78	E	88.1	Confident	87.7	Confident	122 Å²	122	36.2 Å²	36.2	57%	0.57	21%	0.213	S	C	*	.	H	α-helix	trans	-55.9	-49.6	172.2	-90.5	65.5	-161.2	0	0	112	A44 L80 S81 L82	A44-E78 HydrophobicContact CB-CB 3.93Å; E78-L80 VanDerWaalsContact C-N 3.35Å; E78-L80 PolarHBondContact O-N 3.28Å; E78-S81 PolarHBondContact O-N 3.2Å; E78-S81 PolarHBondContact O-OG 2.97Å; E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.74Å
79	C	87.3	Confident	87.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-40.8	178.4	-69.2	0	0	0	0	111.8	A71 S76 L77 S81 L82 L83	A71-C79 HydrophobicContact CB-CB 3.83Å; S76-C79 PolarHBondContact O-N 3.42Å; S76-C79 WeakPolarHBondContact OG-CB 3.21Å; S76-C79 PolarHBondContact OG-N 3.17Å; S76-C79 PolarHBondContact OG-SG 2.68Å; L77-C79 PolarHBondContact O-N 3.16Å; C79-S81 VanDerWaalsContact C-N 3.33Å; C79-S81 PolarHBondContact O-N 3.13Å; C79-L82 PolarHBondContact O-N 3.33Å; C79-L83 WeakPolarHBondContact O-CB 3.49Å; C79-L83 VanDerWaalsContact O-CG 3.28Å; C79-L83 WeakPolarHBondContact O-CG 3.43Å; C79-L83 PolarHBondContact O-N 3.26Å
80	L	89.9	Confident	87.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-43.9	174.1	-71.7	175.7	0	0	0	111.5	L68 A71 A72 S76 L77 E78 L82 L83 V84 C112 F115 L116	L68-L80 HydrophobicContact CD1-CD2 3.54Å; L68-L80 HydrophobicContact CG-CD2 3.97Å; A71-L80 HydrophobicContact CB-CD2 3.71Å; A71-L80 HydrophobicContact CB-CG 3.97Å; A72-L80 HydrophobicContact CB-CD2 4.35Å; S76-L80 WeakPolarHBondContact O-CG 3.32Å; S76-L80 PolarHBondContact O-N 2.7Å; L77-L80 PolarHBondContact O-N 2.92Å; E78-L80 VanDerWaalsContact C-N 3.35Å; E78-L80 PolarHBondContact O-N 3.28Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 2.98Å; L80-L83 PolarHBondContact O-N 3.47Å; L80-V84 WeakPolarHBondContact O-CB 3.28Å; L80-V84 VanDerWaalsContact O-CG2 3.24Å; L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 3.41Å; L80-C112 HydrophobicContact CD1-CB 3.56Å; L80-F115 HydrophobicContact CB-CD1 4.26Å; L80-F115 HydrophobicContact CB-CE1 4.21Å; L80-L116 HydrophobicContact CD1-CD1 4.32Å; L80-L116 HydrophobicContact CD1-CG 4.39Å; L80-L116 HydrophobicContact CD2-CD1 4.31Å; L80-L116 HydrophobicContact CD2-CD2 4.21Å
81	S	89.4	Confident	87.2	Confident	43 Å²	43	45 Å²	45	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-40.4	179.8	78.2	0	0	0	0	112	L77 E78 C79 A85	L77-S81 WeakPolarHBondContact O-CB 3.35Å; L77-S81 PolarHBondContact O-N 3.09Å; E78-S81 PolarHBondContact O-N 3.2Å; E78-S81 PolarHBondContact O-OG 2.97Å; C79-S81 VanDerWaalsContact C-N 3.33Å; C79-S81 PolarHBondContact O-N 3.13Å; S81-A85 WeakPolarHBondContact O-CB 3.41Å; S81-A85 PolarHBondContact O-N 3.12Å
82	L	88.2	Confident	87.1	Confident	40 Å²	40	46.5 Å²	46.5	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-43.4	177.9	-74.2	175.8	0	0	0	112	A44 L47 L48 L51 E78 C79 L80 A85 S86	A44-L82 HydrophobicContact CB-CD1 3.68Å; A44-L82 VanDerWaalsContact O-CD1 3.25Å; A44-L82 WeakPolarHBondContact O-CD1 3.4Å; L47-L82 HydrophobicContact CD2-CB 3.66Å; L47-L82 HydrophobicContact CD2-CD1 4.12Å; L48-L82 HydrophobicContact CB-CD1 4.37Å; L48-L82 HydrophobicContact CD1-CD2 4.2Å; L51-L82 HydrophobicContact CD1-CB 4.42Å; E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.74Å; C79-L82 PolarHBondContact O-N 3.33Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 2.98Å; L82-A85 PolarHBondContact O-N 3.4Å; L82-S86 WeakPolarHBondContact O-CB 3.46Å; L82-S86 PolarHBondContact O-N 3.11Å; L82-S86 VanDerWaalsContact O-N 3.12Å; L82-S86 PolarHBondContact O-OG 3.47Å
83	L	87.6	Confident	87.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-44.8	177.8	-72.4	170.9	0	0	0	111.3	A39 L47 L57 P67 L68 A71 C79 L80 S86 A88	A39-L83 HydrophobicContact CB-CD1 4.42Å; L47-L83 HydrophobicContact CD1-CD1 4.33Å; L47-L83 HydrophobicContact CD1-CD2 4.1Å; L47-L83 HydrophobicContact CD1-CG 4.19Å; L47-L83 HydrophobicContact CD2-CD2 3.99Å; L47-L83 HydrophobicContact CD2-CG 3.95Å; L47-L83 HydrophobicContact CG-CD2 4.42Å; L57-L83 HydrophobicContact CB-CD2 4.44Å; L57-L83 HydrophobicContact CD1-CD2 4.37Å; L57-L83 HydrophobicContact CD2-CD2 3.83Å; L57-L83 HydrophobicContact CG-CD2 4.43Å; P67-L83 HydrophobicContact CB-CD1 4.16Å; P67-L83 HydrophobicContact CB-CD2 4.23Å; L68-L83 HydrophobicContact CB-CD1 4.29Å; L68-L83 HydrophobicContact CD1-CB 3.72Å; L68-L83 HydrophobicContact CD1-CD1 3.93Å; L68-L83 HydrophobicContact CD1-CG 4.49Å; A71-L83 HydrophobicContact CB-CD1 4.15Å; C79-L83 WeakPolarHBondContact O-CB 3.49Å; C79-L83 VanDerWaalsContact O-CG 3.28Å; C79-L83 WeakPolarHBondContact O-CG 3.43Å; C79-L83 PolarHBondContact O-N 3.26Å; L80-L83 PolarHBondContact O-N 3.47Å; L83-S86 CarbonylContact O-C 3.51Å; L83-S86 PolarHBondContact O-N 3.42Å; L83-S86 VanDerWaalsContact O-N 3.13Å; L83-A88 HydrophobicContact CB-CB 4.07Å; L83-A88 WeakPolarHBondContact O-CB 3.4Å; L83-A88 PolarHBondContact O-N 3.09Å; L83-A88 VanDerWaalsContact O-N 3.09Å
84	V	87.6	Confident	87.2	Confident	17 Å²	17	46.3 Å²	46.3	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-42.7	176.1	168	0	0	0	0	111.4	L68 L80 S86 D87 I90 F115 I119	L68-V84 HydrophobicContact CD1-CG2 4.37Å; L80-V84 WeakPolarHBondContact O-CB 3.28Å; L80-V84 VanDerWaalsContact O-CG2 3.24Å; L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 3.41Å; V84-S86 PolarHBondContact O-N 2.97Å; V84-D87 PolarHBondContact O-N 3.37Å; V84-D87 VanDerWaalsContact O-N 3.16Å; V84-I90 HydrophobicContact CG2-CG2 4.12Å; V84-F115 HydrophobicContact CG2-CE1 4.17Å; V84-I119 HydrophobicContact CG1-CB 4.4Å; V84-I119 HydrophobicContact CG1-CD1 4.02Å; V84-I119 HydrophobicContact CG1-CG1 4.01Å; V84-I119 HydrophobicContact CG1-CG2 3.55Å; V84-I119 HydrophobicContact CG2-CG2 4.4Å
85	A	86.8	Confident	87.4	Confident	82 Å²	82	50.5 Å²	50.5	68%	0.678	29%	0.285	S	S	*	.	H	α-helix	trans	-63.8	-18.8	176.3	0	0	0	0	0	113.1	S81 L82	S81-A85 WeakPolarHBondContact O-CB 3.41Å; S81-A85 PolarHBondContact O-N 3.12Å; L82-A85 PolarHBondContact O-N 3.4Å
86	S	84.1	Confident	87.4	Confident	47 Å²	47	55.5 Å²	55.5	33%	0.329	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	20.6	179	-51.9	0	0	0	0	112.9	L51 L57 L82 L83 V84 A88	L51-S86 VanDerWaalsContact CD1-OG 3.31Å; L51-S86 WeakPolarHBondContact CD1-OG 3.21Å; L51-S86 VanDerWaalsContact CD2-CB 3.45Å; L51-S86 WeakPolarHBondContact CD2-OG 3.48Å; L57-S86 VanDerWaalsContact CD1-CB 3.47Å; L82-S86 WeakPolarHBondContact O-CB 3.46Å; L82-S86 PolarHBondContact O-N 3.11Å; L82-S86 VanDerWaalsContact O-N 3.12Å; L82-S86 PolarHBondContact O-OG 3.47Å; L83-S86 CarbonylContact O-C 3.51Å; L83-S86 PolarHBondContact O-N 3.42Å; L83-S86 VanDerWaalsContact O-N 3.13Å; V84-S86 PolarHBondContact O-N 2.97Å; S86-A88 VanDerWaalsContact C-N 3.28Å; S86-A88 PolarHBondContact O-N 3.35Å
87	D	82.4	Confident	87.5	Confident	139 Å²	139	57.1 Å²	57.1	74%	0.743	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	32.3	178.6	-67.6	-47.4	0	0	0	114.5	V84	V84-D87 PolarHBondContact O-N 3.37Å; V84-D87 VanDerWaalsContact O-N 3.16Å
88	A	85.9	Confident	87.6	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.033	32%	0.323	C	S	.	.			trans	-62.9	141.4	170.5	0	0	0	0	0	111.2	L57 L83 S86 I90	L57-A88 HydrophobicContact CB-CB 4.02Å; L57-A88 HydrophobicContact CD1-CB 4.21Å; L83-A88 HydrophobicContact CB-CB 4.07Å; L83-A88 WeakPolarHBondContact O-CB 3.4Å; L83-A88 PolarHBondContact O-N 3.09Å; L83-A88 VanDerWaalsContact O-N 3.09Å; S86-A88 VanDerWaalsContact C-N 3.28Å; S86-A88 PolarHBondContact O-N 3.35Å; A88-I90 PolarHBondContact O-N 3.25Å
89	Q	85.9	Confident	87.8	Confident	108 Å²	108	51.8 Å²	51.8	51%	0.505	30%	0.301	S	S	.	.			trans	-72.6	112.3	179.6	-71.8	179.8	-21.7	0	0	111	N58 L92	N58-Q89 WeakPolarHBondContact OD1-CB 3.18Å; N58-Q89 PolarHBondContact OD1-N 2.66Å; Q89-L92 HydrophobicContact CB-CD1 3.79Å; Q89-L92 HydrophobicContact CB-CD2 4.39Å; Q89-L92 HydrophobicContact CB-CG 3.67Å
90	I	86.8	Confident	87.9	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.072	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-23	-178.4	64.7	175.2	0	0	0	114	L68 V84 A88 L92 I119 K120	L68-I90 HydrophobicContact CD2-CB 4.04Å; L68-I90 HydrophobicContact CD2-CG2 3.84Å; V84-I90 HydrophobicContact CG2-CG2 4.12Å; A88-I90 PolarHBondContact O-N 3.25Å; I90-L92 VanDerWaalsContact C-N 3.31Å; I90-I119 HydrophobicContact CD1-CG2 4.22Å; I90-K120 HydrophobicContact CD1-CB 3.75Å; I90-K120 HydrophobicContact CD1-CG 4.12Å
91	D	86	Confident	88	Confident	90 Å²	90	53.8 Å²	53.8	48%	0.481	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6	-176.7	-69.3	-40.3	0	0	0	113.4	C93 K120	D91-C93 PolarHBondContact O-N 2.68Å; D91-K120 WeakPolarHBondContact OD1-CE 3.44Å; D91-K120 IonicContact OD1-NZ 2.71Å; D91-K120 PolarHBondContact OD1-NZ 2.94Å
92	L	87.9	Confident	88.1	Confident	31 Å²	31	55.2 Å²	55.2	16%	0.162	31%	0.314	C	S	.	.			trans	-61.3	139.5	174.2	-71.7	174	0	0	0	110.1	N58 A66 H69 Q89 I90	N58-L92 HydrophobicContact CB-CD1 4.12Å; A66-L92 HydrophobicContact CB-CD1 3.8Å; H69-L92 PolarHBondContact CE1-O 3.08Å; H69-L92 PolarHBondContact NE2-O 3.38Å; Q89-L92 HydrophobicContact CB-CD1 3.79Å; Q89-L92 HydrophobicContact CB-CD2 4.39Å; Q89-L92 HydrophobicContact CB-CG 3.67Å; I90-L92 VanDerWaalsContact C-N 3.31Å
93	C	90.9	Very high	88.1	Confident	60 Å²	60	53.6 Å²	53.6	41%	0.405	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-110.6	140.1	174.5	-63	0	0	0	0	109.3	Q60 D91 Q98	Q60-C93 PolarHBondContact NE2-O 3.19Å; D91-C93 PolarHBondContact O-N 2.68Å; C93-Q98 WeakPolarHBondContact CA-O 3.45Å
94	N	88.6	Confident	88.3	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.053	31%	0.306	C	S	.	.			trans	-74.2	179.4	169.3	73.2	6.3	0	0	0	111.6	G64 E65 N96 G97 Q98	G64-N94 WeakPolarHBondContact O-CA 3.44Å; E65-N94 HydrophobicContact CG-CB 3.91Å; N94-N96 PolarHBondContact O-N 3.37Å; N94-N96 VanDerWaalsContact O-N 3.09Å; N94-N96 WeakPolarHBondContact OD1-CA 3.37Å; N94-N96 WeakPolarHBondContact OD1-CB 3.5Å; N94-N96 PolarHBondContact OD1-N 3.48Å; N94-G97 PolarHBondContact O-N 2.81Å; N94-G97 PolarHBondContact OD1-N 3.22Å; N94-Q98 PolarHBondContact N-O 2.9Å; N94-Q98 WeakPolarHBondContact OD1-CB 3.34Å; N94-Q98 PolarHBondContact OD1-N 3.06Å; N94-Q98 PolarHBondContact OD1-O 3.46Å
95	K	89	Confident	88.5	Confident	149 Å²	149	59.1 Å²	59.1	65%	0.648	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.6	179.2	-73.7	-178.6	-178.4	-176.6	0	114.2	V62 L63 G97	V62-K95 WeakPolarHBondContact O-CD 3.32Å; V62-K95 WeakPolarHBondContact O-CE 3.33Å; V62-K95 PolarHBondContact O-NZ 2.99Å; L63-K95 VanDerWaalsContact O-CB 3.32Å; L63-K95 WeakPolarHBondContact O-CB 3.44Å; L63-K95 WeakPolarHBondContact O-CG 3.08Å; L63-K95 PolarHBondContact O-N 3.28Å; K95-G97 VanDerWaalsContact C-N 3.3Å
96	N	87.3	Confident	88.6	Confident	127 Å²	127	59 Å²	59	68%	0.679	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	0.8	175.6	-60.3	-13.2	0	0	0	112.5	N94 Q98	N94-N96 PolarHBondContact O-N 3.37Å; N94-N96 VanDerWaalsContact O-N 3.09Å; N94-N96 WeakPolarHBondContact OD1-CA 3.37Å; N94-N96 WeakPolarHBondContact OD1-CB 3.5Å; N94-N96 PolarHBondContact OD1-N 3.48Å; N96-Q98 VanDerWaalsContact C-N 3.3Å; N96-Q98 HydrophobicContact CB-CG 4.05Å; N96-Q98 PolarHBondContact ND2-OE1 3.34Å
97	G	89.4	Confident	88.8	Confident	53 Å²	53	59.3 Å²	59.3	55%	0.546	32%	0.321	S	S	.	.	S	Bend	trans	74.3	19.3	-175.3	0	0	0	0	0	113.7	N94 K95	N94-G97 PolarHBondContact O-N 2.81Å; N94-G97 PolarHBondContact OD1-N 3.22Å; K95-G97 VanDerWaalsContact C-N 3.3Å
98	Q	89.9	Confident	89.2	Confident	56 Å²	56	55.3 Å²	55.3	26%	0.262	31%	0.312	S	S	.	.			trans	-98.3	136.3	179.9	-56.2	176.4	-81.9	0	0	110.2	H69 C93 N94 N96 D102 L103	H69-Q98 PolarHBondContact NE2-O 3.48Å; C93-Q98 WeakPolarHBondContact CA-O 3.45Å; N94-Q98 PolarHBondContact N-O 2.9Å; N94-Q98 WeakPolarHBondContact OD1-CB 3.34Å; N94-Q98 PolarHBondContact OD1-N 3.06Å; N94-Q98 PolarHBondContact OD1-O 3.46Å; N96-Q98 VanDerWaalsContact C-N 3.3Å; N96-Q98 HydrophobicContact CB-CG 4.05Å; N96-Q98 PolarHBondContact ND2-OE1 3.34Å; Q98-D102 HydrophobicContact CB-CB 4.13Å; Q98-L103 HydrophobicContact CB-CD2 4.24Å; Q98-L103 HydrophobicContact CB-CG 4.33Å
99	T	92.1	Very high	89.5	Confident	18 Å²	18	58.7 Å²	58.7	11%	0.11	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-83.4	168.4	171.4	64.8	0	0	0	0	111.4	E101 D102 L103	T99-E101 PolarHBondContact O-N 3.12Å; T99-E101 PolarHBondContact OG1-N 3.3Å; T99-D102 WeakPolarHBondContact CB-OD2 3.25Å; T99-D102 PolarHBondContact N-OD2 2.76Å; T99-D102 PolarHBondContact O-N 3Å; T99-D102 VanDerWaalsContact OG1-CG 3.22Å; T99-D102 PolarHBondContact OG1-N 3.47Å; T99-D102 PolarHBondContact OG1-OD2 3.4Å; T99-L103 WeakPolarHBondContact O-CG 3.34Å; T99-L103 PolarHBondContact O-N 2.7Å; T99-L103 VanDerWaalsContact O-N 3.07Å
100	A	90.1	Very high	89.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-57.6	-33.5	172.5	0	0	0	0	0	112.4	L68 H69 A72 L103 A104 L116	L68-A100 HydrophobicContact CB-CB 4.48Å; L68-A100 HydrophobicContact CD2-CB 3.91Å; L68-A100 HydrophobicContact CG-CB 3.96Å; H69-A100 PolarHBondContact CD2-N 3.12Å; A72-A100 HydrophobicContact CB-CB 4.05Å; A72-A100 WeakPolarHBondContact CB-O 3.26Å; A100-L103 PolarHBondContact O-N 2.91Å; A100-A104 PolarHBondContact O-N 3.25Å; A100-L116 HydrophobicContact CB-CD1 3.89Å
101	E	92.3	Very high	89.8	Confident	41 Å²	41	60.3 Å²	60.3	19%	0.192	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-46.8	175.3	-179.6	-179.8	178.1	0	0	111.7	T99 L103 A104 W105 A113 L116 T117	T99-E101 PolarHBondContact O-N 3.12Å; T99-E101 PolarHBondContact OG1-N 3.3Å; E101-L103 PolarHBondContact O-N 3.37Å; E101-A104 PolarHBondContact O-N 3.29Å; E101-A104 VanDerWaalsContact O-N 3.16Å; E101-W105 VanDerWaalsContact O-CD1 3.3Å; E101-W105 PolarHBondContact O-N 2.78Å; E101-A113 HydrophobicContact CG-CB 4.47Å; E101-L116 HydrophobicContact CB-CB 4.33Å; E101-L116 HydrophobicContact CB-CD1 4.47Å; E101-T117 VanDerWaalsContact CD-OG1 3.26Å; E101-T117 PolarHBondContact OE1-OG1 3.2Å
102	D	90.6	Very high	90.1	Very high	72 Å²	72	56.2 Å²	56.2	39%	0.385	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-39.2	178.2	-60	-49.3	0	0	0	111.3	Q98 T99 W105 S106	Q98-D102 HydrophobicContact CB-CB 4.13Å; T99-D102 WeakPolarHBondContact CB-OD2 3.25Å; T99-D102 PolarHBondContact N-OD2 2.76Å; T99-D102 PolarHBondContact O-N 3Å; T99-D102 VanDerWaalsContact OG1-CG 3.22Å; T99-D102 PolarHBondContact OG1-N 3.47Å; T99-D102 PolarHBondContact OG1-OD2 3.4Å; D102-W105 PolarHBondContact O-N 3.47Å; D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.42Å; D102-S106 PolarHBondContact O-OG 2.85Å
103	L	89.4	Confident	90.2	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-45.7	176.1	-67.6	175.7	0	0	0	111.5	H69 K73 Q98 T99 A100 E101 W105 S106 C107	H69-L103 HydrophobicContact CB-CD1 3.62Å; K73-L103 HydrophobicContact CD-CD1 4.03Å; K73-L103 HydrophobicContact CG-CB 4.06Å; K73-L103 HydrophobicContact CG-CD1 4.06Å; K73-L103 HydrophobicContact CG-CD2 4.49Å; K73-L103 HydrophobicContact CG-CG 4.44Å; Q98-L103 HydrophobicContact CB-CD2 4.24Å; Q98-L103 HydrophobicContact CB-CG 4.33Å; T99-L103 WeakPolarHBondContact O-CG 3.34Å; T99-L103 PolarHBondContact O-N 2.7Å; T99-L103 VanDerWaalsContact O-N 3.07Å; A100-L103 PolarHBondContact O-N 2.91Å; E101-L103 PolarHBondContact O-N 3.37Å; L103-W105 VanDerWaalsContact C-N 3.3Å; L103-W105 PolarHBondContact O-N 3.39Å; L103-S106 WeakPolarHBondContact CA-OG 3.43Å; L103-S106 PolarHBondContact O-N 3.41Å; L103-S106 VanDerWaalsContact O-N 3.13Å; L103-S106 PolarHBondContact O-OG 3.19Å; L103-C107 WeakPolarHBondContact O-CB 3.44Å; L103-C107 PolarHBondContact O-N 3.41Å; L103-C107 PolarHBondContact O-SG 2.95Å; L103-C107 VanDerWaalsContact O-SG 3.33Å
104	A	91.1	Very high	90.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-41.5	176.6	0	0	0	0	0	112	A72 A100 E101 G108 F109 C112 A113	A72-A104 HydrophobicContact CB-CB 4.18Å; A100-A104 PolarHBondContact O-N 3.25Å; E101-A104 PolarHBondContact O-N 3.29Å; E101-A104 VanDerWaalsContact O-N 3.16Å; A104-G108 PolarHBondContact O-N 2.99Å; A104-F109 PolarHBondContact O-N 3.32Å; A104-C112 HydrophobicContact CB-CB 4.13Å; A104-A113 HydrophobicContact CB-CB 3.79Å
105	W	92	Very high	90.4	Very high	133 Å²	133	59.5 Å²	59.5	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-62.7	-47.7	172.7	-78.9	118.2	0	0	0	112.3	E101 D102 L103 C107 G108 P110 A113	E101-W105 VanDerWaalsContact O-CD1 3.3Å; E101-W105 PolarHBondContact O-N 2.78Å; D102-W105 PolarHBondContact O-N 3.47Å; L103-W105 VanDerWaalsContact C-N 3.3Å; L103-W105 PolarHBondContact O-N 3.39Å; W105-C107 VanDerWaalsContact C-N 3.3Å; W105-C107 PolarHBondContact O-N 3Å; W105-G108 PolarHBondContact O-N 3.17Å; W105-P110 HydrophobicContact CE3-CB 4.49Å; W105-P110 HydrophobicContact CH2-CB 4.28Å; W105-P110 HydrophobicContact CZ3-CB 3.86Å; W105-A113 HydrophobicContact CD2-CB 3.79Å; W105-A113 HydrophobicContact CG-CB 3.92Å; W105-A113 HydrophobicContact CZ2-CB 4.05Å
106	S	89.8	Confident	90.4	Very high	79 Å²	79	52.7 Å²	52.7	55%	0.552	30%	0.296	S	S	*	.	H	α-helix	trans	-66.8	-30.2	-177.8	74.4	0	0	0	0	113.6	D102 L103	D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.42Å; D102-S106 PolarHBondContact O-OG 2.85Å; L103-S106 WeakPolarHBondContact CA-OG 3.43Å; L103-S106 PolarHBondContact O-N 3.41Å; L103-S106 VanDerWaalsContact O-N 3.13Å; L103-S106 PolarHBondContact O-OG 3.19Å
107	C	86.9	Confident	90.5	Very high	54 Å²	54	48.8 Å²	48.8	37%	0.365	28%	0.277	S	S	.	.	H	α-helix	trans	-87.1	-6.1	179.3	-67.6	0	0	0	0	113.2	L103 W105 F109	L103-C107 WeakPolarHBondContact O-CB 3.44Å; L103-C107 PolarHBondContact O-N 3.41Å; L103-C107 PolarHBondContact O-SG 2.95Å; L103-C107 VanDerWaalsContact O-SG 3.33Å; W105-C107 VanDerWaalsContact C-N 3.3Å; W105-C107 PolarHBondContact O-N 3Å; C107-F109 HydrophobicContact CB-CD2 3.62Å; C107-F109 HydrophobicContact CB-CE2 3.78Å
108	G	90.9	Very high	90.4	Very high	54 Å²	54	48.9 Å²	48.9	56%	0.557	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	25.9	177.5	0	0	0	0	0	114.6	A104 W105 P110	A104-G108 PolarHBondContact O-N 2.99Å; W105-G108 PolarHBondContact O-N 3.17Å; G108-P110 WeakPolarHBondContact O-CD 3.12Å
109	F	91.9	Very high	90.2	Very high	76 Å²	76	47.7 Å²	47.7	33%	0.333	27%	0.267	S	S	.	.			trans	-109	73.2	177.1	-59.8	-68.4	0	0	0	111.2	K73 V74 G75 A104 C107 D111 C112 A113	K73-F109 VanDerWaalsContact O-CE2 3.24Å; K73-F109 WeakPolarHBondContact O-CE2 3.25Å; V74-F109 WeakPolarHBondContact O-CZ 3.49Å; G75-F109 VanDerWaalsContact CA-CG 3.47Å; A104-F109 PolarHBondContact O-N 3.32Å; C107-F109 HydrophobicContact CB-CD2 3.62Å; C107-F109 HydrophobicContact CB-CE2 3.78Å; F109-D111 VanDerWaalsContact C-N 3.27Å; F109-D111 PolarHBondContact O-N 3.42Å; F109-C112 HydrophobicContact CB-CB 4.09Å; F109-C112 PolarHBondContact O-N 2.93Å; F109-A113 PolarHBondContact O-N 2.96Å; F109-A113 VanDerWaalsContact O-N 3.09Å
110	P	89.3	Confident	89.9	Confident	48 Å²	48	50.2 Å²	50.2	31%	0.312	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-27.3	-173.7	28.5	-36.8	0	0	0	113.1	W105 G108 A113 K114	W105-P110 HydrophobicContact CE3-CB 4.49Å; W105-P110 HydrophobicContact CH2-CB 4.28Å; W105-P110 HydrophobicContact CZ3-CB 3.86Å; G108-P110 WeakPolarHBondContact O-CD 3.12Å; P110-A113 PolarHBondContact O-N 3.23Å; P110-K114 WeakPolarHBondContact O-CB 3.45Å; P110-K114 WeakPolarHBondContact O-CG 3.44Å; P110-K114 PolarHBondContact O-N 3.39Å
111	D	91.5	Very high	89.3	Confident	107 Å²	107	53.9 Å²	53.9	57%	0.572	30%	0.301	S	S	*	.	H	α-helix	trans	-70.5	-39.1	178.5	-61.8	-37	0	0	0	111.4	F109 F115	F109-D111 VanDerWaalsContact C-N 3.27Å; F109-D111 PolarHBondContact O-N 3.42Å; D111-F115 VanDerWaalsContact O-CB 3.32Å; D111-F115 WeakPolarHBondContact O-CB 3.35Å; D111-F115 PolarHBondContact O-N 2.92Å
112	C	90.8	Very high	88.2	Confident	4 Å²	4	59 Å²	59	3%	0.027	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-42.2	171.6	-71.2	0	0	0	0	111.6	G75 L80 A104 F109 F115 L116	G75-C112 PolarHBondContact O-SG 2.9Å; G75-C112 VanDerWaalsContact O-SG 3.35Å; L80-C112 HydrophobicContact CD1-CB 3.56Å; A104-C112 HydrophobicContact CB-CB 4.13Å; F109-C112 HydrophobicContact CB-CB 4.09Å; F109-C112 PolarHBondContact O-N 2.93Å; C112-F115 WeakPolarHBondContact O-CB 2.92Å; C112-F115 PolarHBondContact O-N 2.78Å; C112-L116 WeakPolarHBondContact O-CG 3.44Å; C112-L116 PolarHBondContact O-N 3.49Å
113	A	91	Very high	87	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-51.5	177.2	0	0	0	0	0	111.3	E101 A104 W105 F109 P110 F115 L116 T117	E101-A113 HydrophobicContact CG-CB 4.47Å; A104-A113 HydrophobicContact CB-CB 3.79Å; W105-A113 HydrophobicContact CD2-CB 3.79Å; W105-A113 HydrophobicContact CG-CB 3.92Å; W105-A113 HydrophobicContact CZ2-CB 4.05Å; F109-A113 PolarHBondContact O-N 2.96Å; F109-A113 VanDerWaalsContact O-N 3.09Å; P110-A113 PolarHBondContact O-N 3.23Å; A113-F115 VanDerWaalsContact C-N 3.28Å; A113-F115 PolarHBondContact O-N 3.41Å; A113-L116 WeakPolarHBondContact O-CB 3.24Å; A113-L116 PolarHBondContact O-N 3.46Å; A113-L116 VanDerWaalsContact O-N 3.12Å; A113-T117 PolarHBondContact O-N 2.97Å; A113-T117 PolarHBondContact O-OG1 3.26Å
114	K	91.4	Very high	85.1	Confident	118 Å²	118	64.7 Å²	64.7	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-58.3	-39.3	176.3	-72.4	168.7	-171.1	167	0	112.5	P110 T117 A118	P110-K114 WeakPolarHBondContact O-CB 3.45Å; P110-K114 WeakPolarHBondContact O-CG 3.44Å; P110-K114 PolarHBondContact O-N 3.39Å; K114-T117 PolarHBondContact O-N 3.21Å; K114-A118 VanDerWaalsContact O-CB 3.31Å; K114-A118 WeakPolarHBondContact O-CB 3.46Å; K114-A118 PolarHBondContact O-N 2.88Å
115	F	91.3	Very high	83.2	Confident	52 Å²	52	72.5 Å²	72.5	23%	0.228	40%	0.397	C	S	.	.	H	α-helix	trans	-59.5	-50.8	175.3	178	-97.1	0	0	0	110.5	L77 L80 V84 D111 C112 A113 T117 A118 I119	L77-F115 HydrophobicContact CD1-CB 4.37Å; L80-F115 HydrophobicContact CB-CD1 4.26Å; L80-F115 HydrophobicContact CB-CE1 4.21Å; V84-F115 HydrophobicContact CG2-CE1 4.17Å; D111-F115 VanDerWaalsContact O-CB 3.32Å; D111-F115 WeakPolarHBondContact O-CB 3.35Å; D111-F115 PolarHBondContact O-N 2.92Å; C112-F115 WeakPolarHBondContact O-CB 2.92Å; C112-F115 PolarHBondContact O-N 2.78Å; A113-F115 VanDerWaalsContact C-N 3.28Å; A113-F115 PolarHBondContact O-N 3.41Å; F115-T117 PolarHBondContact O-N 3.41Å; F115-A118 PolarHBondContact O-N 3.27Å; F115-I119 HydrophobicContact CD1-CG1 4.37Å; F115-I119 HydrophobicContact CE1-CG1 4.01Å; F115-I119 HydrophobicContact CE2-CD1 4.36Å; F115-I119 HydrophobicContact CE2-CG1 4.37Å; F115-I119 HydrophobicContact CZ-CD1 4.15Å; F115-I119 HydrophobicContact CZ-CG1 4.01Å; F115-I119 WeakPolarHBondContact O-CG1 3.43Å; F115-I119 PolarHBondContact O-N 3.25Å
116	L	88.9	Confident	80.9	Confident	6 Å²	6	74.8 Å²	74.8	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-60.4	-44.3	177.2	-71.5	170.5	0	0	0	112.3	L68 A72 L80 A100 E101 C112 A113 A118 I119 K120	L68-L116 HydrophobicContact CD1-CD2 4.42Å; L68-L116 HydrophobicContact CD2-CD2 4.2Å; L68-L116 HydrophobicContact CG-CD2 4.48Å; A72-L116 HydrophobicContact CB-CD1 4.36Å; L80-L116 HydrophobicContact CD1-CD1 4.32Å; L80-L116 HydrophobicContact CD1-CG 4.39Å; L80-L116 HydrophobicContact CD2-CD1 4.31Å; L80-L116 HydrophobicContact CD2-CD2 4.21Å; A100-L116 HydrophobicContact CB-CD1 3.89Å; E101-L116 HydrophobicContact CB-CB 4.33Å; E101-L116 HydrophobicContact CB-CD1 4.47Å; C112-L116 WeakPolarHBondContact O-CG 3.44Å; C112-L116 PolarHBondContact O-N 3.49Å; A113-L116 WeakPolarHBondContact O-CB 3.24Å; A113-L116 PolarHBondContact O-N 3.46Å; A113-L116 VanDerWaalsContact O-N 3.12Å; L116-A118 VanDerWaalsContact C-N 3.32Å; L116-A118 PolarHBondContact O-N 3.38Å; L116-I119 PolarHBondContact O-N 3.5Å; L116-K120 WeakPolarHBondContact O-CB 3.09Å; L116-K120 PolarHBondContact O-N 3.2Å
117	T	89.2	Confident	78.6	Confident	46 Å²	46	76.4 Å²	76.4	28%	0.282	42%	0.419	S	S	.	.	H	α-helix	trans	-58.9	-43.7	174.9	-41.5	0	0	0	0	111.3	E101 A113 K114 F115 K120 C121	E101-T117 VanDerWaalsContact CD-OG1 3.26Å; E101-T117 PolarHBondContact OE1-OG1 3.2Å; A113-T117 PolarHBondContact O-N 2.97Å; A113-T117 PolarHBondContact O-OG1 3.26Å; K114-T117 PolarHBondContact O-N 3.21Å; F115-T117 PolarHBondContact O-N 3.41Å; T117-K120 PolarHBondContact O-N 2.66Å; T117-C121 PolarHBondContact O-N 3.22Å; T117-C121 PolarHBondContact O-SG 3.08Å
118	A	89.1	Confident	76.7	Confident	54 Å²	54	79 Å²	79	45%	0.446	44%	0.438	S	S	.	.	H	α-helix	trans	-63.9	-43.6	-179.3	0	0	0	0	0	111.8	K114 F115 L116 C121 M122	K114-A118 VanDerWaalsContact O-CB 3.31Å; K114-A118 WeakPolarHBondContact O-CB 3.46Å; K114-A118 PolarHBondContact O-N 2.88Å; F115-A118 PolarHBondContact O-N 3.27Å; L116-A118 VanDerWaalsContact C-N 3.32Å; L116-A118 PolarHBondContact O-N 3.38Å; A118-C121 PolarHBondContact O-N 3Å; A118-M122 WeakPolarHBondContact O-CG 3.36Å; A118-M122 PolarHBondContact O-N 3.44Å; A118-M122 VanDerWaalsContact O-N 3.09Å
119	I	85.9	Confident	74.2	Confident	31 Å²	31	85.5 Å²	85.5	16%	0.159	45%	0.454	C	S	.	.	H	α-helix	trans	-63.2	-43.5	175.8	-63.4	-61.1	0	0	0	110.8	V84 I90 F115 L116 C121 M122 Q123	V84-I119 HydrophobicContact CG1-CB 4.4Å; V84-I119 HydrophobicContact CG1-CD1 4.02Å; V84-I119 HydrophobicContact CG1-CG1 4.01Å; V84-I119 HydrophobicContact CG1-CG2 3.55Å; V84-I119 HydrophobicContact CG2-CG2 4.4Å; I90-I119 HydrophobicContact CD1-CG2 4.22Å; F115-I119 HydrophobicContact CD1-CG1 4.37Å; F115-I119 HydrophobicContact CE1-CG1 4.01Å; F115-I119 HydrophobicContact CE2-CD1 4.36Å; F115-I119 HydrophobicContact CE2-CG1 4.37Å; F115-I119 HydrophobicContact CZ-CD1 4.15Å; F115-I119 HydrophobicContact CZ-CG1 4.01Å; F115-I119 WeakPolarHBondContact O-CG1 3.43Å; F115-I119 PolarHBondContact O-N 3.25Å; L116-I119 PolarHBondContact O-N 3.5Å; I119-C121 PolarHBondContact O-N 2.81Å; I119-M122 WeakPolarHBondContact O-CB 3.45Å; I119-M122 PolarHBondContact O-N 3.17Å; I119-M122 VanDerWaalsContact O-N 3.11Å; I119-Q123 PolarHBondContact O-N 2.83Å
120	K	83.9	Confident	71.9	Confident	72 Å²	72	88.8 Å²	88.8	31%	0.313	47%	0.47	S	S	.	.	H	α-helix	trans	-58.3	-47.3	176.4	-170.4	165.9	177.4	155.3	0	111.8	I90 D91 L116 T117 M122 Q123 T124	I90-K120 HydrophobicContact CD1-CB 3.75Å; I90-K120 HydrophobicContact CD1-CG 4.12Å; D91-K120 WeakPolarHBondContact OD1-CE 3.44Å; D91-K120 IonicContact OD1-NZ 2.71Å; D91-K120 PolarHBondContact OD1-NZ 2.94Å; L116-K120 WeakPolarHBondContact O-CB 3.09Å; L116-K120 PolarHBondContact O-N 3.2Å; T117-K120 PolarHBondContact O-N 2.66Å; K120-M122 VanDerWaalsContact C-N 3.28Å; K120-M122 PolarHBondContact O-N 3.42Å; K120-Q123 PolarHBondContact O-N 3.42Å; K120-T124 WeakPolarHBondContact O-CG2 3.21Å; K120-T124 PolarHBondContact O-N 3.04Å
121	C	77.6	Confident	69.9	Low	77 Å²	77	91.5 Å²	91.5	52%	0.52	49%	0.49	S	S	.	.	H	α-helix	trans	-57.7	-39.3	174.6	-70.8	0	0	0	0	112.5	T117 A118 I119 T124	T117-C121 PolarHBondContact O-N 3.22Å; T117-C121 PolarHBondContact O-SG 3.08Å; A118-C121 PolarHBondContact O-N 3Å; I119-C121 PolarHBondContact O-N 2.81Å; C121-T124 PolarHBondContact O-OG1 3Å
122	M	69.2	Low	67.6	Low	149 Å²	149	93.3 Å²	93.3	73%	0.734	50%	0.5	S	S	*	.	H	α-helix	trans	-68.3	-36	177	-72.8	-173	146.8	0	0	113.5	A118 I119 K120 M125	A118-M122 WeakPolarHBondContact O-CG 3.36Å; A118-M122 PolarHBondContact O-N 3.44Å; A118-M122 VanDerWaalsContact O-N 3.09Å; I119-M122 WeakPolarHBondContact O-CB 3.45Å; I119-M122 PolarHBondContact O-N 3.17Å; I119-M122 VanDerWaalsContact O-N 3.11Å; K120-M122 VanDerWaalsContact C-N 3.28Å; K120-M122 PolarHBondContact O-N 3.42Å; M122-M125 PolarHBondContact O-N 3.09Å
123	Q	65.1	Low	65.6	Low	88 Å²	88	104.8 Å²	104.8	41%	0.411	54%	0.543	S	S	.	.	H	α-helix	trans	-70.8	-31.1	178.3	-69.3	-178.3	1	0	0	112.5	I119 K120 M125 K126	I119-Q123 PolarHBondContact O-N 2.83Å; K120-Q123 PolarHBondContact O-N 3.42Å; Q123-M125 PolarHBondContact O-N 3.42Å; Q123-M125 VanDerWaalsContact O-N 3.15Å; Q123-K126 PolarHBondContact O-N 3.13Å
124	T	50.3	Low	63.5	Low	110 Å²	110	110.3 Å²	110.3	68%	0.675	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-6.6	178.1	64.2	0	0	0	0	115.2	K120 C121	K120-T124 WeakPolarHBondContact O-CG2 3.21Å; K120-T124 PolarHBondContact O-N 3.04Å; C121-T124 PolarHBondContact O-OG1 3Å
125	M	50.4	Low	61.5	Low	164 Å²	164	112.5 Å²	112.5	81%	0.808	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	3.8	176.7	-73	-153.3	157.4	0	0	115.3	M122 Q123 P127	M122-M125 PolarHBondContact O-N 3.09Å; Q123-M125 PolarHBondContact O-N 3.42Å; Q123-M125 VanDerWaalsContact O-N 3.15Å; M125-P127 WeakPolarHBondContact O-CD 3.26Å
126	K	44	Very low	59.5	Low	182 Å²	182	119.9 Å²	119.9	79%	0.791	62%	0.616	S	S	*	*			trans	-95.1	94.1	164.6	-82.6	-175.6	177.4	173.7	0	109.1	Q123 S128	Q123-K126 PolarHBondContact O-N 3.13Å; K126-S128 PolarHBondContact O-N 3.21Å
127	P	41.8	Very low	57.6	Low	112 Å²	112	125.5 Å²	125.5	73%	0.727	65%	0.65	S	S	*	*			trans	-59.4	126.5	156.5	27.8	-29.2	0	0	0	106.4	M125 E129	M125-P127 WeakPolarHBondContact O-CD 3.26Å; P127-E129 PolarHBondContact O-N 3.16Å; P127-E129 VanDerWaalsContact O-N 3.09Å
128	S	46.5	Very low	55.5	Low	108 Å²	108	128.4 Å²	128.4	76%	0.755	67%	0.67	S	S	*	*			trans	-37.2	109.3	164.8	50.9	0	0	0	0	112.3	K126 H130	K126-S128 PolarHBondContact O-N 3.21Å; S128-H130 PolarHBondContact O-N 3.24Å
129	E	39.4	Very low	53.5	Low	192 Å²	192	132.3 Å²	132.3	90%	0.897	69%	0.688	S	S	*	*			trans	-90.1	91.9	148.9	-76.9	-100.3	132.5	0	0	106.2	P127	P127-E129 PolarHBondContact O-N 3.16Å; P127-E129 VanDerWaalsContact O-N 3.09Å
130	H	43.1	Very low	51.4	Low	145 Å²	145	138.6 Å²	138.6	67%	0.671	72%	0.721	S	S	*	*			trans	30.7	114	143.6	-113.4	-81.7	0	0	0	117.9	S128 D132	S128-H130 PolarHBondContact O-N 3.24Å; H130-D132 PolarHBondContact O-N 2.68Å
131	S	47.8	Very low	49.5	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	75%	0.747	S	S	*	*			trans	-44.6	107.3	140.4	55.1	0	0	0	0	110.8
132	D	42.2	Very low	48.1	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	76%	0.763	S	S	*	*			trans	-109.7	83.4	150.8	-92.2	-35.5	0	0	0	108.4	H130 N134	H130-D132 PolarHBondContact O-N 2.68Å; D132-N134 PolarHBondContact O-N 3.14Å
133	R	49.8	Very low	47	Very low	244 Å²	244	153.8 Å²	153.8	92%	0.921	77%	0.771	S	S	*	*			trans	-65.3	85	153.3	-86	-177.5	170.7	179.2	-1.3	107.7
134	N	47.2	Very low	45.9	Very low	117 Å²	117	161 Å²	161	63%	0.626	79%	0.794	S	S	*	*			trans	-161	52.3	156.9	-127.7	-5.4	0	0	0	115.2	D132 R136	D132-N134 PolarHBondContact O-N 3.14Å; N134-R136 PolarHBondContact O-N 3.47Å
135	D	49.1	Very low	45.8	Very low	163 Å²	163	160.8 Å²	160.8	87%	0.872	80%	0.797	S	S	*	*			trans	-77.9	72.3	154.9	-80.4	-40.1	0	0	0	109.6	V137	D135-V137 PolarHBondContact O-N 2.93Å
136	R	49.3	Very low	45.6	Very low	207 Å²	207	162.8 Å²	162.8	78%	0.781	80%	0.802	S	S	*	*			trans	-61.8	99.1	146.5	-79.6	-175.8	176.4	-179.9	-0.3	105.9	N134 P138	N134-R136 PolarHBondContact O-N 3.47Å; R136-P138 WeakPolarHBondContact O-CD 3Å
137	V	48.6	Very low	45.7	Very low	125 Å²	125	157.7 Å²	157.7	76%	0.758	80%	0.801	S	S	*	*			trans	-46.7	110.1	168.8	-132.4	0	0	0	0	108.8	D135 V139	D135-V137 PolarHBondContact O-N 2.93Å; V137-V139 PolarHBondContact O-N 3.34Å
138	P	44.4	Very low	45.8	Very low	106 Å²	106	158.1 Å²	158.1	69%	0.688	81%	0.807	S	S	*	*			trans	-77.7	103.4	161.5	10	8.2	0	0	0	104.8	R136 L140	R136-P138 WeakPolarHBondContact O-CD 3Å; P138-L140 PolarHBondContact O-N 3.4Å
139	V	46.9	Very low	46	Very low	137 Å²	137	160.2 Å²	160.2	83%	0.83	82%	0.815	S	S	*	*			trans	-57	95.1	166.3	178.7	0	0	0	0	106.9	V137 R141	V137-V139 PolarHBondContact O-N 3.34Å; V139-R141 VanDerWaalsContact C-N 3.26Å; V139-R141 PolarHBondContact O-N 3.4Å
140	L	42.7	Very low	46.1	Very low	163 Å²	163	154 Å²	154	85%	0.853	80%	0.802	S	S	*	*			trans	-68.6	93.6	171.7	-88.2	166.5	0	0	0	107.4	P138 Q142	P138-L140 PolarHBondContact O-N 3.4Å; L140-Q142 PolarHBondContact O-N 2.94Å
141	R	44.8	Very low	45.9	Very low	229 Å²	229	154.6 Å²	154.6	86%	0.864	81%	0.81	S	S	*	*			trans	-45.6	105.5	168.5	-156.4	175.1	-174.9	176.1	1.4	108.8	V139 K143	V139-R141 VanDerWaalsContact C-N 3.26Å; V139-R141 PolarHBondContact O-N 3.4Å; R141-K143 PolarHBondContact O-N 3.13Å
142	Q	47.2	Very low	45.9	Very low	184 Å²	184	156.3 Å²	156.3	86%	0.86	81%	0.81	S	S	*	*			trans	-56	102.1	176.6	-146.7	162.8	7.2	0	0	108.7	L140 R144	L140-Q142 PolarHBondContact O-N 2.94Å; Q142-R144 VanDerWaalsContact C-N 3.34Å; Q142-R144 PolarHBondContact O-N 3.49Å
143	K	46.8	Very low	46.3	Very low	204 Å²	204	154.7 Å²	154.7	89%	0.887	81%	0.81	S	S	*	*			trans	-70.4	97.1	167	-80.6	-173.1	176.3	179.9	0	106.9	R141 S145	R141-K143 PolarHBondContact O-N 3.13Å; K143-S145 PolarHBondContact O-N 2.97Å
144	R	40.8	Very low	46.4	Very low	238 Å²	238	146.9 Å²	146.9	90%	0.898	81%	0.806	S	S	*	*			trans	-52.5	119	162	-74.1	178.5	177.5	168.4	-1.2	107.7	Q142	Q142-R144 VanDerWaalsContact C-N 3.34Å; Q142-R144 PolarHBondContact O-N 3.49Å
145	S	49.4	Very low	46.7	Very low	107 Å²	107	151 Å²	151	75%	0.748	82%	0.818	S	S	*	*			trans	-63.6	135.7	172.5	47.4	0	0	0	0	110.7	K143	K143-S145 PolarHBondContact O-N 2.97Å
146	F	46.8	Very low	46.5	Very low	205 Å²	205	154.5 Å²	154.5	90%	0.899	82%	0.819	S	S	*	*			trans	-24.6	132.6	155.1	-58.3	-95	0	0	0	112.2
147	G	44.8	Very low	46.3	Very low	75 Å²	75	153.7 Å²	153.7	77%	0.773	82%	0.821	S	S	*	*			cis	96	86.6	41	0	0	0	0	0	109.1
148	S	44.2	Very low	46.1	Very low	122 Å²	122	157.5 Å²	157.5	85%	0.853	85%	0.851	S	S	*	*			trans	-178.5	101.7	146.7	-141.9	0	0	0	0	112.8
149	V	49.9	Very low	46.2	Very low	151 Å²	151	160.1 Å²	160.1	92%	0.915	86%	0.859	S	S	*	*			trans	-158.7	121.1	147.4	-176.2	0	0	0	0	102.7
150	G	41.6	Very low	46.1	Very low	62 Å²	62	161.3 Å²	161.3	64%	0.639	86%	0.86	S	S	*	*			cis	121	102.4	31.1	0	0	0	0	0	106.6
151	N	39.3	Very low	46.3	Very low	157 Å²	157	161.2 Å²	161.2	84%	0.84	86%	0.861	S	S	*	*			trans	62.3	152.6	172.1	-96.6	-18.3	0	0	0	115.7
152	I	49	Very low	46.4	Very low	141 Å²	141	157.2 Å²	157.2	72%	0.723	86%	0.861	S	S	*	*			cis	-167.5	139.2	42.2	-7.3	174.8	0	0	0	108.8
153	S	49.8	Very low	46.4	Very low	112 Å²	112	155.5 Å²	155.5	78%	0.783	86%	0.861	S	S	*	*			trans	38.7	120	140	61.8	0	0	0	0	121.4
154	G	52.4	Low	46.3	Very low	80 Å²	80	152.3 Å²	152.3	83%	0.825	86%	0.859	S	S	*	*			trans	-165	80.2	162.5	0	0	0	0	0	113.7
155	K	52.2	Low	46.7	Very low	204 Å²	204	146.1 Å²	146.1	89%	0.887	86%	0.856	S	S	*	*			trans	-59.5	145.8	166.3	-71.9	176	170.6	175.8	0	111.5
156	R	45.4	Very low	46.5	Very low	235 Å²	235	149.2 Å²	149.2	89%	0.887	86%	0.864	S	S	*	*			trans	142.3	125.6	154.7	-85.8	175.5	-150.4	169.8	6.1	107.8
157	K	45.7	Very low	46.5	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	86%	0.861	S	S	*	*			cis	-149.6	150.7	25.2	-78.3	148.4	177.5	-174.4	0	106
158	C	43.8	Very low	46.7	Very low	205 Å²	205	150.8 Å²	150.8	100%	1.385	87%	0.869	S	S	*	*				-138.4	0	61.5	-59.8	0	0	0	0	112.5

Retrieved 158 of 158 residues in 714.7 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).