A0A096NE42_PAPAN Loading...

EF-hand calcium-binding domain-containing protein 11

AlphaFold DB (A0A2K5MZA0), UniProt , Accession A0A096NE42, Species PAPAN (Papio anubis, Olive baboon), Gene EFCAB11, Length 163 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	38.8	Very low	230 Å²	230	170.5 Å²	170.5	100%	1.133	84%	0.841	S	S	*	*				0	86.1	0	-80.1	177.7	168.6	0	0	108.9
2	F	36	Very low	40.4	Very low	196 Å²	196	164.1 Å²	164.1	86%	0.86	82%	0.818	S	S	*	*			trans	-151.7	70.7	173.6	-78.2	-69.7	0	0	0	110.1
3	F	35.4	Very low	43.1	Very low	221 Å²	221	155.1 Å²	155.1	97%	0.969	77%	0.769	S	S	*	*			trans	-150.3	68.6	153.7	-78.5	-70.3	0	0	0	106.8
4	S	41.1	Very low	45.5	Very low	100 Å²	100	155.3 Å²	155.3	70%	0.699	77%	0.767	S	S	*	*			trans	-98.3	122.7	168.1	-174.2	0	0	0	0	107.2
5	E	35.3	Very low	48	Very low	184 Å²	184	146.8 Å²	146.8	86%	0.86	73%	0.731	S	S	*	*			trans	75.6	40	158.6	-62.4	177.6	146.6	0	0	119.2
6	A	33.9	Very low	50.7	Low	98 Å²	98	140 Å²	140	81%	0.81	70%	0.702	S	S	*	*			trans	-98.7	80	140	0	0	0	0	0	107.2	A8	A6-A8 VanDerWaalsContact C-N 3.28Å; A6-A8 PolarHBondContact O-N 3.27Å
7	R	34.5	Very low	53	Low	224 Å²	224	137.2 Å²	137.2	85%	0.845	70%	0.696	S	S	*	*			trans	-53.3	101.2	166.6	-172.3	176.4	-171.7	170.2	2.7	105.9	R9	R7-R9 PolarHBondContact O-N 3.11Å
8	A	40.7	Very low	55.2	Low	84 Å²	84	133.3 Å²	133.3	69%	0.694	68%	0.683	S	S	*	*			trans	-60.7	88.4	167.6	0	0	0	0	0	105.1	A6 S10	A6-A8 VanDerWaalsContact C-N 3.28Å; A6-A8 PolarHBondContact O-N 3.27Å; A8-S10 VanDerWaalsContact C-N 3.28Å; A8-S10 PolarHBondContact O-N 3.5Å
9	R	37.5	Very low	57.1	Low	207 Å²	207	128.8 Å²	128.8	78%	0.781	66%	0.659	S	S	*	*			trans	-57.4	107.7	160.7	-73.8	-179.4	168.9	-174.9	-2.9	102.7	R7 R11	R7-R9 PolarHBondContact O-N 3.11Å; R9-R11 PolarHBondContact O-N 3Å
10	S	46.5	Very low	59	Low	106 Å²	106	126.7 Å²	126.7	74%	0.741	65%	0.646	S	S	*	*			trans	-50	97.6	155.5	-44.9	0	0	0	0	104.1	A8 T12	A8-S10 VanDerWaalsContact C-N 3.28Å; A8-S10 PolarHBondContact O-N 3.5Å; S10-T12 PolarHBondContact O-N 3.34Å
11	R	49.4	Very low	60.7	Low	226 Å²	226	128 Å²	128	85%	0.853	64%	0.643	S	S	*	*			trans	-73.6	75.3	173.7	-86.2	179.2	165.1	175.8	-3.4	103.9	R9 W13	R9-R11 PolarHBondContact O-N 3Å; R11-W13 VanDerWaalsContact C-N 3.31Å; R11-W13 PolarHBondContact O-N 3.35Å
12	T	57.2	Low	63.6	Low	93 Å²	93	122.6 Å²	122.6	57%	0.571	62%	0.617	S	S	*	*			trans	-58.9	106.1	165.9	47.7	0	0	0	0	104.8	S10 E14	S10-T12 PolarHBondContact O-N 3.34Å; T12-E14 PolarHBondContact O-N 3.34Å
13	W	75.9	Confident	66.5	Low	47 Å²	47	113.7 Å²	113.7	18%	0.178	58%	0.577	C	S	.	*	P	Polyproline II helix	trans	-64.6	129.2	177.9	160.7	75.7	0	0	0	107.8	R11 A15 W23 R84 K87 E88 R91	R11-W13 VanDerWaalsContact C-N 3.31Å; R11-W13 PolarHBondContact O-N 3.35Å; W13-A15 HydrophobicContact CH2-CB 4.11Å; W13-A15 HydrophobicContact CZ2-CB 4.16Å; W13-W23 AromaticContact CH2-CH2 3.63Å; W13-W23 HydrophobicContact CH2-CH2 3.63Å; W13-W23 AromaticContact CH2-CZ2 3.91Å; W13-W23 HydrophobicContact CH2-CZ2 3.91Å; W13-W23 HydrophobicContact CZ3-CH2 4.22Å; W13-R84 HydrophobicContact CZ3-CG 4.05Å; W13-K87 HydrophobicContact CH2-CB 3.68Å; W13-K87 HydrophobicContact CZ3-CB 3.83Å; W13-E88 HydrophobicContact CE3-CB 3.93Å; W13-E88 HydrophobicContact CE3-CG 4.46Å; W13-E88 HydrophobicContact CZ3-CB 4.31Å; W13-R91 VanDerWaalsContact CE2-CZ 3.44Å; W13-R91 VanDerWaalsContact CE2-NE 3.34Å
14	E	77.4	Confident	69.4	Low	158 Å²	158	104.3 Å²	104.3	74%	0.738	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-103.2	137.2	174	-69.6	-176.7	177.2	0	0	109.9	T12	T12-E14 PolarHBondContact O-N 3.34Å
15	A	82.5	Confident	72.1	Confident	28 Å²	28	104.4 Å²	104.4	23%	0.231	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-64.8	137.3	175.1	0	0	0	0	0	110.1	W13 E19 W23	W13-A15 HydrophobicContact CH2-CB 4.11Å; W13-A15 HydrophobicContact CZ2-CB 4.16Å; A15-E19 HydrophobicContact CB-CB 4.27Å; A15-W23 HydrophobicContact CB-CH2 3.36Å; A15-W23 HydrophobicContact CB-CZ2 4.04Å; A15-W23 HydrophobicContact CB-CZ3 3.67Å
16	S	90.4	Very high	75.1	Confident	38 Å²	38	96 Å²	96	27%	0.266	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-62.3	154.8	171.7	61.7	0	0	0	0	111.1	S18 E19 H20	S16-S18 PolarHBondContact O-N 2.89Å; S16-S18 VanDerWaalsContact O-N 3.13Å; S16-S18 PolarHBondContact OG-OG 3.27Å; S16-E19 WeakPolarHBondContact CB-OE2 3.38Å; S16-E19 PolarHBondContact N-OE2 3.01Å; S16-E19 PolarHBondContact O-N 3.42Å; S16-E19 WeakPolarHBondContact OG-CB 3.47Å; S16-E19 VanDerWaalsContact OG-CG 3.25Å; S16-E19 WeakPolarHBondContact OG-CG 3.49Å; S16-E19 PolarHBondContact OG-N 2.99Å; S16-E19 PolarHBondContact OG-OE2 3.39Å; S16-H20 PolarHBondContact O-N 3.11Å
17	P	90.8	Very high	78.1	Confident	93 Å²	93	91.9 Å²	91.9	60%	0.604	45%	0.452	S	S	*	.	H	α-helix	trans	-55.3	-32.8	175.4	-27.5	35.3	0	0	0	113.3	R21	P17-R21 WeakPolarHBondContact O-CB 3.3Å; P17-R21 VanDerWaalsContact O-CG 3.31Å; P17-R21 WeakPolarHBondContact O-CG 3.33Å; P17-R21 PolarHBondContact O-N 3.34Å
18	S	92.4	Very high	81.1	Confident	67 Å²	67	86.3 Å²	86.3	47%	0.469	43%	0.434	S	S	.	.	H	α-helix	trans	-68.1	-43.7	174	38	0	0	0	0	113.2	S16 R21 M22	S16-S18 PolarHBondContact O-N 2.89Å; S16-S18 VanDerWaalsContact O-N 3.13Å; S16-S18 PolarHBondContact OG-OG 3.27Å; S18-R21 PolarHBondContact O-N 2.9Å; S18-M22 WeakPolarHBondContact O-CB 3.44Å; S18-M22 PolarHBondContact O-N 3.42Å
19	E	91.9	Very high	83.7	Confident	47 Å²	47	85.8 Å²	85.8	22%	0.22	43%	0.43	C	S	.	.	H	α-helix	trans	-63.3	-45.1	175.3	-77	165.7	125.7	0	0	110.3	A15 S16 R21 M22 W23 R91	A15-E19 HydrophobicContact CB-CB 4.27Å; S16-E19 WeakPolarHBondContact CB-OE2 3.38Å; S16-E19 PolarHBondContact N-OE2 3.01Å; S16-E19 PolarHBondContact O-N 3.42Å; S16-E19 WeakPolarHBondContact OG-CB 3.47Å; S16-E19 VanDerWaalsContact OG-CG 3.25Å; S16-E19 WeakPolarHBondContact OG-CG 3.49Å; S16-E19 PolarHBondContact OG-N 2.99Å; S16-E19 PolarHBondContact OG-OE2 3.39Å; E19-R21 PolarHBondContact O-N 3.44Å; E19-M22 WeakPolarHBondContact O-CB 3.17Å; E19-M22 PolarHBondContact O-N 2.94Å; E19-W23 HydrophobicContact CB-CZ2 4.05Å; E19-W23 PolarHBondContact O-N 3.43Å; E19-W23 PolarHBondContact O-NE1 2.66Å; E19-R91 IonicContact OE1-CZ 2.61Å; E19-R91 IonicContact OE1-NH2 3.34Å; E19-R91 PolarHBondContact OE1-NH2 3.05Å; E19-R91 IonicContact OE2-NH2 3.7Å
20	H	93.6	Very high	86.5	Confident	87 Å²	87	76.2 Å²	76.2	40%	0.403	40%	0.395	S	S	.	.	H	α-helix	trans	-59	-48.4	177.8	-171.7	94.2	0	0	0	111.9	S16 M22 W23 V24	S16-H20 PolarHBondContact O-N 3.11Å; H20-M22 VanDerWaalsContact C-N 3.33Å; H20-M22 PolarHBondContact O-N 3.14Å; H20-W23 PolarHBondContact O-N 2.97Å; H20-V24 WeakPolarHBondContact O-CG2 3.42Å; H20-V24 PolarHBondContact O-N 2.96Å
21	R	95.6	Very high	88.8	Confident	155 Å²	155	71.9 Å²	71.9	59%	0.585	36%	0.363	S	S	*	.	H	α-helix	trans	-57.8	-45.6	175.3	-77.1	-170.7	-59.3	-94.2	4.9	111.7	P17 S18 E19 W23 V24 E25	P17-R21 WeakPolarHBondContact O-CB 3.3Å; P17-R21 VanDerWaalsContact O-CG 3.31Å; P17-R21 WeakPolarHBondContact O-CG 3.33Å; P17-R21 PolarHBondContact O-N 3.34Å; S18-R21 PolarHBondContact O-N 2.9Å; E19-R21 PolarHBondContact O-N 3.44Å; R21-W23 VanDerWaalsContact C-N 3.29Å; R21-W23 PolarHBondContact O-N 2.89Å; R21-V24 PolarHBondContact O-N 2.91Å; R21-E25 WeakPolarHBondContact O-CG 3.5Å; R21-E25 PolarHBondContact O-N 3.07Å
22	M	96.7	Very high	90.6	Very high	116 Å²	116	67.2 Å²	67.2	57%	0.571	35%	0.351	S	S	*	.	H	α-helix	trans	-57.8	-42.7	177.6	-179.2	62.9	74.3	0	0	111.8	S18 E19 H20 E25 V26	S18-M22 WeakPolarHBondContact O-CB 3.44Å; S18-M22 PolarHBondContact O-N 3.42Å; E19-M22 WeakPolarHBondContact O-CB 3.17Å; E19-M22 PolarHBondContact O-N 2.94Å; H20-M22 VanDerWaalsContact C-N 3.33Å; H20-M22 PolarHBondContact O-N 3.14Å; M22-E25 PolarHBondContact O-N 3.37Å; M22-V26 WeakPolarHBondContact O-CG2 3.42Å; M22-V26 PolarHBondContact O-N 2.77Å
23	W	97.2	Very high	92.1	Very high	9 Å²	9	69.3 Å²	69.3	3%	0.034	36%	0.359	C	S	.	.	H	α-helix	trans	-66.9	-40	179.6	-54.8	-12.8	0	0	0	111.8	W13 A15 E19 H20 R21 E25 V26 F27 F79 L80 V83 R84 K87	W13-W23 AromaticContact CH2-CH2 3.63Å; W13-W23 HydrophobicContact CH2-CH2 3.63Å; W13-W23 AromaticContact CH2-CZ2 3.91Å; W13-W23 HydrophobicContact CH2-CZ2 3.91Å; W13-W23 HydrophobicContact CZ3-CH2 4.22Å; A15-W23 HydrophobicContact CB-CH2 3.36Å; A15-W23 HydrophobicContact CB-CZ2 4.04Å; A15-W23 HydrophobicContact CB-CZ3 3.67Å; E19-W23 HydrophobicContact CB-CZ2 4.05Å; E19-W23 PolarHBondContact O-N 3.43Å; E19-W23 PolarHBondContact O-NE1 2.66Å; H20-W23 PolarHBondContact O-N 2.97Å; R21-W23 VanDerWaalsContact C-N 3.29Å; R21-W23 PolarHBondContact O-N 2.89Å; W23-E25 VanDerWaalsContact C-N 3.33Å; W23-E25 PolarHBondContact O-N 2.9Å; W23-V26 PolarHBondContact O-N 3.49Å; W23-F27 PolarHBondContact O-N 2.93Å; W23-F79 HydrophobicContact CB-CE1 4.44Å; W23-F79 WeakPolarHBondContact O-CE1 3.32Å; W23-L80 HydrophobicContact CB-CD2 3.67Å; W23-L80 HydrophobicContact CE3-CD2 4.08Å; W23-V83 HydrophobicContact CD2-CB 4.33Å; W23-V83 HydrophobicContact CD2-CG1 3.51Å; W23-V83 HydrophobicContact CE3-CB 4.35Å; W23-V83 HydrophobicContact CE3-CG1 3.95Å; W23-V83 HydrophobicContact CG-CG1 3.8Å; W23-V83 HydrophobicContact CH2-CG1 4.35Å; W23-V83 HydrophobicContact CZ2-CG1 4Å; W23-V83 HydrophobicContact CZ3-CG1 4.34Å; W23-R84 HydrophobicContact CH2-CB 4.16Å; W23-R84 HydrophobicContact CZ3-CB 3.89Å; W23-K87 HydrophobicContact CZ2-CG 4.02Å
24	V	97.3	Very high	92.7	Very high	23 Å²	23	74.9 Å²	74.9	14%	0.139	39%	0.386	C	S	.	.	H	α-helix	trans	-61.5	-42.2	174.1	173.1	0	0	0	0	111.2	H20 R21 F27 K28 L76 L80	H20-V24 WeakPolarHBondContact O-CG2 3.42Å; H20-V24 PolarHBondContact O-N 2.96Å; R21-V24 PolarHBondContact O-N 2.91Å; V24-F27 WeakPolarHBondContact O-CB 3.29Å; V24-F27 PolarHBondContact O-N 3.25Å; V24-K28 HydrophobicContact CG1-CD 4.39Å; V24-K28 WeakPolarHBondContact O-CG 3.32Å; V24-K28 PolarHBondContact O-N 2.98Å; V24-L76 HydrophobicContact CG2-CD1 4.36Å; V24-L80 HydrophobicContact CG2-CD1 4.38Å; V24-L80 HydrophobicContact CG2-CD2 4.09Å
25	E	97.2	Very high	93.4	Very high	102 Å²	102	70.7 Å²	70.7	48%	0.477	37%	0.366	S	S	.	.	H	α-helix	trans	-67.3	-38.4	177.8	-67.8	-53.7	120.2	0	0	112.4	R21 M22 W23 F27 K28 A29	R21-E25 WeakPolarHBondContact O-CG 3.5Å; R21-E25 PolarHBondContact O-N 3.07Å; M22-E25 PolarHBondContact O-N 3.37Å; W23-E25 VanDerWaalsContact C-N 3.33Å; W23-E25 PolarHBondContact O-N 2.9Å; E25-F27 VanDerWaalsContact C-N 3.34Å; E25-F27 PolarHBondContact O-N 3.45Å; E25-K28 PolarHBondContact O-N 3.2Å; E25-K28 IonicContact OE1-NZ 3.94Å; E25-K28 PolarHBondContact OE1-NZ 3.48Å; E25-A29 WeakPolarHBondContact O-CB 3.28Å; E25-A29 PolarHBondContact O-N 3.45Å
26	V	97.8	Very high	93.9	Very high	9 Å²	9	71.1 Å²	71.1	6%	0.055	37%	0.372	C	S	.	.	H	α-helix	trans	-61.9	-43.1	171.9	170.6	0	0	0	0	111.1	M22 W23 K28 A29 C30 A46 M49 L50 F79	M22-V26 WeakPolarHBondContact O-CG2 3.42Å; M22-V26 PolarHBondContact O-N 2.77Å; W23-V26 PolarHBondContact O-N 3.49Å; V26-K28 PolarHBondContact O-N 3.1Å; V26-A29 PolarHBondContact O-N 2.67Å; V26-C30 PolarHBondContact O-N 2.82Å; V26-C30 PolarHBondContact O-SG 2.84Å; V26-A46 HydrophobicContact CG1-CB 3.88Å; V26-M49 HydrophobicContact CG1-CB 4.25Å; V26-M49 HydrophobicContact CG1-SD 4.39Å; V26-M49 HydrophobicContact CG2-CB 4.49Å; V26-L50 HydrophobicContact CB-CD1 4.47Å; V26-L50 HydrophobicContact CB-CD2 4.34Å; V26-L50 HydrophobicContact CB-CG 4.3Å; V26-L50 HydrophobicContact CG1-CD1 4.08Å; V26-L50 HydrophobicContact CG1-CG 3.98Å; V26-L50 HydrophobicContact CG2-CD2 3.85Å; V26-L50 HydrophobicContact CG2-CG 4.1Å; V26-F79 HydrophobicContact CG1-CZ 4.2Å
27	F	97.8	Very high	94.1	Very high	10 Å²	10	72.3 Å²	72.3	4%	0.044	37%	0.372	C	S	.	.	H	α-helix	trans	-56.9	-51.2	176.2	179.6	-83.7	0	0	0	110.9	W23 V24 E25 A29 C30 D31 L38 I74 L76 F79	W23-F27 PolarHBondContact O-N 2.93Å; V24-F27 WeakPolarHBondContact O-CB 3.29Å; V24-F27 PolarHBondContact O-N 3.25Å; E25-F27 VanDerWaalsContact C-N 3.34Å; E25-F27 PolarHBondContact O-N 3.45Å; F27-A29 VanDerWaalsContact C-N 3.29Å; F27-A29 PolarHBondContact O-N 2.61Å; F27-C30 PolarHBondContact O-N 2.97Å; F27-C30 VanDerWaalsContact O-N 3.13Å; F27-D31 HydrophobicContact CD1-CB 4.47Å; F27-D31 HydrophobicContact CE1-CB 4.18Å; F27-D31 WeakPolarHBondContact O-CB 3.47Å; F27-D31 PolarHBondContact O-N 3.09Å; F27-L38 HydrophobicContact CD2-CD1 3.75Å; F27-L38 HydrophobicContact CD2-CD2 3.96Å; F27-L38 HydrophobicContact CD2-CG 3.66Å; F27-L38 HydrophobicContact CE2-CD1 4.12Å; F27-L38 HydrophobicContact CE2-CD2 3.97Å; F27-L38 HydrophobicContact CE2-CG 3.54Å; F27-L38 HydrophobicContact CG-CD2 4.37Å; F27-L38 HydrophobicContact CZ-CD2 4.35Å; F27-L38 HydrophobicContact CZ-CG 4.29Å; F27-I74 WeakPolarHBondContact CE2-O 3.23Å; F27-L76 HydrophobicContact CB-CD1 3.74Å; F27-L76 HydrophobicContact CD1-CB 4.33Å; F27-L76 HydrophobicContact CD1-CD1 3.81Å; F27-L76 HydrophobicContact CD2-CB 4.35Å; F27-L76 HydrophobicContact CD2-CD1 3.88Å; F27-L76 HydrophobicContact CE1-CB 4.07Å; F27-L76 HydrophobicContact CE1-CD1 4.4Å; F27-L76 VanDerWaalsContact CE2-CA 3.43Å; F27-L76 HydrophobicContact CE2-CB 4.05Å; F27-L76 HydrophobicContact CE2-CD1 4.44Å; F27-L76 HydrophobicContact CG-CB 4.48Å; F27-L76 HydrophobicContact CG-CD1 3.52Å; F27-L76 HydrophobicContact CZ-CB 3.92Å; F27-F79 HydrophobicContact CB-CD1 3.89Å; F27-F79 HydrophobicContact CB-CE1 3.93Å; F27-F79 HydrophobicContact CD2-CB 3.76Å; F27-F79 AromaticContact CD2-CD1 3.8Å; F27-F79 HydrophobicContact CD2-CD1 3.8Å; F27-F79 AromaticContact CD2-CG 3.77Å; F27-F79 HydrophobicContact CD2-CG 3.77Å; F27-F79 HydrophobicContact CE2-CB 4.12Å; F27-F79 HydrophobicContact CG-CD1 4.32Å
28	K	96.6	Very high	94.3	Very high	108 Å²	108	67.9 Å²	67.9	47%	0.47	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-36.9	179.9	-68.8	173.5	-174	166.4	0	112.7	V24 E25 V26 C30	V24-K28 HydrophobicContact CG1-CD 4.39Å; V24-K28 WeakPolarHBondContact O-CG 3.32Å; V24-K28 PolarHBondContact O-N 2.98Å; E25-K28 PolarHBondContact O-N 3.2Å; E25-K28 IonicContact OE1-NZ 3.94Å; E25-K28 PolarHBondContact OE1-NZ 3.48Å; V26-K28 PolarHBondContact O-N 3.1Å; K28-C30 VanDerWaalsContact C-N 3.28Å; K28-C30 PolarHBondContact O-N 2.81Å
29	A	96.4	Very high	94.4	Very high	72 Å²	72	66.1 Å²	66.1	60%	0.595	33%	0.33	S	S	*	.	H	α-helix	trans	-69.3	-27.1	178	0	0	0	0	0	112.7	E25 V26 F27	E25-A29 WeakPolarHBondContact O-CB 3.28Å; E25-A29 PolarHBondContact O-N 3.45Å; V26-A29 PolarHBondContact O-N 2.67Å; F27-A29 VanDerWaalsContact C-N 3.29Å; F27-A29 PolarHBondContact O-N 2.61Å
30	C	96.5	Very high	94.4	Very high	7 Å²	7	67.3 Å²	67.3	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-95.1	-18.1	178.2	-62.3	0	0	0	0	113.6	V26 F27 K28 E32 L38 D42 A46	V26-C30 PolarHBondContact O-N 2.82Å; V26-C30 PolarHBondContact O-SG 2.84Å; F27-C30 PolarHBondContact O-N 2.97Å; F27-C30 VanDerWaalsContact O-N 3.13Å; K28-C30 VanDerWaalsContact C-N 3.28Å; K28-C30 PolarHBondContact O-N 2.81Å; C30-E32 PolarHBondContact O-N 2.95Å; C30-L38 HydrophobicContact CB-CD2 3.86Å; C30-D42 HydrophobicContact CB-CB 4.35Å; C30-D42 VanDerWaalsContact O-CB 3.32Å; C30-D42 WeakPolarHBondContact O-CB 3.33Å; C30-A46 HydrophobicContact CB-CB 4.37Å
31	D	95.1	Very high	94.5	Very high	14 Å²	14	67.8 Å²	67.8	8%	0.075	34%	0.335	C	S	.	.			trans	-75.1	74.4	175	-176.6	24.5	0	0	0	110.6	F27 D33 H34 K35 G36 L38	F27-D31 HydrophobicContact CD1-CB 4.47Å; F27-D31 HydrophobicContact CE1-CB 4.18Å; F27-D31 WeakPolarHBondContact O-CB 3.47Å; F27-D31 PolarHBondContact O-N 3.09Å; D31-D33 PolarHBondContact O-N 3.35Å; D31-H34 PolarHBondContact O-N 3.38Å; D31-H34 VanDerWaalsContact O-N 3.13Å; D31-K35 WeakPolarHBondContact OD1-CB 3.38Å; D31-K35 PolarHBondContact OD1-N 3.5Å; D31-K35 PolarHBondContact OD2-N 3.35Å; D31-G36 PolarHBondContact OD1-N 3.43Å; D31-G36 WeakPolarHBondContact OD2-CA 3.44Å; D31-G36 PolarHBondContact OD2-N 3.2Å; D31-L38 HydrophobicContact CB-CD2 4.03Å
32	E	86.6	Confident	94.5	Very high	129 Å²	129	60.7 Å²	60.7	60%	0.603	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-56.5	133.9	174.7	-168.3	172.4	-152.9	0	0	109.7	C30 H34 K35	C30-E32 PolarHBondContact O-N 2.95Å; E32-H34 PolarHBondContact O-N 3.02Å; E32-K35 VanDerWaalsContact O-CD 3.26Å; E32-K35 WeakPolarHBondContact O-CD 3.48Å; E32-K35 WeakPolarHBondContact O-CE 3.38Å; E32-K35 VanDerWaalsContact O-CG 3.32Å; E32-K35 WeakPolarHBondContact O-CG 3.35Å; E32-K35 PolarHBondContact O-NZ 2.97Å; E32-K35 VanDerWaalsContact O-NZ 3.11Å
33	D	87.8	Confident	94.4	Very high	137 Å²	137	55.4 Å²	55.4	73%	0.733	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	66.2	11.8	-175.6	-51	-43.6	0	0	0	116.3	D31 K35	D31-D33 PolarHBondContact O-N 3.35Å; D33-K35 VanDerWaalsContact C-N 3.29Å; D33-K35 HydrophobicContact CB-CG 4.21Å; D33-K35 PolarHBondContact O-N 3.19Å
34	H	89.6	Confident	94.4	Very high	163 Å²	163	58 Å²	58	76%	0.755	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	54.7	42.7	178.4	-58.3	-53.8	0	0	0	113.4	D31 E32 G36	D31-H34 PolarHBondContact O-N 3.38Å; D31-H34 VanDerWaalsContact O-N 3.13Å; E32-H34 PolarHBondContact O-N 3.02Å; H34-G36 PolarHBondContact O-N 3.18Å
35	K	92.8	Very high	94.4	Very high	71 Å²	71	61.2 Å²	61.2	31%	0.309	31%	0.31	S	S	.	.			trans	-68.5	-20	-177.5	-57.8	164	-54.8	-143.5	0	112	D31 E32 D33 Y37 D42	D31-K35 WeakPolarHBondContact OD1-CB 3.38Å; D31-K35 PolarHBondContact OD1-N 3.5Å; D31-K35 PolarHBondContact OD2-N 3.35Å; E32-K35 VanDerWaalsContact O-CD 3.26Å; E32-K35 WeakPolarHBondContact O-CD 3.48Å; E32-K35 WeakPolarHBondContact O-CE 3.38Å; E32-K35 VanDerWaalsContact O-CG 3.32Å; E32-K35 WeakPolarHBondContact O-CG 3.35Å; E32-K35 PolarHBondContact O-NZ 2.97Å; E32-K35 VanDerWaalsContact O-NZ 3.11Å; D33-K35 VanDerWaalsContact C-N 3.29Å; D33-K35 HydrophobicContact CB-CG 4.21Å; D33-K35 PolarHBondContact O-N 3.19Å; K35-Y37 VanDerWaalsContact C-N 3.32Å; K35-Y37 HydrophobicContact CB-CD1 3.75Å; K35-Y37 HydrophobicContact CB-CE1 3.56Å; K35-Y37 HydrophobicContact CB-CG 4.41Å; K35-Y37 HydrophobicContact CD-CE1 4.46Å; K35-Y37 HydrophobicContact CD-CE2 4.44Å; K35-Y37 WeakPolarHBondContact CE-O 3.48Å; K35-Y37 HydrophobicContact CG-CE1 4.39Å; K35-Y37 WeakPolarHBondContact O-CD1 3.37Å; K35-D42 IonicContact NZ-OD2 2.67Å; K35-D42 PolarHBondContact NZ-OD2 3.01Å
36	G	92.6	Very high	94.4	Very high	36 Å²	36	56.3 Å²	56.3	37%	0.371	29%	0.287	S	S	.	.	S	Bend	trans	82.4	8.3	-174	0	0	0	0	0	113.6	D31 H34 L75	D31-G36 PolarHBondContact OD1-N 3.43Å; D31-G36 WeakPolarHBondContact OD2-CA 3.44Å; D31-G36 PolarHBondContact OD2-N 3.2Å; H34-G36 PolarHBondContact O-N 3.18Å; G36-L75 WeakPolarHBondContact O-CD2 3.33Å
37	Y	93.8	Very high	94.3	Very high	64 Å²	64	56 Å²	56	25%	0.251	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	150	178.5	68.8	-94.4	0	0	0	111.8	K35 S72 I74	K35-Y37 VanDerWaalsContact C-N 3.32Å; K35-Y37 HydrophobicContact CB-CD1 3.75Å; K35-Y37 HydrophobicContact CB-CE1 3.56Å; K35-Y37 HydrophobicContact CB-CG 4.41Å; K35-Y37 HydrophobicContact CD-CE1 4.46Å; K35-Y37 HydrophobicContact CD-CE2 4.44Å; K35-Y37 WeakPolarHBondContact CE-O 3.48Å; K35-Y37 HydrophobicContact CG-CE1 4.39Å; K35-Y37 WeakPolarHBondContact O-CD1 3.37Å; Y37-S72 WeakPolarHBondContact CE2-O 3.38Å; Y37-S72 VanDerWaalsContact CZ-CB 3.47Å; Y37-I74 CarbonylContact C-O 3.57Å; Y37-I74 WeakPolarHBondContact CA-O 3.43Å
38	L	95.3	Very high	94.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.3	171.7	-55.3	-173.8	0	0	0	110.3	F27 C30 D31 D42 A46 G73 I74 F79	F27-L38 HydrophobicContact CD2-CD1 3.75Å; F27-L38 HydrophobicContact CD2-CD2 3.96Å; F27-L38 HydrophobicContact CD2-CG 3.66Å; F27-L38 HydrophobicContact CE2-CD1 4.12Å; F27-L38 HydrophobicContact CE2-CD2 3.97Å; F27-L38 HydrophobicContact CE2-CG 3.54Å; F27-L38 HydrophobicContact CG-CD2 4.37Å; F27-L38 HydrophobicContact CZ-CD2 4.35Å; F27-L38 HydrophobicContact CZ-CG 4.29Å; C30-L38 HydrophobicContact CB-CD2 3.86Å; D31-L38 HydrophobicContact CB-CD2 4.03Å; L38-D42 HydrophobicContact CB-CB 3.83Å; L38-D42 HydrophobicContact CD2-CB 3.95Å; L38-D42 HydrophobicContact CG-CB 4.38Å; L38-A46 HydrophobicContact CD1-CB 4.16Å; L38-G73 WeakPolarHBondContact O-CA 3.45Å; L38-I74 HydrophobicContact CB-CB 4.34Å; L38-I74 PolarHBondContact N-O 3.49Å; L38-I74 PolarHBondContact O-N 3.41Å; L38-F79 HydrophobicContact CD1-CD2 3.58Å; L38-F79 HydrophobicContact CD1-CE2 3.78Å; L38-F79 HydrophobicContact CD1-CG 4.15Å; L38-F79 HydrophobicContact CD1-CZ 4.5Å
39	S	94.3	Very high	94.4	Very high	29 Å²	29	58.9 Å²	58.9	20%	0.203	31%	0.306	C	S	.	.			trans	-66.7	178	165.8	74.1	0	0	0	0	111.2	E41 D42 F43	S39-E41 PolarHBondContact O-N 2.96Å; S39-E41 PolarHBondContact OG-N 3.18Å; S39-D42 VanDerWaalsContact CB-OD2 3.27Å; S39-D42 WeakPolarHBondContact CB-OD2 3.35Å; S39-D42 PolarHBondContact N-OD2 2.88Å; S39-D42 PolarHBondContact O-N 2.93Å; S39-D42 PolarHBondContact OG-N 3.49Å; S39-D42 PolarHBondContact OG-OD1 2.9Å; S39-D42 PolarHBondContact OG-OD2 2.88Å; S39-F43 WeakPolarHBondContact O-CB 3.42Å; S39-F43 PolarHBondContact O-N 3.34Å
40	R	93.2	Very high	94.3	Very high	72 Å²	72	56.5 Å²	56.5	27%	0.272	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-35.2	175.3	-175.3	-171.5	-179.2	84.7	2.7	112.5	K44 V60 D61 M64	R40-K44 WeakPolarHBondContact O-CG 3.27Å; R40-K44 PolarHBondContact O-N 2.75Å; R40-V60 HydrophobicContact CG-CG1 3.64Å; R40-D61 IonicContact CZ-OD1 3.04Å; R40-D61 IonicContact NH1-OD1 3.81Å; R40-D61 PolarHBondContact NH1-OD1 2.95Å; R40-D61 IonicContact NH2-OD1 4Å; R40-D61 PolarHBondContact NH2-OD1 2.68Å; R40-D61 IonicContact NH2-OD2 3.8Å; R40-M64 HydrophobicContact CB-CE 4.2Å; R40-M64 HydrophobicContact CG-CE 4.4Å
41	E	94.3	Very high	94.3	Very high	98 Å²	98	57.7 Å²	57.7	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-76.8	-46.2	-179.3	-75.3	51.7	-119.8	0	0	110.2	S39 F43 K44 I45	S39-E41 PolarHBondContact O-N 2.96Å; S39-E41 PolarHBondContact OG-N 3.18Å; E41-F43 VanDerWaalsContact C-N 3.29Å; E41-F43 PolarHBondContact O-N 3.16Å; E41-K44 WeakPolarHBondContact O-CB 3.39Å; E41-K44 PolarHBondContact O-N 3.09Å; E41-K44 IonicContact OE1-NZ 3.88Å; E41-K44 PolarHBondContact OE1-NZ 3.34Å; E41-I45 PolarHBondContact O-N 3.25Å
42	D	96.1	Very high	94.3	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.032	32%	0.317	C	S	.	.	H	α-helix	trans	-58.2	-42.9	177.5	-55.4	-21.7	0	0	0	111.1	C30 K35 L38 S39 K44 I45 A46	C30-D42 HydrophobicContact CB-CB 4.35Å; C30-D42 VanDerWaalsContact O-CB 3.32Å; C30-D42 WeakPolarHBondContact O-CB 3.33Å; K35-D42 IonicContact NZ-OD2 2.67Å; K35-D42 PolarHBondContact NZ-OD2 3.01Å; L38-D42 HydrophobicContact CB-CB 3.83Å; L38-D42 HydrophobicContact CD2-CB 3.95Å; L38-D42 HydrophobicContact CG-CB 4.38Å; S39-D42 VanDerWaalsContact CB-OD2 3.27Å; S39-D42 WeakPolarHBondContact CB-OD2 3.35Å; S39-D42 PolarHBondContact N-OD2 2.88Å; S39-D42 PolarHBondContact O-N 2.93Å; S39-D42 PolarHBondContact OG-N 3.49Å; S39-D42 PolarHBondContact OG-OD1 2.9Å; S39-D42 PolarHBondContact OG-OD2 2.88Å; D42-K44 VanDerWaalsContact C-N 3.33Å; D42-K44 PolarHBondContact O-N 2.88Å; D42-I45 PolarHBondContact O-N 3.42Å; D42-A46 PolarHBondContact O-N 3.04Å
43	F	95.6	Very high	94.8	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-38.6	176.8	179	-109.7	0	0	0	112.6	S39 E41 I45 A46 V47 V60 V63 M64 I74 F79 I82	S39-F43 WeakPolarHBondContact O-CB 3.42Å; S39-F43 PolarHBondContact O-N 3.34Å; E41-F43 VanDerWaalsContact C-N 3.29Å; E41-F43 PolarHBondContact O-N 3.16Å; F43-I45 VanDerWaalsContact C-N 3.32Å; F43-I45 PolarHBondContact O-N 2.95Å; F43-A46 PolarHBondContact O-N 3.39Å; F43-V47 HydrophobicContact CD1-CG2 4.32Å; F43-V47 HydrophobicContact CD2-CG2 4.43Å; F43-V47 HydrophobicContact CE1-CG2 3.81Å; F43-V47 HydrophobicContact CE2-CG2 3.93Å; F43-V47 HydrophobicContact CZ-CG2 3.58Å; F43-V47 WeakPolarHBondContact O-CG2 3.3Å; F43-V47 PolarHBondContact O-N 2.95Å; F43-V60 HydrophobicContact CD1-CG1 4.41Å; F43-V63 HydrophobicContact CE1-CB 4.04Å; F43-V63 HydrophobicContact CE1-CG1 3.92Å; F43-V63 HydrophobicContact CE1-CG2 4.15Å; F43-V63 HydrophobicContact CE2-CG1 4.2Å; F43-V63 HydrophobicContact CZ-CB 4.15Å; F43-V63 HydrophobicContact CZ-CG1 3.7Å; F43-V63 HydrophobicContact CZ-CG2 4.01Å; F43-M64 HydrophobicContact CB-CE 3.61Å; F43-M64 HydrophobicContact CD1-CE 3.85Å; F43-M64 HydrophobicContact CG-CE 3.88Å; F43-I74 HydrophobicContact CB-CD1 4.11Å; F43-I74 HydrophobicContact CD1-CD1 4.36Å; F43-I74 HydrophobicContact CD2-CD1 3.59Å; F43-I74 HydrophobicContact CE2-CD1 4.1Å; F43-I74 HydrophobicContact CG-CD1 3.74Å; F43-F79 HydrophobicContact CD2-CD2 4.3Å; F43-F79 HydrophobicContact CD2-CE2 4.43Å; F43-F79 HydrophobicContact CE2-CD2 4.43Å; F43-I82 HydrophobicContact CE2-CG2 4.11Å; F43-I82 HydrophobicContact CZ-CG2 4.11Å
44	K	96.4	Very high	95.1	Very high	63 Å²	63	59.8 Å²	59.8	27%	0.274	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-42	176.5	-67.1	162.9	-170.8	158.6	0	110.9	R40 E41 D42 V47 V48 P55 V60	R40-K44 WeakPolarHBondContact O-CG 3.27Å; R40-K44 PolarHBondContact O-N 2.75Å; E41-K44 WeakPolarHBondContact O-CB 3.39Å; E41-K44 PolarHBondContact O-N 3.09Å; E41-K44 IonicContact OE1-NZ 3.88Å; E41-K44 PolarHBondContact OE1-NZ 3.34Å; D42-K44 VanDerWaalsContact C-N 3.33Å; D42-K44 PolarHBondContact O-N 2.88Å; K44-V47 PolarHBondContact O-N 3.42Å; K44-V48 WeakPolarHBondContact O-CG2 3.42Å; K44-V48 PolarHBondContact O-N 2.91Å; K44-V48 VanDerWaalsContact O-N 3.09Å; K44-P55 HydrophobicContact CB-CG 4.19Å; K44-P55 HydrophobicContact CG-CG 4.05Å; K44-V60 HydrophobicContact CG-CG2 3.94Å
45	I	96.7	Very high	95.4	Very high	91 Å²	91	52.5 Å²	52.5	47%	0.467	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-47.1	177.2	-61.1	170.4	0	0	0	109.5	E41 D42 F43 V47 V48 M49	E41-I45 PolarHBondContact O-N 3.25Å; D42-I45 PolarHBondContact O-N 3.42Å; F43-I45 VanDerWaalsContact C-N 3.32Å; F43-I45 PolarHBondContact O-N 2.95Å; I45-V47 VanDerWaalsContact C-N 3.3Å; I45-V47 PolarHBondContact O-N 3.02Å; I45-V48 WeakPolarHBondContact O-CB 3.35Å; I45-V48 PolarHBondContact O-N 3.26Å; I45-V48 VanDerWaalsContact O-N 3.08Å; I45-M49 HydrophobicContact CG2-CG 4.43Å; I45-M49 HydrophobicContact CG2-SD 4.07Å; I45-M49 WeakPolarHBondContact O-CG 3.49Å; I45-M49 PolarHBondContact O-N 3.34Å
46	A	97.2	Very high	95.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-39.9	177.5	0	0	0	0	0	112.6	V26 C30 L38 D42 F43 M49 L50 F79	V26-A46 HydrophobicContact CG1-CB 3.88Å; C30-A46 HydrophobicContact CB-CB 4.37Å; L38-A46 HydrophobicContact CD1-CB 4.16Å; D42-A46 PolarHBondContact O-N 3.04Å; F43-A46 PolarHBondContact O-N 3.39Å; A46-M49 PolarHBondContact O-N 3.28Å; A46-L50 WeakPolarHBondContact O-CB 3.23Å; A46-L50 PolarHBondContact O-N 3.13Å; A46-F79 HydrophobicContact CB-CE2 3.65Å; A46-F79 HydrophobicContact CB-CZ 3.93Å
47	V	97	Very high	95.7	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-41.9	175.4	174	0	0	0	0	111.5	F43 K44 I45 M49 L50 F51 Y53 P55	F43-V47 HydrophobicContact CD1-CG2 4.32Å; F43-V47 HydrophobicContact CD2-CG2 4.43Å; F43-V47 HydrophobicContact CE1-CG2 3.81Å; F43-V47 HydrophobicContact CE2-CG2 3.93Å; F43-V47 HydrophobicContact CZ-CG2 3.58Å; F43-V47 WeakPolarHBondContact O-CG2 3.3Å; F43-V47 PolarHBondContact O-N 2.95Å; K44-V47 PolarHBondContact O-N 3.42Å; I45-V47 VanDerWaalsContact C-N 3.3Å; I45-V47 PolarHBondContact O-N 3.02Å; V47-M49 PolarHBondContact O-N 3.28Å; V47-L50 PolarHBondContact O-N 2.92Å; V47-F51 HydrophobicContact CG1-CD2 4.1Å; V47-F51 WeakPolarHBondContact O-CB 3.44Å; V47-F51 PolarHBondContact O-N 3.42Å; V47-Y53 HydrophobicContact CG1-CE1 4.25Å; V47-Y53 HydrophobicContact CG1-CE2 4.26Å; V47-P55 HydrophobicContact CB-CB 4.49Å; V47-P55 HydrophobicContact CB-CG 3.94Å; V47-P55 HydrophobicContact CG1-CB 4.04Å; V47-P55 HydrophobicContact CG1-CG 3.94Å; V47-P55 HydrophobicContact CG2-CG 4.29Å
48	V	97.3	Very high	95.7	Very high	68 Å²	68	61.3 Å²	61.3	41%	0.412	32%	0.315	S	S	.	.	H	α-helix	trans	-61.4	-45	175.6	173.1	0	0	0	0	110.6	K44 I45 L50 G52 Y53	K44-V48 WeakPolarHBondContact O-CG2 3.42Å; K44-V48 PolarHBondContact O-N 2.91Å; K44-V48 VanDerWaalsContact O-N 3.09Å; I45-V48 WeakPolarHBondContact O-CB 3.35Å; I45-V48 PolarHBondContact O-N 3.26Å; I45-V48 VanDerWaalsContact O-N 3.08Å; V48-L50 PolarHBondContact O-N 3.46Å; V48-G52 WeakPolarHBondContact O-CA 3.33Å; V48-G52 PolarHBondContact O-N 2.92Å; V48-Y53 WeakPolarHBondContact CG2-O 3.36Å
49	M	97.3	Very high	95.6	Very high	109 Å²	109	63.3 Å²	63.3	54%	0.537	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-39.5	179.9	-66.8	178.9	79.6	0	0	113	V26 I45 A46 V47	V26-M49 HydrophobicContact CG1-CB 4.25Å; V26-M49 HydrophobicContact CG1-SD 4.39Å; V26-M49 HydrophobicContact CG2-CB 4.49Å; I45-M49 HydrophobicContact CG2-CG 4.43Å; I45-M49 HydrophobicContact CG2-SD 4.07Å; I45-M49 WeakPolarHBondContact O-CG 3.49Å; I45-M49 PolarHBondContact O-N 3.34Å; A46-M49 PolarHBondContact O-N 3.28Å; V47-M49 PolarHBondContact O-N 3.28Å
50	L	96.1	Very high	95.6	Very high	22 Å²	22	62 Å²	62	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-88	-27	-174.6	-75.7	171.1	0	0	0	115.1	V26 A46 V47 V48 F79 V83 K87	V26-L50 HydrophobicContact CB-CD1 4.47Å; V26-L50 HydrophobicContact CB-CD2 4.34Å; V26-L50 HydrophobicContact CB-CG 4.3Å; V26-L50 HydrophobicContact CG1-CD1 4.08Å; V26-L50 HydrophobicContact CG1-CG 3.98Å; V26-L50 HydrophobicContact CG2-CD2 3.85Å; V26-L50 HydrophobicContact CG2-CG 4.1Å; A46-L50 WeakPolarHBondContact O-CB 3.23Å; A46-L50 PolarHBondContact O-N 3.13Å; V47-L50 PolarHBondContact O-N 2.92Å; V48-L50 PolarHBondContact O-N 3.46Å; L50-F79 HydrophobicContact CD1-CE1 4.25Å; L50-F79 HydrophobicContact CD1-CE2 4.34Å; L50-F79 HydrophobicContact CD1-CZ 3.54Å; L50-V83 HydrophobicContact CD1-CB 4.48Å; L50-V83 HydrophobicContact CD1-CG1 3.98Å; L50-V83 HydrophobicContact CD1-CG2 3.59Å; L50-K87 PolarHBondContact O-NZ 2.72Å
51	F	95.3	Very high	95.5	Very high	32 Å²	32	61.1 Å²	61.1	14%	0.14	32%	0.316	C	S	.	.	H	α-helix	trans	-127.5	-8.8	-170.9	-56.7	-84.3	0	0	0	113.7	V47 Y53 V83 K86 K87	V47-F51 HydrophobicContact CG1-CD2 4.1Å; V47-F51 WeakPolarHBondContact O-CB 3.44Å; V47-F51 PolarHBondContact O-N 3.42Å; F51-Y53 VanDerWaalsContact C-N 3.32Å; F51-Y53 HydrophobicContact CB-CD1 3.65Å; F51-Y53 HydrophobicContact CB-CE1 3.51Å; F51-Y53 HydrophobicContact CG-CE1 4.27Å; F51-Y53 PolarHBondContact O-N 2.94Å; F51-V83 HydrophobicContact CZ-CG1 4.09Å; F51-K86 HydrophobicContact CD1-CD 4.25Å; F51-K86 HydrophobicContact CD2-CD 4.25Å; F51-K86 HydrophobicContact CE1-CB 4.24Å; F51-K86 HydrophobicContact CE1-CD 3.79Å; F51-K86 HydrophobicContact CE1-CG 3.83Å; F51-K86 HydrophobicContact CE2-CD 3.82Å; F51-K86 HydrophobicContact CG-CD 4.47Å; F51-K86 HydrophobicContact CZ-CB 4Å; F51-K86 HydrophobicContact CZ-CD 3.57Å; F51-K86 HydrophobicContact CZ-CG 3.91Å; F51-K87 HydrophobicContact CD1-CD 4.46Å; F51-K87 HydrophobicContact CE1-CD 3.68Å; F51-K87 HydrophobicContact CE1-CG 3.91Å; F51-K87 HydrophobicContact CZ-CD 4.33Å; F51-K87 HydrophobicContact CZ-CG 4.17Å
52	G	95.8	Very high	95.4	Very high	66 Å²	66	60.4 Å²	60.4	68%	0.68	32%	0.321	S	S	*	.	S	Bend	trans	75	16	172.6	0	0	0	0	0	114.8	V48	V48-G52 WeakPolarHBondContact O-CA 3.33Å; V48-G52 PolarHBondContact O-N 2.92Å
53	Y	95.8	Very high	95.1	Very high	78 Å²	78	61 Å²	61	31%	0.306	33%	0.325	S	S	.	.	S	Bend	trans	-140.1	154.8	178.6	78	-90.1	0	0	0	111.8	V47 V48 F51 P55 E59 K86	V47-Y53 HydrophobicContact CG1-CE1 4.25Å; V47-Y53 HydrophobicContact CG1-CE2 4.26Å; V48-Y53 WeakPolarHBondContact CG2-O 3.36Å; F51-Y53 VanDerWaalsContact C-N 3.32Å; F51-Y53 HydrophobicContact CB-CD1 3.65Å; F51-Y53 HydrophobicContact CB-CE1 3.51Å; F51-Y53 HydrophobicContact CG-CE1 4.27Å; F51-Y53 PolarHBondContact O-N 2.94Å; Y53-P55 HydrophobicContact CE2-CB 4.33Å; Y53-E59 WeakPolarHBondContact CE2-OE2 3.34Å; Y53-E59 PolarHBondContact OH-OE1 3.12Å; Y53-E59 PolarHBondContact OH-OE2 2.55Å; Y53-K86 WeakPolarHBondContact OH-CE 3.42Å; Y53-K86 PolarHBondContact OH-NZ 2.92Å
54	K	95.8	Very high	94.8	Very high	180 Å²	180	62.9 Å²	62.9	78%	0.783	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-81.5	118.1	175.5	-179.1	175	178.8	174.8	0	109.8
55	P	95.9	Very high	94.4	Very high	10 Å²	10	64.9 Å²	64.9	7%	0.065	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-66.3	147.5	179.6	27.8	-34.1	0	0	0	111.7	K44 V47 Y53 E59 V60	K44-P55 HydrophobicContact CB-CG 4.19Å; K44-P55 HydrophobicContact CG-CG 4.05Å; V47-P55 HydrophobicContact CB-CB 4.49Å; V47-P55 HydrophobicContact CB-CG 3.94Å; V47-P55 HydrophobicContact CG1-CB 4.04Å; V47-P55 HydrophobicContact CG1-CG 3.94Å; V47-P55 HydrophobicContact CG2-CG 4.29Å; Y53-P55 HydrophobicContact CE2-CB 4.33Å; P55-E59 HydrophobicContact CB-CB 4.43Å; P55-E59 HydrophobicContact CB-CG 4.35Å; P55-V60 HydrophobicContact CB-CG2 3.9Å; P55-V60 HydrophobicContact CG-CG2 3.84Å
56	S	96.1	Very high	93.7	Very high	65 Å²	65	64.8 Å²	64.8	46%	0.455	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-74.3	162.2	176.6	76.4	0	0	0	0	111.1	I58 E59 V60	S56-I58 PolarHBondContact O-N 3.14Å; S56-E59 PolarHBondContact O-N 3.48Å; S56-E59 PolarHBondContact OG-N 3.03Å; S56-E59 VanDerWaalsContact OG-N 3.15Å; S56-V60 WeakPolarHBondContact O-CG2 3.41Å; S56-V60 PolarHBondContact O-N 2.86Å
57	K	94.5	Very high	93	Very high	156 Å²	156	66.2 Å²	66.2	68%	0.678	37%	0.372	S	S	*	.	H	α-helix	trans	-55.6	-43.4	174.9	-179.4	176.5	177	-176	0	111.5	E59 V60 D61	K57-E59 PolarHBondContact O-N 3.24Å; K57-V60 PolarHBondContact O-N 3.03Å; K57-D61 WeakPolarHBondContact CG-OD2 3.41Å; K57-D61 WeakPolarHBondContact O-CB 3.22Å; K57-D61 PolarHBondContact O-N 3.33Å
58	I	94.3	Very high	92	Very high	136 Å²	136	70.3 Å²	70.3	70%	0.697	39%	0.394	S	S	*	.	H	α-helix	trans	-62.8	-43	-179.7	-61.9	171.2	0	0	0	111	S56 D61 S62	S56-I58 PolarHBondContact O-N 3.14Å; I58-D61 PolarHBondContact O-N 2.89Å; I58-S62 WeakPolarHBondContact O-CB 3.27Å; I58-S62 PolarHBondContact O-N 3.13Å
59	E	92.7	Very high	90.9	Very high	41 Å²	41	72.9 Å²	72.9	19%	0.192	41%	0.412	C	S	.	.	H	α-helix	trans	-63.3	-46.7	178.2	-177.6	178.9	175.9	0	0	111.4	Y53 P55 S56 K57 S62 V63 K86	Y53-E59 WeakPolarHBondContact CE2-OE2 3.34Å; Y53-E59 PolarHBondContact OH-OE1 3.12Å; Y53-E59 PolarHBondContact OH-OE2 2.55Å; P55-E59 HydrophobicContact CB-CB 4.43Å; P55-E59 HydrophobicContact CB-CG 4.35Å; S56-E59 PolarHBondContact O-N 3.48Å; S56-E59 PolarHBondContact OG-N 3.03Å; S56-E59 VanDerWaalsContact OG-N 3.15Å; K57-E59 PolarHBondContact O-N 3.24Å; E59-S62 PolarHBondContact O-N 3.28Å; E59-V63 WeakPolarHBondContact O-CG2 3.4Å; E59-V63 PolarHBondContact O-N 3.21Å; E59-V63 VanDerWaalsContact O-N 3.08Å; E59-K86 WeakPolarHBondContact OE1-CE 3.42Å; E59-K86 IonicContact OE1-NZ 3.68Å; E59-K86 PolarHBondContact OE1-NZ 3.01Å
60	V	93.9	Very high	89.9	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	42%	0.424	C	S	.	.	H	α-helix	trans	-63.6	-44.8	178.2	-179.8	0	0	0	0	110.6	R40 F43 K44 P55 S56 K57 S62 V63 M64	R40-V60 HydrophobicContact CG-CG1 3.64Å; F43-V60 HydrophobicContact CD1-CG1 4.41Å; K44-V60 HydrophobicContact CG-CG2 3.94Å; P55-V60 HydrophobicContact CB-CG2 3.9Å; P55-V60 HydrophobicContact CG-CG2 3.84Å; S56-V60 WeakPolarHBondContact O-CG2 3.41Å; S56-V60 PolarHBondContact O-N 2.86Å; K57-V60 PolarHBondContact O-N 3.03Å; V60-S62 PolarHBondContact O-N 3.2Å; V60-V63 PolarHBondContact O-N 2.73Å; V60-M64 HydrophobicContact CG1-CE 4.24Å; V60-M64 HydrophobicContact CG1-CG 4.04Å; V60-M64 WeakPolarHBondContact O-CB 3.42Å; V60-M64 WeakPolarHBondContact O-CG 3.24Å; V60-M64 PolarHBondContact O-N 2.87Å
61	D	92.1	Very high	89	Confident	55 Å²	55	75.7 Å²	75.7	29%	0.294	43%	0.431	S	S	.	.	H	α-helix	trans	-59.7	-45.8	177.8	-71.1	-18.7	0	0	0	111.2	R40 K57 I58 V63 M64 S65	R40-D61 IonicContact CZ-OD1 3.04Å; R40-D61 IonicContact NH1-OD1 3.81Å; R40-D61 PolarHBondContact NH1-OD1 2.95Å; R40-D61 IonicContact NH2-OD1 4Å; R40-D61 PolarHBondContact NH2-OD1 2.68Å; R40-D61 IonicContact NH2-OD2 3.8Å; K57-D61 WeakPolarHBondContact CG-OD2 3.41Å; K57-D61 WeakPolarHBondContact O-CB 3.22Å; K57-D61 PolarHBondContact O-N 3.33Å; I58-D61 PolarHBondContact O-N 2.89Å; D61-V63 VanDerWaalsContact C-N 3.31Å; D61-V63 PolarHBondContact O-N 2.86Å; D61-M64 PolarHBondContact O-N 2.97Å; D61-S65 WeakPolarHBondContact O-CB 3.32Å; D61-S65 PolarHBondContact O-N 2.91Å; D61-S65 PolarHBondContact O-OG 3Å; D61-S65 VanDerWaalsContact O-OG 3.07Å
62	S	91.3	Very high	88.4	Confident	83 Å²	83	78.8 Å²	78.8	58%	0.58	46%	0.457	S	S	*	.	H	α-helix	trans	-58.6	-42.5	177.3	178.1	0	0	0	0	112.4	I58 E59 V60 S66	I58-S62 WeakPolarHBondContact O-CB 3.27Å; I58-S62 PolarHBondContact O-N 3.13Å; E59-S62 PolarHBondContact O-N 3.28Å; V60-S62 PolarHBondContact O-N 3.2Å; S62-S66 PolarHBondContact O-N 3.18Å
63	V	91.2	Very high	88.1	Confident	19 Å²	19	76.1 Å²	76.1	12%	0.115	43%	0.429	C	S	.	.	H	α-helix	trans	-68.6	-48	177.5	172.9	0	0	0	0	110.9	F43 E59 V60 D61 S65 S66 V67 I74 I82	F43-V63 HydrophobicContact CE1-CB 4.04Å; F43-V63 HydrophobicContact CE1-CG1 3.92Å; F43-V63 HydrophobicContact CE1-CG2 4.15Å; F43-V63 HydrophobicContact CE2-CG1 4.2Å; F43-V63 HydrophobicContact CZ-CB 4.15Å; F43-V63 HydrophobicContact CZ-CG1 3.7Å; F43-V63 HydrophobicContact CZ-CG2 4.01Å; E59-V63 WeakPolarHBondContact O-CG2 3.4Å; E59-V63 PolarHBondContact O-N 3.21Å; E59-V63 VanDerWaalsContact O-N 3.08Å; V60-V63 PolarHBondContact O-N 2.73Å; D61-V63 VanDerWaalsContact C-N 3.31Å; D61-V63 PolarHBondContact O-N 2.86Å; V63-S65 VanDerWaalsContact C-N 3.31Å; V63-S65 PolarHBondContact O-N 2.99Å; V63-S66 WeakPolarHBondContact O-CB 3.49Å; V63-S66 PolarHBondContact O-N 3.49Å; V63-S66 PolarHBondContact O-OG 3.36Å; V63-V67 WeakPolarHBondContact O-CG2 3.16Å; V63-V67 PolarHBondContact O-N 3.49Å; V63-I74 HydrophobicContact CG1-CD1 3.83Å; V63-I82 HydrophobicContact CG1-CD1 3.42Å; V63-I82 VanDerWaalsContact CG1-CD1 3.42Å; V63-I82 HydrophobicContact CG1-CG1 4.08Å; V63-I82 HydrophobicContact CG1-CG2 4.2Å; V63-I82 HydrophobicContact CG2-CG2 4.34Å
64	M	88.7	Confident	88	Confident	43 Å²	43	72.4 Å²	72.4	21%	0.212	42%	0.415	C	S	.	.	H	α-helix	trans	-63.1	-37.8	-177.8	-67.8	-67.6	163.2	0	0	112.1	R40 F43 V60 D61 S66 V67 I74	R40-M64 HydrophobicContact CB-CE 4.2Å; R40-M64 HydrophobicContact CG-CE 4.4Å; F43-M64 HydrophobicContact CB-CE 3.61Å; F43-M64 HydrophobicContact CD1-CE 3.85Å; F43-M64 HydrophobicContact CG-CE 3.88Å; V60-M64 HydrophobicContact CG1-CE 4.24Å; V60-M64 HydrophobicContact CG1-CG 4.04Å; V60-M64 WeakPolarHBondContact O-CB 3.42Å; V60-M64 WeakPolarHBondContact O-CG 3.24Å; V60-M64 PolarHBondContact O-N 2.87Å; D61-M64 PolarHBondContact O-N 2.97Å; M64-S66 PolarHBondContact O-N 3.18Å; M64-V67 PolarHBondContact O-N 2.96Å; M64-I74 HydrophobicContact CE-CD1 3.5Å; M64-I74 HydrophobicContact CE-CG1 4.03Å; M64-I74 HydrophobicContact SD-CD1 3.96Å; M64-I74 HydrophobicContact SD-CG1 4Å
65	S	87.7	Confident	88	Confident	105 Å²	105	68 Å²	68	73%	0.734	40%	0.399	S	S	*	.	H	α-helix	trans	-70.1	-19.4	175	-62.5	0	0	0	0	113.8	D61 V63 V67	D61-S65 WeakPolarHBondContact O-CB 3.32Å; D61-S65 PolarHBondContact O-N 2.91Å; D61-S65 PolarHBondContact O-OG 3Å; D61-S65 VanDerWaalsContact O-OG 3.07Å; V63-S65 VanDerWaalsContact C-N 3.31Å; V63-S65 PolarHBondContact O-N 2.99Å; S65-V67 VanDerWaalsContact C-N 3.31Å
66	S	82.3	Confident	87.9	Confident	88 Å²	88	70.5 Å²	70.5	62%	0.615	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.5	176.6	75.3	0	0	0	0	113.7	S62 V63 M64	S62-S66 PolarHBondContact O-N 3.18Å; V63-S66 WeakPolarHBondContact O-CB 3.49Å; V63-S66 PolarHBondContact O-N 3.49Å; V63-S66 PolarHBondContact O-OG 3.36Å; M64-S66 PolarHBondContact O-N 3.18Å
67	V	82.7	Confident	87.7	Confident	30 Å²	30	75.2 Å²	75.2	18%	0.182	43%	0.427	C	S	.	.	S	Bend	trans	-95.1	154.7	-178.8	177.9	0	0	0	0	109.2	V63 M64 S65 P69 I74 I82	V63-V67 WeakPolarHBondContact O-CG2 3.16Å; V63-V67 PolarHBondContact O-N 3.49Å; M64-V67 PolarHBondContact O-N 2.96Å; S65-V67 VanDerWaalsContact C-N 3.31Å; V67-P69 WeakPolarHBondContact O-CD 3.42Å; V67-I74 HydrophobicContact CG2-CD1 4.43Å; V67-I74 HydrophobicContact CG2-CG1 3.94Å; V67-I82 HydrophobicContact CG2-CD1 4.41Å
68	N	75.6	Confident	87.7	Confident	89 Å²	89	69 Å²	69	48%	0.476	41%	0.407	S	S	.	.			trans	-58.1	120.8	-178.4	-175.1	-19.4	0	0	0	110.7	N70 T71	N68-N70 PolarHBondContact O-N 3.28Å; N68-N70 WeakPolarHBondContact OD1-CB 3.25Å; N68-N70 PolarHBondContact OD1-N 2.9Å; N68-T71 HydrophobicContact CB-CG2 4.06Å; N68-T71 PolarHBondContact O-N 3.19Å; N68-T71 PolarHBondContact O-OG1 3.5Å
69	P	73.9	Confident	87.7	Confident	123 Å²	123	62.6 Å²	62.6	80%	0.799	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.7	-177.9	25.3	-34.9	0	0	0	113.7	V67 T71	V67-P69 WeakPolarHBondContact O-CD 3.42Å; P69-T71 VanDerWaalsContact C-N 3.29Å
70	N	76.2	Confident	87.8	Confident	146 Å²	146	61.9 Å²	61.9	78%	0.781	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	0.1	177.2	-61	-30.4	0	0	0	113.6	N68	N68-N70 PolarHBondContact O-N 3.28Å; N68-N70 WeakPolarHBondContact OD1-CB 3.25Å; N68-N70 PolarHBondContact OD1-N 2.9Å
71	T	77.1	Confident	87.7	Confident	43 Å²	43	64.7 Å²	64.7	26%	0.264	39%	0.386	S	S	.	.	S	Bend	trans	-103.2	142.3	178.2	57.9	0	0	0	0	110.7	N68 P69 G73 L75	N68-T71 HydrophobicContact CB-CG2 4.06Å; N68-T71 PolarHBondContact O-N 3.19Å; N68-T71 PolarHBondContact O-OG1 3.5Å; P69-T71 VanDerWaalsContact C-N 3.29Å; T71-G73 PolarHBondContact O-N 3.42Å; T71-G73 VanDerWaalsContact O-N 3.13Å; T71-G73 PolarHBondContact OG1-O 3.3Å; T71-G73 VanDerWaalsContact OG1-O 3.13Å; T71-L75 HydrophobicContact CG2-CD1 4.12Å
72	S	82.9	Confident	87.8	Confident	97 Å²	97	63.3 Å²	63.3	68%	0.678	38%	0.379	S	S	*	.	S	Bend	trans	-66.4	-9.9	179.3	-55.4	0	0	0	0	113.9	Y37	Y37-S72 WeakPolarHBondContact CE2-O 3.38Å; Y37-S72 VanDerWaalsContact CZ-CB 3.47Å
73	G	89.5	Confident	88	Confident	10 Å²	10	59.4 Å²	59.4	10%	0.103	35%	0.352	C	S	.	.	S	Bend	trans	173.1	-159.5	177.4	0	0	0	0	0	111.7	L38 T71 L75	L38-G73 WeakPolarHBondContact O-CA 3.45Å; T71-G73 PolarHBondContact O-N 3.42Å; T71-G73 VanDerWaalsContact O-N 3.13Å; T71-G73 PolarHBondContact OG1-O 3.3Å; T71-G73 VanDerWaalsContact OG1-O 3.13Å; G73-L75 PolarHBondContact O-N 2.98Å
74	I	94.1	Very high	88.1	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	111.4	-175.2	-53.2	-180	0	0	0	109.9	F27 Y37 L38 F43 V63 M64 V67 F79 I82	F27-I74 WeakPolarHBondContact CE2-O 3.23Å; Y37-I74 CarbonylContact C-O 3.57Å; Y37-I74 WeakPolarHBondContact CA-O 3.43Å; L38-I74 HydrophobicContact CB-CB 4.34Å; L38-I74 PolarHBondContact N-O 3.49Å; L38-I74 PolarHBondContact O-N 3.41Å; F43-I74 HydrophobicContact CB-CD1 4.11Å; F43-I74 HydrophobicContact CD1-CD1 4.36Å; F43-I74 HydrophobicContact CD2-CD1 3.59Å; F43-I74 HydrophobicContact CE2-CD1 4.1Å; F43-I74 HydrophobicContact CG-CD1 3.74Å; V63-I74 HydrophobicContact CG1-CD1 3.83Å; M64-I74 HydrophobicContact CE-CD1 3.5Å; M64-I74 HydrophobicContact CE-CG1 4.03Å; M64-I74 HydrophobicContact SD-CD1 3.96Å; M64-I74 HydrophobicContact SD-CG1 4Å; V67-I74 HydrophobicContact CG2-CD1 4.43Å; V67-I74 HydrophobicContact CG2-CG1 3.94Å; I74-F79 HydrophobicContact CG2-CB 3.84Å; I74-I82 HydrophobicContact CD1-CD1 4.08Å; I74-I82 HydrophobicContact CG2-CD1 3.91Å
75	L	94.6	Very high	88.2	Confident	87 Å²	87	66 Å²	66	46%	0.455	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	159.2	171.7	-60	176.1	0	0	0	111.7	G36 T71 G73 E77 G78 F79	G36-L75 WeakPolarHBondContact O-CD2 3.33Å; T71-L75 HydrophobicContact CG2-CD1 4.12Å; G73-L75 PolarHBondContact O-N 2.98Å; L75-E77 VanDerWaalsContact C-N 3.3Å; L75-E77 PolarHBondContact O-N 3.5Å; L75-G78 WeakPolarHBondContact O-CA 3.41Å; L75-G78 PolarHBondContact O-N 3.43Å; L75-F79 PolarHBondContact O-N 2.97Å
76	L	94.5	Very high	88.4	Confident	63 Å²	63	63.4 Å²	63.4	33%	0.33	35%	0.351	S	S	.	.	H	α-helix	trans	-50.5	-46.8	-178.9	176.9	62	0	0	0	113	V24 F27 G78 F79 L80	V24-L76 HydrophobicContact CG2-CD1 4.36Å; F27-L76 HydrophobicContact CB-CD1 3.74Å; F27-L76 HydrophobicContact CD1-CB 4.33Å; F27-L76 HydrophobicContact CD1-CD1 3.81Å; F27-L76 HydrophobicContact CD2-CB 4.35Å; F27-L76 HydrophobicContact CD2-CD1 3.88Å; F27-L76 HydrophobicContact CE1-CB 4.07Å; F27-L76 HydrophobicContact CE1-CD1 4.4Å; F27-L76 VanDerWaalsContact CE2-CA 3.43Å; F27-L76 HydrophobicContact CE2-CB 4.05Å; F27-L76 HydrophobicContact CE2-CD1 4.44Å; F27-L76 HydrophobicContact CG-CB 4.48Å; F27-L76 HydrophobicContact CG-CD1 3.52Å; F27-L76 HydrophobicContact CZ-CB 3.92Å; L76-G78 PolarHBondContact O-N 2.9Å; L76-F79 WeakPolarHBondContact O-CB 3.39Å; L76-F79 PolarHBondContact O-N 3.11Å; L76-L80 HydrophobicContact CD1-CD1 4.08Å; L76-L80 HydrophobicContact CD1-CD2 4.47Å; L76-L80 HydrophobicContact CD1-CG 4.04Å; L76-L80 HydrophobicContact CG-CD1 4.02Å; L76-L80 HydrophobicContact CG-CG 4.41Å; L76-L80 VanDerWaalsContact O-CG 3.27Å; L76-L80 WeakPolarHBondContact O-CG 3.34Å; L76-L80 PolarHBondContact O-N 3.32Å
77	E	92.6	Very high	88.8	Confident	164 Å²	164	61.4 Å²	61.4	77%	0.766	33%	0.331	S	S	*	.	H	α-helix	trans	-61.4	-44.6	179.1	-172.1	-174.7	171.4	0	0	112	L75 F79 L80 N81	L75-E77 VanDerWaalsContact C-N 3.3Å; L75-E77 PolarHBondContact O-N 3.5Å; E77-F79 VanDerWaalsContact C-N 3.34Å; E77-F79 PolarHBondContact O-N 3.45Å; E77-L80 PolarHBondContact O-N 2.96Å; E77-N81 WeakPolarHBondContact O-CB 3.48Å; E77-N81 PolarHBondContact O-N 2.88Å
78	G	93.2	Very high	89.1	Confident	26 Å²	26	62.9 Å²	62.9	27%	0.268	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-45	175.7	0	0	0	0	0	111.5	L75 L76 N81 I82	L75-G78 WeakPolarHBondContact O-CA 3.41Å; L75-G78 PolarHBondContact O-N 3.43Å; L76-G78 PolarHBondContact O-N 2.9Å; G78-N81 PolarHBondContact O-N 3.26Å; G78-I82 VanDerWaalsContact O-CD1 3.31Å; G78-I82 WeakPolarHBondContact O-CD1 3.4Å; G78-I82 VanDerWaalsContact O-CG1 3.24Å; G78-I82 WeakPolarHBondContact O-CG1 3.39Å; G78-I82 PolarHBondContact O-N 3.42Å
79	F	95.3	Very high	89.7	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-49.5	177	175.7	-102.5	0	0	0	112	W23 V26 F27 L38 F43 A46 L50 I74 L75 L76 E77 N81 I82 V83	W23-F79 HydrophobicContact CB-CE1 4.44Å; W23-F79 WeakPolarHBondContact O-CE1 3.32Å; V26-F79 HydrophobicContact CG1-CZ 4.2Å; F27-F79 HydrophobicContact CB-CD1 3.89Å; F27-F79 HydrophobicContact CB-CE1 3.93Å; F27-F79 HydrophobicContact CD2-CB 3.76Å; F27-F79 AromaticContact CD2-CD1 3.8Å; F27-F79 HydrophobicContact CD2-CD1 3.8Å; F27-F79 AromaticContact CD2-CG 3.77Å; F27-F79 HydrophobicContact CD2-CG 3.77Å; F27-F79 HydrophobicContact CE2-CB 4.12Å; F27-F79 HydrophobicContact CG-CD1 4.32Å; L38-F79 HydrophobicContact CD1-CD2 3.58Å; L38-F79 HydrophobicContact CD1-CE2 3.78Å; L38-F79 HydrophobicContact CD1-CG 4.15Å; L38-F79 HydrophobicContact CD1-CZ 4.5Å; F43-F79 HydrophobicContact CD2-CD2 4.3Å; F43-F79 HydrophobicContact CD2-CE2 4.43Å; F43-F79 HydrophobicContact CE2-CD2 4.43Å; A46-F79 HydrophobicContact CB-CE2 3.65Å; A46-F79 HydrophobicContact CB-CZ 3.93Å; L50-F79 HydrophobicContact CD1-CE1 4.25Å; L50-F79 HydrophobicContact CD1-CE2 4.34Å; L50-F79 HydrophobicContact CD1-CZ 3.54Å; I74-F79 HydrophobicContact CG2-CB 3.84Å; L75-F79 PolarHBondContact O-N 2.97Å; L76-F79 WeakPolarHBondContact O-CB 3.39Å; L76-F79 PolarHBondContact O-N 3.11Å; E77-F79 VanDerWaalsContact C-N 3.34Å; E77-F79 PolarHBondContact O-N 3.45Å; F79-N81 VanDerWaalsContact C-N 3.28Å; F79-N81 PolarHBondContact O-N 3.37Å; F79-I82 PolarHBondContact O-N 2.95Å; F79-I82 VanDerWaalsContact O-N 3.17Å; F79-V83 HydrophobicContact CD1-CG2 4.26Å; F79-V83 HydrophobicContact CD2-CG2 4.16Å; F79-V83 HydrophobicContact CE1-CG2 3.87Å; F79-V83 HydrophobicContact CE2-CG2 3.77Å; F79-V83 HydrophobicContact CG-CG2 4.42Å; F79-V83 HydrophobicContact CZ-CG2 3.63Å; F79-V83 WeakPolarHBondContact O-CG2 3.37Å; F79-V83 PolarHBondContact O-N 3.49Å
80	L	94.8	Very high	90.3	Very high	26 Å²	26	58.6 Å²	58.6	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-40.4	178.2	-68.4	172.1	0	0	0	111.5	W23 V24 L76 E77 R84	W23-L80 HydrophobicContact CB-CD2 3.67Å; W23-L80 HydrophobicContact CE3-CD2 4.08Å; V24-L80 HydrophobicContact CG2-CD1 4.38Å; V24-L80 HydrophobicContact CG2-CD2 4.09Å; L76-L80 HydrophobicContact CD1-CD1 4.08Å; L76-L80 HydrophobicContact CD1-CD2 4.47Å; L76-L80 HydrophobicContact CD1-CG 4.04Å; L76-L80 HydrophobicContact CG-CD1 4.02Å; L76-L80 HydrophobicContact CG-CG 4.41Å; L76-L80 VanDerWaalsContact O-CG 3.27Å; L76-L80 WeakPolarHBondContact O-CG 3.34Å; L76-L80 PolarHBondContact O-N 3.32Å; E77-L80 PolarHBondContact O-N 2.96Å; L80-R84 WeakPolarHBondContact O-CB 3.43Å; L80-R84 PolarHBondContact O-N 2.87Å
81	N	92.3	Very high	90.8	Very high	60 Å²	60	57 Å²	57	32%	0.321	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-43	176.2	-174	46.5	0	0	0	112.5	E77 G78 F79 R84 K85	E77-N81 WeakPolarHBondContact O-CB 3.48Å; E77-N81 PolarHBondContact O-N 2.88Å; G78-N81 PolarHBondContact O-N 3.26Å; F79-N81 VanDerWaalsContact C-N 3.28Å; F79-N81 PolarHBondContact O-N 3.37Å; N81-R84 PolarHBondContact OD1-NH2 3.3Å; N81-K85 WeakPolarHBondContact O-CB 3.48Å; N81-K85 WeakPolarHBondContact O-CG 3.2Å; N81-K85 PolarHBondContact O-N 2.7Å
82	I	93.4	Very high	91.2	Very high	26 Å²	26	57.7 Å²	57.7	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-50.6	176.8	-68.9	155.4	0	0	0	110.3	F43 V63 V67 I74 G78 F79 R84 K85 K86	F43-I82 HydrophobicContact CE2-CG2 4.11Å; F43-I82 HydrophobicContact CZ-CG2 4.11Å; V63-I82 HydrophobicContact CG1-CD1 3.42Å; V63-I82 VanDerWaalsContact CG1-CD1 3.42Å; V63-I82 HydrophobicContact CG1-CG1 4.08Å; V63-I82 HydrophobicContact CG1-CG2 4.2Å; V63-I82 HydrophobicContact CG2-CG2 4.34Å; V67-I82 HydrophobicContact CG2-CD1 4.41Å; I74-I82 HydrophobicContact CD1-CD1 4.08Å; I74-I82 HydrophobicContact CG2-CD1 3.91Å; G78-I82 VanDerWaalsContact O-CD1 3.31Å; G78-I82 WeakPolarHBondContact O-CD1 3.4Å; G78-I82 VanDerWaalsContact O-CG1 3.24Å; G78-I82 WeakPolarHBondContact O-CG1 3.39Å; G78-I82 PolarHBondContact O-N 3.42Å; F79-I82 PolarHBondContact O-N 2.95Å; F79-I82 VanDerWaalsContact O-N 3.17Å; I82-R84 VanDerWaalsContact C-N 3.35Å; I82-R84 PolarHBondContact O-N 3.42Å; I82-K85 PolarHBondContact O-N 2.79Å; I82-K86 WeakPolarHBondContact O-CB 3.34Å; I82-K86 PolarHBondContact O-N 3.02Å
83	V	94.8	Very high	91.3	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-44.4	-179.9	174.6	0	0	0	0	110.7	W23 L50 F51 F79 K86 K87	W23-V83 HydrophobicContact CD2-CB 4.33Å; W23-V83 HydrophobicContact CD2-CG1 3.51Å; W23-V83 HydrophobicContact CE3-CB 4.35Å; W23-V83 HydrophobicContact CE3-CG1 3.95Å; W23-V83 HydrophobicContact CG-CG1 3.8Å; W23-V83 HydrophobicContact CH2-CG1 4.35Å; W23-V83 HydrophobicContact CZ2-CG1 4Å; W23-V83 HydrophobicContact CZ3-CG1 4.34Å; L50-V83 HydrophobicContact CD1-CB 4.48Å; L50-V83 HydrophobicContact CD1-CG1 3.98Å; L50-V83 HydrophobicContact CD1-CG2 3.59Å; F51-V83 HydrophobicContact CZ-CG1 4.09Å; F79-V83 HydrophobicContact CD1-CG2 4.26Å; F79-V83 HydrophobicContact CD2-CG2 4.16Å; F79-V83 HydrophobicContact CE1-CG2 3.87Å; F79-V83 HydrophobicContact CE2-CG2 3.77Å; F79-V83 HydrophobicContact CG-CG2 4.42Å; F79-V83 HydrophobicContact CZ-CG2 3.63Å; F79-V83 WeakPolarHBondContact O-CG2 3.37Å; F79-V83 PolarHBondContact O-N 3.49Å; V83-K86 PolarHBondContact O-N 3.09Å; V83-K87 HydrophobicContact CG1-CG 4.26Å; V83-K87 WeakPolarHBondContact O-CB 3.33Å; V83-K87 WeakPolarHBondContact O-CG 3.45Å; V83-K87 PolarHBondContact O-N 3.33Å
84	R	93.2	Very high	91.1	Very high	84 Å²	84	63.6 Å²	63.6	32%	0.317	31%	0.305	S	S	.	.	H	α-helix	trans	-57.3	-56.2	176.6	-177.7	-177.6	62.8	85.2	-1.9	111.6	W13 W23 L80 N81 I82 K86 K87 E88	W13-R84 HydrophobicContact CZ3-CG 4.05Å; W23-R84 HydrophobicContact CH2-CB 4.16Å; W23-R84 HydrophobicContact CZ3-CB 3.89Å; L80-R84 WeakPolarHBondContact O-CB 3.43Å; L80-R84 PolarHBondContact O-N 2.87Å; N81-R84 PolarHBondContact OD1-NH2 3.3Å; I82-R84 VanDerWaalsContact C-N 3.35Å; I82-R84 PolarHBondContact O-N 3.42Å; R84-K86 PolarHBondContact O-N 3.29Å; R84-K87 PolarHBondContact O-N 2.91Å; R84-E88 IonicContact NH1-OE2 2.67Å; R84-E88 WeakPolarHBondContact O-CB 3.31Å; R84-E88 PolarHBondContact O-N 2.89Å
85	K	90.9	Very high	90.7	Very high	117 Å²	117	69.4 Å²	69.4	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-57.1	-39.4	179.8	-74.6	-179.8	177.7	-175.9	0	111.8	N81 I82 E88 A89	N81-K85 WeakPolarHBondContact O-CB 3.48Å; N81-K85 WeakPolarHBondContact O-CG 3.2Å; N81-K85 PolarHBondContact O-N 2.7Å; I82-K85 PolarHBondContact O-N 2.79Å; K85-E88 PolarHBondContact O-N 2.92Å; K85-A89 WeakPolarHBondContact O-CB 3.47Å; K85-A89 PolarHBondContact O-N 3.42Å
86	K	91.7	Very high	90.2	Very high	50 Å²	50	65.4 Å²	65.4	22%	0.217	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-43.3	179	-168.4	173.9	-177	81.5	0	112.6	F51 Y53 E59 I82 V83 R84 E88 A89 Q90	F51-K86 HydrophobicContact CD1-CD 4.25Å; F51-K86 HydrophobicContact CD2-CD 4.25Å; F51-K86 HydrophobicContact CE1-CB 4.24Å; F51-K86 HydrophobicContact CE1-CD 3.79Å; F51-K86 HydrophobicContact CE1-CG 3.83Å; F51-K86 HydrophobicContact CE2-CD 3.82Å; F51-K86 HydrophobicContact CG-CD 4.47Å; F51-K86 HydrophobicContact CZ-CB 4Å; F51-K86 HydrophobicContact CZ-CD 3.57Å; F51-K86 HydrophobicContact CZ-CG 3.91Å; Y53-K86 WeakPolarHBondContact OH-CE 3.42Å; Y53-K86 PolarHBondContact OH-NZ 2.92Å; E59-K86 WeakPolarHBondContact OE1-CE 3.42Å; E59-K86 IonicContact OE1-NZ 3.68Å; E59-K86 PolarHBondContact OE1-NZ 3.01Å; I82-K86 WeakPolarHBondContact O-CB 3.34Å; I82-K86 PolarHBondContact O-N 3.02Å; V83-K86 PolarHBondContact O-N 3.09Å; R84-K86 PolarHBondContact O-N 3.29Å; K86-E88 VanDerWaalsContact C-N 3.34Å; K86-A89 PolarHBondContact O-N 3.2Å; K86-Q90 WeakPolarHBondContact O-CG 3.32Å; K86-Q90 PolarHBondContact O-N 3.23Å
87	K	91.9	Very high	89.9	Confident	46 Å²	46	69.3 Å²	69.3	20%	0.2	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-38.4	175.1	-71.2	-74.8	-178.1	-171.3	0	111.4	W13 W23 L50 F51 V83 R84 Q90 R91	W13-K87 HydrophobicContact CH2-CB 3.68Å; W13-K87 HydrophobicContact CZ3-CB 3.83Å; W23-K87 HydrophobicContact CZ2-CG 4.02Å; L50-K87 PolarHBondContact O-NZ 2.72Å; F51-K87 HydrophobicContact CD1-CD 4.46Å; F51-K87 HydrophobicContact CE1-CD 3.68Å; F51-K87 HydrophobicContact CE1-CG 3.91Å; F51-K87 HydrophobicContact CZ-CD 4.33Å; F51-K87 HydrophobicContact CZ-CG 4.17Å; V83-K87 HydrophobicContact CG1-CG 4.26Å; V83-K87 WeakPolarHBondContact O-CB 3.33Å; V83-K87 WeakPolarHBondContact O-CG 3.45Å; V83-K87 PolarHBondContact O-N 3.33Å; R84-K87 PolarHBondContact O-N 2.91Å; K87-Q90 PolarHBondContact O-N 2.8Å; K87-R91 WeakPolarHBondContact O-CB 3.46Å; K87-R91 WeakPolarHBondContact O-CG 3.37Å; K87-R91 PolarHBondContact O-N 3.36Å
88	E	88.9	Confident	89.5	Confident	60 Å²	60	68.3 Å²	68.3	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-49.3	173.6	-173.1	171.4	-159.8	0	0	111.2	W13 R84 K85 K86 Q90 R91 Y92	W13-E88 HydrophobicContact CE3-CB 3.93Å; W13-E88 HydrophobicContact CE3-CG 4.46Å; W13-E88 HydrophobicContact CZ3-CB 4.31Å; R84-E88 IonicContact NH1-OE2 2.67Å; R84-E88 WeakPolarHBondContact O-CB 3.31Å; R84-E88 PolarHBondContact O-N 2.89Å; K85-E88 PolarHBondContact O-N 2.92Å; K86-E88 VanDerWaalsContact C-N 3.34Å; E88-Q90 VanDerWaalsContact C-N 3.34Å; E88-Q90 PolarHBondContact O-N 2.81Å; E88-R91 PolarHBondContact O-N 2.95Å; E88-Y92 PolarHBondContact O-N 3.19Å
89	A	87	Confident	89.1	Confident	60 Å²	60	69.8 Å²	69.8	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-40	175.6	0	0	0	0	0	112.8	K85 K86 R93	K85-A89 WeakPolarHBondContact O-CB 3.47Å; K85-A89 PolarHBondContact O-N 3.42Å; K86-A89 PolarHBondContact O-N 3.2Å; A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 PolarHBondContact O-N 3.35Å
90	Q	88.3	Confident	88.8	Confident	62 Å²	62	70.1 Å²	70.1	29%	0.29	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-42.9	174.3	-76	-176.7	-44.2	0	0	112.1	K86 K87 E88 N94	K86-Q90 WeakPolarHBondContact O-CG 3.32Å; K86-Q90 PolarHBondContact O-N 3.23Å; K87-Q90 PolarHBondContact O-N 2.8Å; E88-Q90 VanDerWaalsContact C-N 3.34Å; E88-Q90 PolarHBondContact O-N 2.81Å; Q90-N94 WeakPolarHBondContact O-CB 3.4Å; Q90-N94 PolarHBondContact O-N 3.31Å; Q90-N94 PolarHBondContact O-ND2 3.36Å; Q90-N94 PolarHBondContact O-OD1 3.19Å
91	R	85.8	Confident	88.3	Confident	114 Å²	114	71.2 Å²	71.2	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-63.2	-48.2	177.4	-76.2	174.5	177.2	-114.6	6.5	111	W13 E19 K87 E88 R93 N94 E95	W13-R91 VanDerWaalsContact CE2-CZ 3.44Å; W13-R91 VanDerWaalsContact CE2-NE 3.34Å; E19-R91 IonicContact OE1-CZ 2.61Å; E19-R91 IonicContact OE1-NH2 3.34Å; E19-R91 PolarHBondContact OE1-NH2 3.05Å; E19-R91 IonicContact OE2-NH2 3.7Å; K87-R91 WeakPolarHBondContact O-CB 3.46Å; K87-R91 WeakPolarHBondContact O-CG 3.37Å; K87-R91 PolarHBondContact O-N 3.36Å; E88-R91 PolarHBondContact O-N 2.95Å; R91-R93 PolarHBondContact O-N 3.49Å; R91-N94 WeakPolarHBondContact O-CB 3.47Å; R91-N94 PolarHBondContact O-N 3.46Å; R91-E95 PolarHBondContact O-N 2.89Å
92	Y	85	Confident	87.9	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.224	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-50.1	176.3	176.1	-99.6	0	0	0	111.6	E88 N94 E95 V96 L156 N157	E88-Y92 PolarHBondContact O-N 3.19Å; Y92-N94 VanDerWaalsContact C-N 3.26Å; Y92-N94 PolarHBondContact O-N 3.34Å; Y92-E95 WeakPolarHBondContact O-CB 3.42Å; Y92-E95 PolarHBondContact O-N 2.86Å; Y92-E95 VanDerWaalsContact O-N 3.09Å; Y92-V96 HydrophobicContact CD1-CG2 4.19Å; Y92-V96 HydrophobicContact CD2-CG2 4.46Å; Y92-V96 HydrophobicContact CE1-CG2 3.75Å; Y92-V96 HydrophobicContact CE2-CG2 4.06Å; Y92-V96 WeakPolarHBondContact O-CG2 3.43Å; Y92-V96 PolarHBondContact O-N 3.33Å; Y92-L156 PolarHBondContact OH-O 2.97Å; Y92-N157 PolarHBondContact OH-N 2.91Å
93	R	85.3	Confident	87.5	Confident	133 Å²	133	71.5 Å²	71.5	50%	0.502	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-37.6	178.1	-165.7	-178.7	77.3	-180	6.1	112.1	A89 R91 R97 F149	A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 PolarHBondContact O-N 3.35Å; R91-R93 PolarHBondContact O-N 3.49Å; R93-R97 WeakPolarHBondContact O-CB 3.38Å; R93-R97 PolarHBondContact O-N 3.49Å; R93-F149 HydrophobicContact CG-CZ 4.29Å
94	N	85.8	Confident	87.1	Confident	98 Å²	98	71.7 Å²	71.7	52%	0.524	34%	0.338	S	S	.	.	H	α-helix	trans	-68.1	-38	176.2	-70.5	-13.6	0	0	0	112.1	Q90 R91 Y92 R97 H98	Q90-N94 WeakPolarHBondContact O-CB 3.4Å; Q90-N94 PolarHBondContact O-N 3.31Å; Q90-N94 PolarHBondContact O-ND2 3.36Å; Q90-N94 PolarHBondContact O-OD1 3.19Å; R91-N94 WeakPolarHBondContact O-CB 3.47Å; R91-N94 PolarHBondContact O-N 3.46Å; Y92-N94 VanDerWaalsContact C-N 3.26Å; Y92-N94 PolarHBondContact O-N 3.34Å; N94-R97 PolarHBondContact O-N 2.96Å; N94-H98 WeakPolarHBondContact O-CB 3.46Å; N94-H98 PolarHBondContact O-N 2.95Å
95	E	85.1	Confident	86.4	Confident	121 Å²	121	70.3 Å²	70.3	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-63.8	-49.3	174.5	-176.5	173.4	-168.9	0	0	110.9	R91 Y92 R97 H98 I99	R91-E95 PolarHBondContact O-N 2.89Å; Y92-E95 WeakPolarHBondContact O-CB 3.42Å; Y92-E95 PolarHBondContact O-N 2.86Å; Y92-E95 VanDerWaalsContact O-N 3.09Å; E95-R97 VanDerWaalsContact C-N 3.29Å; E95-R97 PolarHBondContact O-N 3.26Å; E95-H98 WeakPolarHBondContact O-CB 2.94Å; E95-H98 PolarHBondContact O-N 3.42Å; E95-H98 VanDerWaalsContact O-N 3.09Å; E95-I99 HydrophobicContact CG-CD1 4.29Å; E95-I99 WeakPolarHBondContact O-CG1 3.37Å; E95-I99 PolarHBondContact O-N 3Å
96	V	85.2	Confident	86.1	Confident	3 Å²	3	72 Å²	72	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-56.5	-44.5	174.5	171.5	0	0	0	0	111.1	Y92 H98 I99 F100 F149 F152 E153 L156	Y92-V96 HydrophobicContact CD1-CG2 4.19Å; Y92-V96 HydrophobicContact CD2-CG2 4.46Å; Y92-V96 HydrophobicContact CE1-CG2 3.75Å; Y92-V96 HydrophobicContact CE2-CG2 4.06Å; Y92-V96 WeakPolarHBondContact O-CG2 3.43Å; Y92-V96 PolarHBondContact O-N 3.33Å; V96-H98 PolarHBondContact O-N 3.39Å; V96-I99 PolarHBondContact O-N 3.43Å; V96-F100 WeakPolarHBondContact O-CB 3.27Å; V96-F100 PolarHBondContact O-N 3.25Å; V96-F149 HydrophobicContact CG1-CE2 3.91Å; V96-F149 HydrophobicContact CG1-CZ 4.15Å; V96-F152 HydrophobicContact CG1-CD1 3.97Å; V96-F152 HydrophobicContact CG1-CE1 4.29Å; V96-E153 HydrophobicContact CG1-CB 4.26Å; V96-L156 HydrophobicContact CB-CD1 4.37Å; V96-L156 HydrophobicContact CG1-CD1 3.95Å; V96-L156 HydrophobicContact CG2-CD1 3.93Å
97	R	86.9	Confident	85.8	Confident	146 Å²	146	78 Å²	78	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-65	-37.7	176.7	-175.1	129.6	156.8	119.6	-3	112.8	R93 N94 E95 F100 T101 F149	R93-R97 WeakPolarHBondContact O-CB 3.38Å; R93-R97 PolarHBondContact O-N 3.49Å; N94-R97 PolarHBondContact O-N 2.96Å; E95-R97 VanDerWaalsContact C-N 3.29Å; E95-R97 PolarHBondContact O-N 3.26Å; R97-F100 PolarHBondContact O-N 3.06Å; R97-T101 WeakPolarHBondContact O-CB 3.18Å; R97-T101 PolarHBondContact O-N 3.08Å; R97-T101 PolarHBondContact O-OG1 2.94Å; R97-F149 HydrophobicContact CB-CE2 3.83Å; R97-F149 HydrophobicContact CB-CZ 4.15Å; R97-F149 HydrophobicContact CG-CE2 4.32Å
98	H	85.6	Confident	85.8	Confident	142 Å²	142	80.4 Å²	80.4	66%	0.657	37%	0.373	S	S	*	.	H	α-helix	trans	-64	-44.9	176	-173.6	71.6	0	0	0	111	N94 E95 V96 T101 A102	N94-H98 WeakPolarHBondContact O-CB 3.46Å; N94-H98 PolarHBondContact O-N 2.95Å; E95-H98 WeakPolarHBondContact O-CB 2.94Å; E95-H98 PolarHBondContact O-N 3.42Å; E95-H98 VanDerWaalsContact O-N 3.09Å; V96-H98 PolarHBondContact O-N 3.39Å; H98-T101 PolarHBondContact O-N 3.5Å; H98-A102 PolarHBondContact O-N 3.49Å
99	I	84.3	Confident	85.9	Confident	58 Å²	58	79.7 Å²	79.7	30%	0.297	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-49.2	176.1	-62.4	165.1	0	0	0	110.5	E95 V96 T101 A102 F103 F152	E95-I99 HydrophobicContact CG-CD1 4.29Å; E95-I99 WeakPolarHBondContact O-CG1 3.37Å; E95-I99 PolarHBondContact O-N 3Å; V96-I99 PolarHBondContact O-N 3.43Å; I99-T101 VanDerWaalsContact C-N 3.3Å; I99-T101 PolarHBondContact O-N 3.07Å; I99-A102 WeakPolarHBondContact O-CB 3.41Å; I99-A102 PolarHBondContact O-N 2.94Å; I99-A102 VanDerWaalsContact O-N 3.11Å; I99-F103 HydrophobicContact CG2-CD2 4.24Å; I99-F103 HydrophobicContact CG2-CE1 4.42Å; I99-F103 HydrophobicContact CG2-CE2 3.63Å; I99-F103 HydrophobicContact CG2-CZ 3.74Å; I99-F103 PolarHBondContact O-N 2.97Å; I99-F152 HydrophobicContact CB-CE1 4.29Å; I99-F152 HydrophobicContact CB-CZ 4.49Å; I99-F152 HydrophobicContact CG2-CE1 3.98Å; I99-F152 HydrophobicContact CG2-CZ 3.69Å
100	F	87.8	Confident	86.2	Confident	7 Å²	7	80 Å²	80	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-56.2	-46.2	178	-177.1	-89.5	0	0	0	111.9	V96 R97 A102 F103 D104 L111 F149 F152	V96-F100 WeakPolarHBondContact O-CB 3.27Å; V96-F100 PolarHBondContact O-N 3.25Å; R97-F100 PolarHBondContact O-N 3.06Å; F100-A102 VanDerWaalsContact C-N 3.29Å; F100-A102 PolarHBondContact O-N 3.32Å; F100-F103 PolarHBondContact O-N 3.08Å; F100-F103 VanDerWaalsContact O-N 3.07Å; F100-D104 HydrophobicContact CE1-CB 4.25Å; F100-D104 PolarHBondContact O-N 3.31Å; F100-L111 HydrophobicContact CD2-CD1 4.01Å; F100-L111 HydrophobicContact CD2-CG 4.17Å; F100-L111 HydrophobicContact CE2-CD1 3.98Å; F100-L111 HydrophobicContact CE2-CD2 4.43Å; F100-L111 HydrophobicContact CE2-CG 3.72Å; F100-L111 HydrophobicContact CZ-CG 4.12Å; F100-F149 HydrophobicContact CB-CD2 4.08Å; F100-F149 HydrophobicContact CB-CE2 4.39Å; F100-F149 HydrophobicContact CD1-CD2 4.18Å; F100-F149 HydrophobicContact CD2-CD2 4.23Å; F100-F149 HydrophobicContact CE1-CB 4.44Å; F100-F149 HydrophobicContact CE2-CB 4.35Å; F100-F149 AromaticContact CG-CD2 3.9Å; F100-F149 HydrophobicContact CG-CD2 3.9Å; F100-F149 HydrophobicContact CZ-CB 4.24Å; F100-F152 HydrophobicContact CB-CD1 3.94Å; F100-F152 HydrophobicContact CB-CE1 4.07Å; F100-F152 HydrophobicContact CD2-CB 3.72Å; F100-F152 AromaticContact CD2-CD1 3.84Å; F100-F152 HydrophobicContact CD2-CD1 3.84Å; F100-F152 HydrophobicContact CD2-CD2 4.28Å; F100-F152 AromaticContact CD2-CG 3.69Å; F100-F152 HydrophobicContact CD2-CG 3.69Å; F100-F152 HydrophobicContact CE2-CB 4.09Å; F100-F152 HydrophobicContact CE2-CG 4.44Å; F100-F152 HydrophobicContact CG-CD1 4.39Å
101	T	86.3	Confident	86.4	Confident	50 Å²	50	77 Å²	77	31%	0.307	36%	0.358	S	S	.	.	H	α-helix	trans	-65.8	-32	179.5	-51.8	0	0	0	0	112.1	R97 H98 I99 F103 Y107	R97-T101 WeakPolarHBondContact O-CB 3.18Å; R97-T101 PolarHBondContact O-N 3.08Å; R97-T101 PolarHBondContact O-OG1 2.94Å; H98-T101 PolarHBondContact O-N 3.5Å; I99-T101 VanDerWaalsContact C-N 3.3Å; I99-T101 PolarHBondContact O-N 3.07Å; T101-F103 PolarHBondContact O-N 3.36Å; T101-Y107 HydrophobicContact CG2-CD1 4.07Å; T101-Y107 HydrophobicContact CG2-CE1 3.53Å
102	A	83.3	Confident	86.7	Confident	62 Å²	62	73 Å²	73	51%	0.512	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-27.9	174.3	0	0	0	0	0	112.4	H98 I99 F100	H98-A102 PolarHBondContact O-N 3.49Å; I99-A102 WeakPolarHBondContact O-CB 3.41Å; I99-A102 PolarHBondContact O-N 2.94Å; I99-A102 VanDerWaalsContact O-N 3.11Å; F100-A102 VanDerWaalsContact C-N 3.29Å; F100-A102 PolarHBondContact O-N 3.32Å
103	F	84.4	Confident	87	Confident	30 Å²	30	72.9 Å²	72.9	13%	0.132	35%	0.349	C	S	.	.	H	α-helix	trans	-85.8	-35.7	176.7	-61.3	-15.8	0	0	0	112.4	I99 F100 T101 T105 L111 A119 F152	I99-F103 HydrophobicContact CG2-CD2 4.24Å; I99-F103 HydrophobicContact CG2-CE1 4.42Å; I99-F103 HydrophobicContact CG2-CE2 3.63Å; I99-F103 HydrophobicContact CG2-CZ 3.74Å; I99-F103 PolarHBondContact O-N 2.97Å; F100-F103 PolarHBondContact O-N 3.08Å; F100-F103 VanDerWaalsContact O-N 3.07Å; T101-F103 PolarHBondContact O-N 3.36Å; F103-T105 PolarHBondContact O-N 2.97Å; F103-L111 VanDerWaalsContact C-CD2 3.42Å; F103-L111 HydrophobicContact CB-CD1 3.87Å; F103-L111 HydrophobicContact CB-CD2 3.61Å; F103-L111 HydrophobicContact CB-CG 4.42Å; F103-L111 HydrophobicContact CD2-CD1 4.15Å; F103-A119 HydrophobicContact CB-CB 4.15Å; F103-A119 HydrophobicContact CD1-CB 3.27Å; F103-A119 HydrophobicContact CD2-CB 3.96Å; F103-A119 HydrophobicContact CE1-CB 3.5Å; F103-A119 VanDerWaalsContact CE1-CB 3.5Å; F103-A119 HydrophobicContact CE2-CB 4.14Å; F103-A119 HydrophobicContact CG-CB 3.53Å; F103-A119 HydrophobicContact CZ-CB 3.93Å; F103-F152 AromaticContact CD2-CE2 3.98Å; F103-F152 HydrophobicContact CD2-CE2 3.98Å; F103-F152 AromaticContact CD2-CZ 3.97Å; F103-F152 HydrophobicContact CD2-CZ 3.97Å; F103-F152 HydrophobicContact CE2-CE2 4.01Å; F103-F152 AromaticContact CE2-CZ 3.83Å; F103-F152 HydrophobicContact CE2-CZ 3.83Å
104	D	85.8	Confident	87.3	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.032	36%	0.361	C	S	.	.			trans	-78	69.1	176.9	-175.2	11.9	0	0	0	111.2	F100 Y106 Y107 R108 G109 L111	F100-D104 HydrophobicContact CE1-CB 4.25Å; F100-D104 PolarHBondContact O-N 3.31Å; D104-Y106 PolarHBondContact O-N 3.09Å; D104-Y107 PolarHBondContact O-N 3.33Å; D104-Y107 PolarHBondContact OD1-N 2.69Å; D104-Y107 VanDerWaalsContact OD1-N 3.1Å; D104-Y107 VanDerWaalsContact OD2-C 3.26Å; D104-Y107 VanDerWaalsContact OD2-CA 3.28Å; D104-Y107 WeakPolarHBondContact OD2-CA 3.37Å; D104-R108 VanDerWaalsContact CG-N 3.33Å; D104-R108 PolarHBondContact OD1-N 2.95Å; D104-R108 PolarHBondContact OD2-N 2.71Å; D104-G109 WeakPolarHBondContact OD2-CA 3.44Å; D104-G109 PolarHBondContact OD2-N 2.74Å; D104-L111 HydrophobicContact CB-CD2 3.63Å
105	T	78.9	Confident	87.5	Confident	54 Å²	54	69.7 Å²	69.7	33%	0.331	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.6	-173.6	55.6	0	0	0	0	114.7	F103	F103-T105 PolarHBondContact O-N 2.97Å
106	Y	85.4	Confident	87.6	Confident	153 Å²	153	64.2 Å²	64.2	60%	0.6	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	5.7	179.4	-60.1	-81.7	0	0	0	113.3	D104 R108	D104-Y106 PolarHBondContact O-N 3.09Å; Y106-R108 VanDerWaalsContact C-N 3.27Å; Y106-R108 VanDerWaalsContact CB-NH1 3.31Å; Y106-R108 VanDerWaalsContact CG-NH1 3.28Å; Y106-R108 PolarHBondContact O-N 2.61Å
107	Y	85.4	Confident	87.8	Confident	176 Å²	176	66 Å²	66	69%	0.69	32%	0.319	S	S	*	.			trans	53.4	39.1	178.2	-57.4	-83.4	0	0	0	114.1	T101 D104 G109	T101-Y107 HydrophobicContact CG2-CD1 4.07Å; T101-Y107 HydrophobicContact CG2-CE1 3.53Å; D104-Y107 PolarHBondContact O-N 3.33Å; D104-Y107 PolarHBondContact OD1-N 2.69Å; D104-Y107 VanDerWaalsContact OD1-N 3.1Å; D104-Y107 VanDerWaalsContact OD2-C 3.26Å; D104-Y107 VanDerWaalsContact OD2-CA 3.28Å; D104-Y107 WeakPolarHBondContact OD2-CA 3.37Å; Y107-G109 VanDerWaalsContact C-N 3.28Å; Y107-G109 PolarHBondContact O-N 3.36Å
108	R	91.1	Very high	87.9	Confident	96 Å²	96	63.4 Å²	63.4	36%	0.362	31%	0.312	S	S	.	.			trans	-75.6	-17.5	178.9	-70.5	-177.1	-71.5	-101.6	-2.4	113.2	D104 Y106 F110 D115	D104-R108 VanDerWaalsContact CG-N 3.33Å; D104-R108 PolarHBondContact OD1-N 2.95Å; D104-R108 PolarHBondContact OD2-N 2.71Å; Y106-R108 VanDerWaalsContact C-N 3.27Å; Y106-R108 VanDerWaalsContact CB-NH1 3.31Å; Y106-R108 VanDerWaalsContact CG-NH1 3.28Å; Y106-R108 PolarHBondContact O-N 2.61Å; R108-F110 VanDerWaalsContact C-N 3.33Å; R108-F110 HydrophobicContact CB-CD1 3.98Å; R108-F110 HydrophobicContact CB-CD2 4.39Å; R108-F110 HydrophobicContact CB-CE1 3.73Å; R108-F110 HydrophobicContact CB-CE2 4.15Å; R108-F110 HydrophobicContact CB-CG 4.32Å; R108-F110 HydrophobicContact CB-CZ 3.84Å; R108-F110 HydrophobicContact CG-CZ 4.3Å; R108-F110 WeakPolarHBondContact O-CD1 3.36Å; R108-D115 IonicContact CZ-OD2 2.61Å; R108-D115 IonicContact NH2-OD1 2.81Å; R108-D115 PolarHBondContact NH2-OD1 2.9Å; R108-D115 IonicContact NH2-OD2 3.75Å; R108-D115 PolarHBondContact NH2-OD2 2.91Å
109	G	90.7	Very high	87.9	Confident	45 Å²	45	56.8 Å²	56.8	46%	0.464	28%	0.282	S	S	.	.	S	Bend	trans	85.7	4.9	-173	0	0	0	0	0	113.9	D104 Y107	D104-G109 WeakPolarHBondContact OD2-CA 3.44Å; D104-G109 PolarHBondContact OD2-N 2.74Å; Y107-G109 VanDerWaalsContact C-N 3.28Å; Y107-G109 PolarHBondContact O-N 3.36Å
110	F	93.3	Very high	87.9	Confident	66 Å²	66	56.2 Å²	56.2	29%	0.289	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.1	178	60.3	-99.8	0	0	0	110.4	R108 T112 H146 V147	R108-F110 VanDerWaalsContact C-N 3.33Å; R108-F110 HydrophobicContact CB-CD1 3.98Å; R108-F110 HydrophobicContact CB-CD2 4.39Å; R108-F110 HydrophobicContact CB-CE1 3.73Å; R108-F110 HydrophobicContact CB-CE2 4.15Å; R108-F110 HydrophobicContact CB-CG 4.32Å; R108-F110 HydrophobicContact CB-CZ 3.84Å; R108-F110 HydrophobicContact CG-CZ 4.3Å; R108-F110 WeakPolarHBondContact O-CD1 3.36Å; F110-T112 HydrophobicContact CD2-CG2 4.33Å; F110-T112 HydrophobicContact CE2-CG2 3.99Å; F110-H146 HydrophobicContact CB-CB 4.05Å; F110-H146 HydrophobicContact CD2-CB 3.91Å; F110-H146 AromaticContact CD2-CD2 3.27Å; F110-H146 WeakPolarHBondContact CD2-CD2 3.5Å; F110-H146 AromaticContact CD2-CG 3.79Å; F110-H146 AromaticContact CE2-CD2 3.23Å; F110-H146 WeakPolarHBondContact CE2-CD2 3.34Å; F110-H146 AromaticContact CE2-NE2 3.76Å; F110-H146 HydrophobicContact CG-CB 4.16Å; F110-V147 WeakPolarHBondContact CA-O 3.49Å
111	L	92.5	Very high	87.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.4	175.2	-54.3	176.4	0	0	0	109.8	F100 F103 D104 D115 F116 V147 F152	F100-L111 HydrophobicContact CD2-CD1 4.01Å; F100-L111 HydrophobicContact CD2-CG 4.17Å; F100-L111 HydrophobicContact CE2-CD1 3.98Å; F100-L111 HydrophobicContact CE2-CD2 4.43Å; F100-L111 HydrophobicContact CE2-CG 3.72Å; F100-L111 HydrophobicContact CZ-CG 4.12Å; F103-L111 VanDerWaalsContact C-CD2 3.42Å; F103-L111 HydrophobicContact CB-CD1 3.87Å; F103-L111 HydrophobicContact CB-CD2 3.61Å; F103-L111 HydrophobicContact CB-CG 4.42Å; F103-L111 HydrophobicContact CD2-CD1 4.15Å; D104-L111 HydrophobicContact CB-CD2 3.63Å; L111-D115 HydrophobicContact CB-CB 4.32Å; L111-D115 HydrophobicContact CD2-CB 4.17Å; L111-F116 HydrophobicContact CD1-CD2 4.21Å; L111-V147 HydrophobicContact CB-CB 4.2Å; L111-V147 PolarHBondContact N-O 3.38Å; L111-V147 PolarHBondContact O-N 3.03Å; L111-F152 HydrophobicContact CD1-CD2 4.17Å; L111-F152 HydrophobicContact CD1-CE2 4.35Å
112	T	93.4	Very high	87.7	Confident	31 Å²	31	67.6 Å²	67.6	19%	0.19	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	165.2	166.2	66.2	0	0	0	0	109.7	F110 E114 D115 F116	F110-T112 HydrophobicContact CD2-CG2 4.33Å; F110-T112 HydrophobicContact CE2-CG2 3.99Å; T112-E114 PolarHBondContact O-N 3.02Å; T112-E114 PolarHBondContact OG1-N 3.46Å; T112-D115 WeakPolarHBondContact CB-OD2 3.37Å; T112-D115 PolarHBondContact N-OD2 3.17Å; T112-D115 PolarHBondContact O-N 2.96Å; T112-D115 VanDerWaalsContact O-N 3.14Å; T112-D115 VanDerWaalsContact OG1-CG 3.23Å; T112-D115 PolarHBondContact OG1-N 3.39Å; T112-D115 PolarHBondContact OG1-OD2 3.34Å; T112-F116 PolarHBondContact O-N 3.43Å
113	L	91.4	Very high	87.5	Confident	53 Å²	53	69.2 Å²	69.2	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-56.5	-33.5	172.7	175.9	61.7	0	0	0	112.7	F116 K117 L133 F136	L113-F116 PolarHBondContact O-N 3.29Å; L113-K117 HydrophobicContact CD1-CD 4.41Å; L113-K117 HydrophobicContact CD1-CG 4.21Å; L113-K117 HydrophobicContact CG-CD 4.25Å; L113-K117 HydrophobicContact CG-CG 4.48Å; L113-K117 WeakPolarHBondContact O-CB 3.49Å; L113-K117 VanDerWaalsContact O-CG 3.29Å; L113-K117 WeakPolarHBondContact O-CG 3.32Å; L113-K117 PolarHBondContact O-N 2.99Å; L113-L133 HydrophobicContact CD1-CD2 3.68Å; L113-L133 HydrophobicContact CD2-CD2 3.52Å; L113-L133 HydrophobicContact CG-CD2 4.14Å; L113-F136 HydrophobicContact CB-CD2 4.38Å; L113-F136 HydrophobicContact CB-CE1 4.31Å; L113-F136 HydrophobicContact CB-CE2 4.14Å; L113-F136 HydrophobicContact CB-CZ 4.11Å; L113-F136 HydrophobicContact CD1-CB 3.9Å; L113-F136 HydrophobicContact CD1-CD1 4.11Å; L113-F136 HydrophobicContact CD1-CD2 3.95Å; L113-F136 HydrophobicContact CD1-CG 3.69Å
114	E	90.7	Very high	87.2	Confident	159 Å²	159	69.5 Å²	69.5	74%	0.743	33%	0.331	S	S	*	.	H	α-helix	trans	-68	-43.1	176.7	-70	-167.9	157.3	0	0	112.3	T112 F116 K117 K118	T112-E114 PolarHBondContact O-N 3.02Å; T112-E114 PolarHBondContact OG1-N 3.46Å; E114-F116 VanDerWaalsContact C-N 3.29Å; E114-F116 PolarHBondContact O-N 3.28Å; E114-K117 PolarHBondContact O-N 3.46Å; E114-K118 WeakPolarHBondContact O-CB 3.44Å; E114-K118 PolarHBondContact O-N 2.95Å
115	D	90.6	Very high	87.2	Confident	6 Å²	6	73.9 Å²	73.9	3%	0.032	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-44.8	174.7	-56.5	-51.8	0	0	0	110.3	R108 L111 T112 K118 A119	R108-D115 IonicContact CZ-OD2 2.61Å; R108-D115 IonicContact NH2-OD1 2.81Å; R108-D115 PolarHBondContact NH2-OD1 2.9Å; R108-D115 IonicContact NH2-OD2 3.75Å; R108-D115 PolarHBondContact NH2-OD2 2.91Å; L111-D115 HydrophobicContact CB-CB 4.32Å; L111-D115 HydrophobicContact CD2-CB 4.17Å; T112-D115 WeakPolarHBondContact CB-OD2 3.37Å; T112-D115 PolarHBondContact N-OD2 3.17Å; T112-D115 PolarHBondContact O-N 2.96Å; T112-D115 VanDerWaalsContact O-N 3.14Å; T112-D115 VanDerWaalsContact OG1-CG 3.23Å; T112-D115 PolarHBondContact OG1-N 3.39Å; T112-D115 PolarHBondContact OG1-OD2 3.34Å; D115-K118 PolarHBondContact O-N 3.29Å; D115-A119 WeakPolarHBondContact O-CB 2.96Å; D115-A119 PolarHBondContact O-N 2.87Å
116	F	87.6	Confident	87.5	Confident	6 Å²	6	81.1 Å²	81.1	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-62.3	-47.2	179	-152.2	-100.1	0	0	0	111.5	L111 T112 L113 E114 K118 A119 F120 V132 V135 F136 V139	L111-F116 HydrophobicContact CD1-CD2 4.21Å; T112-F116 PolarHBondContact O-N 3.43Å; L113-F116 PolarHBondContact O-N 3.29Å; E114-F116 VanDerWaalsContact C-N 3.29Å; E114-F116 PolarHBondContact O-N 3.28Å; F116-K118 VanDerWaalsContact C-N 3.35Å; F116-K118 PolarHBondContact O-N 3.02Å; F116-A119 WeakPolarHBondContact O-CB 3.4Å; F116-A119 PolarHBondContact O-N 3.31Å; F116-F120 AromaticContact CD1-CD2 3.8Å; F116-F120 HydrophobicContact CD1-CD2 3.8Å; F116-F120 AromaticContact CD1-CE2 3.74Å; F116-F120 HydrophobicContact CD1-CE2 3.74Å; F116-F120 AromaticContact CE1-CD2 3.78Å; F116-F120 HydrophobicContact CE1-CD2 3.78Å; F116-F120 AromaticContact CE1-CE2 3.23Å; F116-F120 HydrophobicContact CE1-CE2 3.23Å; F116-F120 HydrophobicContact CE1-CZ 4.01Å; F116-F120 HydrophobicContact CE2-CE2 4.14Å; F116-F120 HydrophobicContact CG-CD2 4.4Å; F116-F120 HydrophobicContact CG-CE2 4.38Å; F116-F120 HydrophobicContact CZ-CD2 4.34Å; F116-F120 AromaticContact CZ-CE2 3.47Å; F116-F120 HydrophobicContact CZ-CE2 3.47Å; F116-F120 VanDerWaalsContact CZ-CE2 3.47Å; F116-F120 HydrophobicContact CZ-CZ 4.17Å; F116-F120 WeakPolarHBondContact O-CD2 3.39Å; F116-F120 PolarHBondContact O-N 3.48Å; F116-V132 HydrophobicContact CD1-CG1 3.8Å; F116-V132 HydrophobicContact CE1-CG1 4.32Å; F116-V135 HydrophobicContact CE1-CB 4.37Å; F116-V135 HydrophobicContact CE1-CG1 3.9Å; F116-V135 HydrophobicContact CZ-CG1 3.93Å; F116-F136 HydrophobicContact CB-CD2 3.74Å; F116-F136 HydrophobicContact CB-CE2 4.19Å; F116-F136 HydrophobicContact CD1-CB 4.06Å; F116-F136 AromaticContact CD1-CD2 3.95Å; F116-F136 HydrophobicContact CD1-CD2 3.95Å; F116-F136 HydrophobicContact CD2-CD2 4.12Å; F116-F136 HydrophobicContact CE1-CB 4.22Å; F116-F136 AromaticContact CG-CD2 3.7Å; F116-F136 HydrophobicContact CG-CD2 3.7Å; F116-F136 HydrophobicContact CG-CE2 4.44Å; F116-V139 HydrophobicContact CZ-CG2 4.5Å
117	K	89.1	Confident	87.5	Confident	39 Å²	39	77 Å²	77	17%	0.17	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-43.7	174.3	-75.3	176.2	-178.8	-173.9	0	112.2	L113 E114 F120 R121 E129 V132	L113-K117 HydrophobicContact CD1-CD 4.41Å; L113-K117 HydrophobicContact CD1-CG 4.21Å; L113-K117 HydrophobicContact CG-CD 4.25Å; L113-K117 HydrophobicContact CG-CG 4.48Å; L113-K117 WeakPolarHBondContact O-CB 3.49Å; L113-K117 VanDerWaalsContact O-CG 3.29Å; L113-K117 WeakPolarHBondContact O-CG 3.32Å; L113-K117 PolarHBondContact O-N 2.99Å; E114-K117 PolarHBondContact O-N 3.46Å; K117-F120 PolarHBondContact O-N 2.91Å; K117-R121 VanDerWaalsContact O-CG 3.3Å; K117-R121 WeakPolarHBondContact O-CG 3.43Å; K117-R121 PolarHBondContact O-N 3.13Å; K117-E129 HydrophobicContact CD-CG 4.42Å; K117-E129 WeakPolarHBondContact CE-OE1 3.47Å; K117-E129 IonicContact NZ-OE1 2.87Å; K117-E129 PolarHBondContact NZ-OE1 3.15Å; K117-V132 HydrophobicContact CG-CG1 4.1Å
118	K	88.7	Confident	87.8	Confident	92 Å²	92	72.1 Å²	72.1	40%	0.4	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-44.2	179.4	-175.5	179.5	175.5	-174.7	0	111.2	E114 D115 F116 R121 Q122	E114-K118 WeakPolarHBondContact O-CB 3.44Å; E114-K118 PolarHBondContact O-N 2.95Å; D115-K118 PolarHBondContact O-N 3.29Å; F116-K118 VanDerWaalsContact C-N 3.35Å; F116-K118 PolarHBondContact O-N 3.02Å; K118-R121 PolarHBondContact O-N 3.04Å; K118-Q122 PolarHBondContact O-N 3.2Å
119	A	84.9	Confident	87.7	Confident	4 Å²	4	72.1 Å²	72.1	3%	0.033	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-52.9	174.8	0	0	0	0	0	111.7	F103 D115 F116 R121 Q122 V123	F103-A119 HydrophobicContact CB-CB 4.15Å; F103-A119 HydrophobicContact CD1-CB 3.27Å; F103-A119 HydrophobicContact CD2-CB 3.96Å; F103-A119 HydrophobicContact CE1-CB 3.5Å; F103-A119 VanDerWaalsContact CE1-CB 3.5Å; F103-A119 HydrophobicContact CE2-CB 4.14Å; F103-A119 HydrophobicContact CG-CB 3.53Å; F103-A119 HydrophobicContact CZ-CB 3.93Å; D115-A119 WeakPolarHBondContact O-CB 2.96Å; D115-A119 PolarHBondContact O-N 2.87Å; F116-A119 WeakPolarHBondContact O-CB 3.4Å; F116-A119 PolarHBondContact O-N 3.31Å; A119-R121 VanDerWaalsContact C-N 3.32Å; A119-R121 PolarHBondContact O-N 2.9Å; A119-Q122 WeakPolarHBondContact O-CB 3.41Å; A119-Q122 PolarHBondContact O-N 3.19Å; A119-V123 WeakPolarHBondContact O-CG2 3.37Å; A119-V123 PolarHBondContact O-N 3.39Å; A119-V123 VanDerWaalsContact O-N 3.11Å
120	F	85.8	Confident	87.8	Confident	45 Å²	45	78.7 Å²	78.7	20%	0.197	38%	0.38	C	S	.	.	H	α-helix	trans	-63.3	-34	-179.4	-88.8	-92.9	0	0	0	113.5	F116 K117 Q122 V123 A124 L127 V132	F116-F120 AromaticContact CD1-CD2 3.8Å; F116-F120 HydrophobicContact CD1-CD2 3.8Å; F116-F120 AromaticContact CD1-CE2 3.74Å; F116-F120 HydrophobicContact CD1-CE2 3.74Å; F116-F120 AromaticContact CE1-CD2 3.78Å; F116-F120 HydrophobicContact CE1-CD2 3.78Å; F116-F120 AromaticContact CE1-CE2 3.23Å; F116-F120 HydrophobicContact CE1-CE2 3.23Å; F116-F120 HydrophobicContact CE1-CZ 4.01Å; F116-F120 HydrophobicContact CE2-CE2 4.14Å; F116-F120 HydrophobicContact CG-CD2 4.4Å; F116-F120 HydrophobicContact CG-CE2 4.38Å; F116-F120 HydrophobicContact CZ-CD2 4.34Å; F116-F120 AromaticContact CZ-CE2 3.47Å; F116-F120 HydrophobicContact CZ-CE2 3.47Å; F116-F120 VanDerWaalsContact CZ-CE2 3.47Å; F116-F120 HydrophobicContact CZ-CZ 4.17Å; F116-F120 WeakPolarHBondContact O-CD2 3.39Å; F116-F120 PolarHBondContact O-N 3.48Å; K117-F120 PolarHBondContact O-N 2.91Å; F120-Q122 PolarHBondContact O-N 3.47Å; F120-V123 PolarHBondContact O-N 3.05Å; F120-A124 HydrophobicContact CD1-CB 4.46Å; F120-A124 CarbonylContact O-C 3.09Å; F120-A124 VanDerWaalsContact O-CA 3.32Å; F120-A124 WeakPolarHBondContact O-CA 3.34Å; F120-A124 PolarHBondContact O-N 3.47Å; F120-L127 HydrophobicContact CD1-CD2 3.51Å; F120-L127 HydrophobicContact CE1-CD2 3.75Å; F120-V132 HydrophobicContact CB-CG1 4.18Å; F120-V132 HydrophobicContact CB-CG2 3.84Å; F120-V132 HydrophobicContact CD1-CG2 4.18Å; F120-V132 HydrophobicContact CD2-CG1 4.17Å; F120-V132 HydrophobicContact CG-CG1 4.17Å; F120-V132 HydrophobicContact CG-CG2 4.01Å
121	R	86.8	Confident	87.6	Confident	157 Å²	157	77.8 Å²	77.8	59%	0.592	38%	0.38	S	S	*	.	H	α-helix	trans	-62.3	-31.1	172.5	-73.1	175.3	-162.4	165.2	4.1	112.9	K117 K118 A119 P125	K117-R121 VanDerWaalsContact O-CG 3.3Å; K117-R121 WeakPolarHBondContact O-CG 3.43Å; K117-R121 PolarHBondContact O-N 3.13Å; K118-R121 PolarHBondContact O-N 3.04Å; A119-R121 VanDerWaalsContact C-N 3.32Å; A119-R121 PolarHBondContact O-N 2.9Å; R121-P125 WeakPolarHBondContact O-CB 3.35Å
122	Q	82.3	Confident	87.4	Confident	139 Å²	139	78.1 Å²	78.1	65%	0.65	38%	0.382	S	S	*	.	H	α-helix	trans	-80	-43.2	179.3	-67.5	178.4	0.1	0	0	112.1	K118 A119 F120	K118-Q122 PolarHBondContact O-N 3.2Å; A119-Q122 WeakPolarHBondContact O-CB 3.41Å; A119-Q122 PolarHBondContact O-N 3.19Å; F120-Q122 PolarHBondContact O-N 3.47Å
123	V	78.1	Confident	87.3	Confident	96 Å²	96	79.3 Å²	79.3	58%	0.582	39%	0.387	S	S	*	.	H	α-helix	trans	-91.6	-28.6	-173.4	-57.2	0	0	0	0	113.8	A119 F120	A119-V123 WeakPolarHBondContact O-CG2 3.37Å; A119-V123 PolarHBondContact O-N 3.39Å; A119-V123 VanDerWaalsContact O-N 3.11Å; F120-V123 PolarHBondContact O-N 3.05Å
124	A	79.3	Confident	87.3	Confident	36 Å²	36	81.4 Å²	81.4	30%	0.298	40%	0.395	S	S	.	.			trans	-142.9	63	-176.3	0	0	0	0	0	111.2	F120 K126 L127	F120-A124 HydrophobicContact CD1-CB 4.46Å; F120-A124 CarbonylContact O-C 3.09Å; F120-A124 VanDerWaalsContact O-CA 3.32Å; F120-A124 WeakPolarHBondContact O-CA 3.34Å; F120-A124 PolarHBondContact O-N 3.47Å; A124-K126 PolarHBondContact O-N 3.34Å; A124-L127 HydrophobicContact CB-CB 4.25Å; A124-L127 WeakPolarHBondContact O-CB 3.47Å; A124-L127 PolarHBondContact O-N 2.99Å
125	P	84.3	Confident	87.2	Confident	99 Å²	99	75.9 Å²	75.9	64%	0.643	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.7	-171.6	21.9	-33.8	0	0	0	114.9	R121	R121-P125 WeakPolarHBondContact O-CB 3.35Å
126	K	87.1	Confident	87.2	Confident	205 Å²	205	76.2 Å²	76.2	89%	0.891	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.3	179.1	-62.3	-177.2	-179.7	178.8	0	113.4	A124	A124-K126 PolarHBondContact O-N 3.34Å
127	L	85	Confident	87.5	Confident	66 Å²	66	85.3 Å²	85.3	35%	0.346	41%	0.408	S	S	.	.	S	Bend	trans	-73.3	129	-179.6	-164.7	66.4	0	0	0	109.7	F120 A124 T131 V132	F120-L127 HydrophobicContact CD1-CD2 3.51Å; F120-L127 HydrophobicContact CE1-CD2 3.75Å; A124-L127 HydrophobicContact CB-CB 4.25Å; A124-L127 WeakPolarHBondContact O-CB 3.47Å; A124-L127 PolarHBondContact O-N 2.99Å; L127-T131 HydrophobicContact CD1-CG2 3.92Å; L127-T131 HydrophobicContact CD2-CG2 4.35Å; L127-T131 HydrophobicContact CG-CG2 4.18Å; L127-V132 HydrophobicContact CD2-CG2 3.87Å; L127-V132 HydrophobicContact CG-CG2 4.29Å
128	P	91.8	Very high	87.5	Confident	75 Å²	75	91 Å²	91	49%	0.487	44%	0.435	S	S	.	.			trans	-61.5	140.8	178.4	-23.2	34.2	0	0	0	111.9	R130 T131 V132	P128-R130 PolarHBondContact O-N 3.22Å; P128-T131 WeakPolarHBondContact O-CB 3.47Å; P128-T131 PolarHBondContact O-N 3.08Å; P128-V132 PolarHBondContact O-N 3.4Å
129	E	89.1	Confident	87.6	Confident	96 Å²	96	87.3 Å²	87.3	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-58.3	-33.7	178.6	-176	168.5	169.2	0	0	112.3	K117 T131 V132 L133	K117-E129 HydrophobicContact CD-CG 4.42Å; K117-E129 WeakPolarHBondContact CE-OE1 3.47Å; K117-E129 IonicContact NZ-OE1 2.87Å; K117-E129 PolarHBondContact NZ-OE1 3.15Å; E129-T131 VanDerWaalsContact C-N 3.33Å; E129-T131 PolarHBondContact O-N 2.77Å; E129-V132 WeakPolarHBondContact O-CB 3.32Å; E129-V132 PolarHBondContact O-N 3.06Å; E129-L133 WeakPolarHBondContact O-CG 3.48Å; E129-L133 PolarHBondContact O-N 3.35Å
130	R	91.6	Very high	88	Confident	182 Å²	182	87.7 Å²	87.7	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-58.6	-42.7	173.4	-178.7	177.4	172.6	162.9	1.7	112.5	P128 V132 L133 E134	P128-R130 PolarHBondContact O-N 3.22Å; R130-V132 VanDerWaalsContact C-N 3.33Å; R130-L133 WeakPolarHBondContact O-CB 3.31Å; R130-L133 PolarHBondContact O-N 3.49Å; R130-E134 IonicContact CZ-OE1 2.77Å; R130-E134 IonicContact NE-OE1 2.84Å; R130-E134 PolarHBondContact NE-OE1 3.26Å; R130-E134 IonicContact NH2-OE1 3.1Å; R130-E134 WeakPolarHBondContact O-CG 3.24Å; R130-E134 PolarHBondContact O-N 3.32Å
131	T	89	Confident	88.3	Confident	48 Å²	48	92.3 Å²	92.3	29%	0.294	44%	0.438	S	S	.	.	H	α-helix	trans	-66.1	-39	177.2	-53.8	0	0	0	0	110.8	L127 P128 E129 L133 E134 V135	L127-T131 HydrophobicContact CD1-CG2 3.92Å; L127-T131 HydrophobicContact CD2-CG2 4.35Å; L127-T131 HydrophobicContact CG-CG2 4.18Å; P128-T131 WeakPolarHBondContact O-CB 3.47Å; P128-T131 PolarHBondContact O-N 3.08Å; E129-T131 VanDerWaalsContact C-N 3.33Å; E129-T131 PolarHBondContact O-N 2.77Å; T131-L133 VanDerWaalsContact C-N 3.31Å; T131-L133 PolarHBondContact O-N 2.85Å; T131-E134 PolarHBondContact O-N 3.37Å; T131-V135 WeakPolarHBondContact O-CG2 3.49Å; T131-V135 PolarHBondContact O-N 3.48Å
132	V	89.3	Confident	88.5	Confident	6 Å²	6	89 Å²	89	4%	0.036	43%	0.432	C	S	.	.	H	α-helix	trans	-62	-39.6	174.8	-179.1	0	0	0	0	111.4	F116 K117 F120 L127 P128 E129 R130 F136	F116-V132 HydrophobicContact CD1-CG1 3.8Å; F116-V132 HydrophobicContact CE1-CG1 4.32Å; K117-V132 HydrophobicContact CG-CG1 4.1Å; F120-V132 HydrophobicContact CB-CG1 4.18Å; F120-V132 HydrophobicContact CB-CG2 3.84Å; F120-V132 HydrophobicContact CD1-CG2 4.18Å; F120-V132 HydrophobicContact CD2-CG1 4.17Å; F120-V132 HydrophobicContact CG-CG1 4.17Å; F120-V132 HydrophobicContact CG-CG2 4.01Å; L127-V132 HydrophobicContact CD2-CG2 3.87Å; L127-V132 HydrophobicContact CG-CG2 4.29Å; P128-V132 PolarHBondContact O-N 3.4Å; E129-V132 WeakPolarHBondContact O-CB 3.32Å; E129-V132 PolarHBondContact O-N 3.06Å; R130-V132 VanDerWaalsContact C-N 3.33Å; V132-F136 WeakPolarHBondContact O-CB 3.44Å; V132-F136 PolarHBondContact O-N 3.02Å
133	L	91.4	Very high	89	Confident	57 Å²	57	87 Å²	87	30%	0.298	43%	0.433	S	S	.	.	H	α-helix	trans	-64	-42.2	175.1	-69.7	168.2	0	0	0	112.4	L113 E129 R130 T131 F136 R137	L113-L133 HydrophobicContact CD1-CD2 3.68Å; L113-L133 HydrophobicContact CD2-CD2 3.52Å; L113-L133 HydrophobicContact CG-CD2 4.14Å; E129-L133 WeakPolarHBondContact O-CG 3.48Å; E129-L133 PolarHBondContact O-N 3.35Å; R130-L133 WeakPolarHBondContact O-CB 3.31Å; R130-L133 PolarHBondContact O-N 3.49Å; T131-L133 VanDerWaalsContact C-N 3.31Å; T131-L133 PolarHBondContact O-N 2.85Å; L133-F136 PolarHBondContact O-N 3.22Å; L133-R137 WeakPolarHBondContact O-CG 2.99Å; L133-R137 PolarHBondContact O-N 3.13Å; L133-R137 VanDerWaalsContact O-N 3.13Å
134	E	90.9	Very high	89.7	Confident	96 Å²	96	86.6 Å²	86.6	45%	0.449	43%	0.428	S	S	.	.	H	α-helix	trans	-64.1	-46.1	177.8	-72.8	167.9	-174	0	0	110.6	R130 T131 F136 R137 E138	R130-E134 IonicContact CZ-OE1 2.77Å; R130-E134 IonicContact NE-OE1 2.84Å; R130-E134 PolarHBondContact NE-OE1 3.26Å; R130-E134 IonicContact NH2-OE1 3.1Å; R130-E134 WeakPolarHBondContact O-CG 3.24Å; R130-E134 PolarHBondContact O-N 3.32Å; T131-E134 PolarHBondContact O-N 3.37Å; E134-F136 PolarHBondContact O-N 3.33Å; E134-R137 PolarHBondContact O-N 3.46Å; E134-E138 PolarHBondContact O-N 2.95Å; E134-E138 VanDerWaalsContact O-N 3.09Å
135	V	88.8	Confident	90.4	Very high	44 Å²	44	86.7 Å²	86.7	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-44	174.9	174.8	0	0	0	0	111.2	F116 T131 R137 E138 V139	F116-V135 HydrophobicContact CE1-CB 4.37Å; F116-V135 HydrophobicContact CE1-CG1 3.9Å; F116-V135 HydrophobicContact CZ-CG1 3.93Å; T131-V135 WeakPolarHBondContact O-CG2 3.49Å; T131-V135 PolarHBondContact O-N 3.48Å; V135-R137 VanDerWaalsContact C-N 3.29Å; V135-R137 PolarHBondContact O-N 3.11Å; V135-E138 PolarHBondContact O-N 2.88Å; V135-E138 VanDerWaalsContact O-N 3.14Å; V135-V139 HydrophobicContact CG1-CG2 4.1Å; V135-V139 VanDerWaalsContact O-CG2 3.27Å; V135-V139 WeakPolarHBondContact O-CG2 3.26Å; V135-V139 PolarHBondContact O-N 3.46Å
136	F	91.3	Very high	90.9	Very high	13 Å²	13	85 Å²	85	6%	0.057	42%	0.416	C	S	.	.	H	α-helix	trans	-57	-45.2	178.3	-177.2	-87.2	0	0	0	111.6	L113 F116 V132 L133 E134 E138 V139 D140 V147	L113-F136 HydrophobicContact CB-CD2 4.38Å; L113-F136 HydrophobicContact CB-CE1 4.31Å; L113-F136 HydrophobicContact CB-CE2 4.14Å; L113-F136 HydrophobicContact CB-CZ 4.11Å; L113-F136 HydrophobicContact CD1-CB 3.9Å; L113-F136 HydrophobicContact CD1-CD1 4.11Å; L113-F136 HydrophobicContact CD1-CD2 3.95Å; L113-F136 HydrophobicContact CD1-CG 3.69Å; F116-F136 HydrophobicContact CB-CD2 3.74Å; F116-F136 HydrophobicContact CB-CE2 4.19Å; F116-F136 HydrophobicContact CD1-CB 4.06Å; F116-F136 AromaticContact CD1-CD2 3.95Å; F116-F136 HydrophobicContact CD1-CD2 3.95Å; F116-F136 HydrophobicContact CD2-CD2 4.12Å; F116-F136 HydrophobicContact CE1-CB 4.22Å; F116-F136 AromaticContact CG-CD2 3.7Å; F116-F136 HydrophobicContact CG-CD2 3.7Å; F116-F136 HydrophobicContact CG-CE2 4.44Å; V132-F136 WeakPolarHBondContact O-CB 3.44Å; V132-F136 PolarHBondContact O-N 3.02Å; L133-F136 PolarHBondContact O-N 3.22Å; E134-F136 PolarHBondContact O-N 3.33Å; F136-E138 VanDerWaalsContact C-N 3.3Å; F136-E138 PolarHBondContact O-N 2.85Å; F136-V139 PolarHBondContact O-N 2.66Å; F136-D140 HydrophobicContact CD1-CB 4.46Å; F136-D140 HydrophobicContact CE1-CB 4.17Å; F136-D140 VanDerWaalsContact O-CB 3.32Å; F136-D140 WeakPolarHBondContact O-CB 3.35Å; F136-D140 PolarHBondContact O-N 2.84Å; F136-V147 HydrophobicContact CD2-CG2 3.93Å; F136-V147 HydrophobicContact CE2-CB 4.45Å; F136-V147 HydrophobicContact CE2-CG2 3.6Å; F136-V147 HydrophobicContact CZ-CG2 4.02Å
137	R	91.9	Very high	91.2	Very high	196 Å²	196	75.3 Å²	75.3	74%	0.74	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-31.5	178.3	-72	176.8	176.9	-173.2	-1.5	113.3	L133 E134 V135	L133-R137 WeakPolarHBondContact O-CG 2.99Å; L133-R137 PolarHBondContact O-N 3.13Å; L133-R137 VanDerWaalsContact O-N 3.13Å; E134-R137 PolarHBondContact O-N 3.46Å; V135-R137 VanDerWaalsContact C-N 3.29Å; V135-R137 PolarHBondContact O-N 3.11Å
138	E	89.9	Confident	91.6	Very high	160 Å²	160	73.9 Å²	73.9	75%	0.748	37%	0.369	S	S	*	.	H	α-helix	trans	-73.5	-35.9	176.1	-172	178.4	171.4	0	0	111.6	E134 V135 F136	E134-E138 PolarHBondContact O-N 2.95Å; E134-E138 VanDerWaalsContact O-N 3.09Å; V135-E138 PolarHBondContact O-N 2.88Å; V135-E138 VanDerWaalsContact O-N 3.14Å; F136-E138 VanDerWaalsContact C-N 3.3Å; F136-E138 PolarHBondContact O-N 2.85Å
139	V	91.3	Very high	91.5	Very high	14 Å²	14	72.4 Å²	72.4	9%	0.085	36%	0.355	C	S	.	.	H	α-helix	trans	-76.6	-38.3	178.4	179.3	0	0	0	0	111.5	F116 V135 F136 R141 V147 D151 A155	F116-V139 HydrophobicContact CZ-CG2 4.5Å; V135-V139 HydrophobicContact CG1-CG2 4.1Å; V135-V139 VanDerWaalsContact O-CG2 3.27Å; V135-V139 WeakPolarHBondContact O-CG2 3.26Å; V135-V139 PolarHBondContact O-N 3.46Å; F136-V139 PolarHBondContact O-N 2.66Å; V139-R141 VanDerWaalsContact C-N 3.32Å; V139-R141 WeakPolarHBondContact O-CG 3.27Å; V139-R141 PolarHBondContact O-N 3.27Å; V139-V147 HydrophobicContact CB-CG2 4.21Å; V139-V147 HydrophobicContact CG1-CB 4.33Å; V139-V147 HydrophobicContact CG1-CG1 3.54Å; V139-V147 HydrophobicContact CG1-CG2 3.81Å; V139-D151 HydrophobicContact CG1-CB 4.28Å; V139-D151 WeakPolarHBondContact O-CB 3.35Å; V139-A155 HydrophobicContact CB-CB 4.45Å; V139-A155 HydrophobicContact CG1-CB 4Å; V139-A155 HydrophobicContact CG2-CB 3.73Å
140	D	93.5	Very high	91.6	Very high	12 Å²	12	75.8 Å²	75.8	6%	0.064	36%	0.364	C	S	.	.			trans	-70.4	80.1	176.4	179.6	6.5	0	0	0	111.5	F136 S143 D144 G145 V147	F136-D140 HydrophobicContact CD1-CB 4.46Å; F136-D140 HydrophobicContact CE1-CB 4.17Å; F136-D140 VanDerWaalsContact O-CB 3.32Å; F136-D140 WeakPolarHBondContact O-CB 3.35Å; F136-D140 PolarHBondContact O-N 2.84Å; D140-S143 PolarHBondContact O-N 2.76Å; D140-S143 WeakPolarHBondContact OD1-CA 3.18Å; D140-S143 PolarHBondContact OD1-N 2.89Å; D140-S143 WeakPolarHBondContact OD2-CA 3.42Å; D140-D144 PolarHBondContact OD1-N 3.22Å; D140-G145 WeakPolarHBondContact OD2-CA 3.32Å; D140-G145 PolarHBondContact OD2-N 3.37Å; D140-V147 HydrophobicContact CB-CG2 4.3Å
141	R	91.3	Very high	91.6	Very high	141 Å²	141	67.2 Å²	67.2	53%	0.532	33%	0.331	S	S	.	.	S	Bend	trans	-72.2	-29.6	-168.2	-70.4	-172.2	65.9	-165	-2.7	114.6	V139 Y154	V139-R141 VanDerWaalsContact C-N 3.32Å; V139-R141 WeakPolarHBondContact O-CG 3.27Å; V139-R141 PolarHBondContact O-N 3.27Å; R141-Y154 VanDerWaalsContact NH1-CD2 3.3Å
142	D	92	Very high	91.6	Very high	88 Å²	88	65.5 Å²	65.5	47%	0.471	32%	0.32	S	S	.	.	S	Bend	trans	-97	-1.9	175.4	56.1	6.4	0	0	0	112.7	D144	D142-D144 PolarHBondContact O-N 3.44Å
143	S	91.8	Very high	91.5	Very high	96 Å²	96	68 Å²	68	67%	0.671	33%	0.331	S	S	*	.			trans	59.1	34.3	173.9	-58.8	0	0	0	0	112.6	D140	D140-S143 PolarHBondContact O-N 2.76Å; D140-S143 WeakPolarHBondContact OD1-CA 3.18Å; D140-S143 PolarHBondContact OD1-N 2.89Å; D140-S143 WeakPolarHBondContact OD2-CA 3.42Å
144	D	93.8	Very high	91.2	Very high	89 Å²	89	69.3 Å²	69.3	48%	0.476	33%	0.333	S	S	.	.	S	Bend	trans	-85.1	-1.3	178.8	86.6	-10.3	0	0	0	112.6	D140 D142 H146	D140-D144 PolarHBondContact OD1-N 3.22Å; D142-D144 PolarHBondContact O-N 3.44Å; D144-H146 VanDerWaalsContact C-N 3.34Å; D144-H146 PolarHBondContact O-ND1 2.88Å; D144-H146 VanDerWaalsContact O-ND1 3.16Å; D144-H146 VanDerWaalsContact OD1-CA 3.3Å; D144-H146 WeakPolarHBondContact OD1-CA 3.37Å; D144-H146 VanDerWaalsContact OD1-CB 3.23Å; D144-H146 WeakPolarHBondContact OD1-CB 3.35Å; D144-H146 IonicContact OD1-CG 3.78Å; D144-H146 PolarHBondContact OD1-N 3.34Å; D144-H146 IonicContact OD1-ND1 2.94Å; D144-H146 PolarHBondContact OD1-ND1 3.29Å; D144-H146 VanDerWaalsContact OD1-O 3.07Å; D144-H146 IonicContact OD2-ND1 2.66Å
145	G	93.1	Very high	91	Very high	37 Å²	37	66.3 Å²	66.3	38%	0.381	33%	0.325	S	S	.	.	S	Bend	trans	85.4	5.8	-178	0	0	0	0	0	113.9	D140	D140-G145 WeakPolarHBondContact OD2-CA 3.32Å; D140-G145 PolarHBondContact OD2-N 3.37Å
146	H	94.1	Very high	90.6	Very high	65 Å²	65	67.4 Å²	67.4	30%	0.301	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.1	-179.7	-48.1	93.3	0	0	0	110.7	F110 D144	F110-H146 HydrophobicContact CB-CB 4.05Å; F110-H146 HydrophobicContact CD2-CB 3.91Å; F110-H146 AromaticContact CD2-CD2 3.27Å; F110-H146 WeakPolarHBondContact CD2-CD2 3.5Å; F110-H146 AromaticContact CD2-CG 3.79Å; F110-H146 AromaticContact CE2-CD2 3.23Å; F110-H146 WeakPolarHBondContact CE2-CD2 3.34Å; F110-H146 AromaticContact CE2-NE2 3.76Å; F110-H146 HydrophobicContact CG-CB 4.16Å; D144-H146 VanDerWaalsContact C-N 3.34Å; D144-H146 PolarHBondContact O-ND1 2.88Å; D144-H146 VanDerWaalsContact O-ND1 3.16Å; D144-H146 VanDerWaalsContact OD1-CA 3.3Å; D144-H146 WeakPolarHBondContact OD1-CA 3.37Å; D144-H146 VanDerWaalsContact OD1-CB 3.23Å; D144-H146 WeakPolarHBondContact OD1-CB 3.35Å; D144-H146 IonicContact OD1-CG 3.78Å; D144-H146 PolarHBondContact OD1-N 3.34Å; D144-H146 IonicContact OD1-ND1 2.94Å; D144-H146 PolarHBondContact OD1-ND1 3.29Å; D144-H146 VanDerWaalsContact OD1-O 3.07Å; D144-H146 IonicContact OD2-ND1 2.66Å
147	V	93.3	Very high	89.8	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	107.6	170	169.4	0	0	0	0	108.1	F110 L111 F136 V139 D140 D151 F152	F110-V147 WeakPolarHBondContact CA-O 3.49Å; L111-V147 HydrophobicContact CB-CB 4.2Å; L111-V147 PolarHBondContact N-O 3.38Å; L111-V147 PolarHBondContact O-N 3.03Å; F136-V147 HydrophobicContact CD2-CG2 3.93Å; F136-V147 HydrophobicContact CE2-CB 4.45Å; F136-V147 HydrophobicContact CE2-CG2 3.6Å; F136-V147 HydrophobicContact CZ-CG2 4.02Å; V139-V147 HydrophobicContact CB-CG2 4.21Å; V139-V147 HydrophobicContact CG1-CB 4.33Å; V139-V147 HydrophobicContact CG1-CG1 3.54Å; V139-V147 HydrophobicContact CG1-CG2 3.81Å; D140-V147 HydrophobicContact CB-CG2 4.3Å; V147-D151 HydrophobicContact CG1-CB 4.13Å; V147-F152 HydrophobicContact CG1-CB 3.99Å; V147-F152 HydrophobicContact CG1-CD2 4.33Å
148	S	93.6	Very high	88.6	Confident	37 Å²	37	66.2 Å²	66.2	26%	0.259	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	166.5	173.6	80.1	0	0	0	0	111.1	R150 D151 F152	S148-R150 PolarHBondContact O-N 3.34Å; S148-R150 PolarHBondContact OG-N 2.67Å; S148-D151 VanDerWaalsContact CB-OD2 3.24Å; S148-D151 WeakPolarHBondContact CB-OD2 3.39Å; S148-D151 PolarHBondContact N-OD2 3.27Å; S148-D151 VanDerWaalsContact N-OD2 3.12Å; S148-D151 PolarHBondContact O-N 3.36Å; S148-D151 VanDerWaalsContact OG-CG 3.28Å; S148-D151 PolarHBondContact OG-N 2.67Å; S148-D151 PolarHBondContact OG-OD2 2.9Å; S148-F152 PolarHBondContact O-N 3.07Å
149	F	91.1	Very high	87	Confident	43 Å²	43	61.2 Å²	61.2	19%	0.189	32%	0.32	C	S	.	.	H	α-helix	trans	-56.7	-35.2	172.3	178.6	-102.3	0	0	0	112.3	R93 V96 R97 F100 F152 E153	R93-F149 HydrophobicContact CG-CZ 4.29Å; V96-F149 HydrophobicContact CG1-CE2 3.91Å; V96-F149 HydrophobicContact CG1-CZ 4.15Å; R97-F149 HydrophobicContact CB-CE2 3.83Å; R97-F149 HydrophobicContact CB-CZ 4.15Å; R97-F149 HydrophobicContact CG-CE2 4.32Å; F100-F149 HydrophobicContact CB-CD2 4.08Å; F100-F149 HydrophobicContact CB-CE2 4.39Å; F100-F149 HydrophobicContact CD1-CD2 4.18Å; F100-F149 HydrophobicContact CD2-CD2 4.23Å; F100-F149 HydrophobicContact CE1-CB 4.44Å; F100-F149 HydrophobicContact CE2-CB 4.35Å; F100-F149 AromaticContact CG-CD2 3.9Å; F100-F149 HydrophobicContact CG-CD2 3.9Å; F100-F149 HydrophobicContact CZ-CB 4.24Å; F149-F152 PolarHBondContact O-N 3.47Å; F149-E153 HydrophobicContact CE1-CB 4.45Å; F149-E153 VanDerWaalsContact O-CB 3.32Å; F149-E153 WeakPolarHBondContact O-CB 3.38Å; F149-E153 PolarHBondContact O-N 2.87Å
150	R	89.9	Confident	85	Confident	167 Å²	167	66.4 Å²	66.4	63%	0.63	34%	0.344	S	S	*	.	H	α-helix	trans	-68.8	-39.2	-179.4	-169.8	-177.8	70.3	-164.4	-1.7	111.4	S148 Y154	S148-R150 PolarHBondContact O-N 3.34Å; S148-R150 PolarHBondContact OG-N 2.67Å; R150-Y154 WeakPolarHBondContact O-CB 3.44Å; R150-Y154 PolarHBondContact O-N 3.45Å
151	D	92.1	Very high	82.4	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.011	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-43.2	177.4	-60.1	-42.4	0	0	0	110.9	V139 V147 S148 Y154 A155	V139-D151 HydrophobicContact CG1-CB 4.28Å; V139-D151 WeakPolarHBondContact O-CB 3.35Å; V147-D151 HydrophobicContact CG1-CB 4.13Å; S148-D151 VanDerWaalsContact CB-OD2 3.24Å; S148-D151 WeakPolarHBondContact CB-OD2 3.39Å; S148-D151 PolarHBondContact N-OD2 3.27Å; S148-D151 VanDerWaalsContact N-OD2 3.12Å; S148-D151 PolarHBondContact O-N 3.36Å; S148-D151 VanDerWaalsContact OG-CG 3.28Å; S148-D151 PolarHBondContact OG-N 2.67Å; S148-D151 PolarHBondContact OG-OD2 2.9Å; D151-Y154 PolarHBondContact O-N 3.28Å; D151-A155 WeakPolarHBondContact O-CB 3.49Å; D151-A155 PolarHBondContact O-N 3.32Å
152	F	89.1	Confident	79.8	Confident	13 Å²	13	74.9 Å²	74.9	6%	0.057	39%	0.387	C	S	.	.	H	α-helix	trans	-63.2	-45	175.5	-166.5	-100.8	0	0	0	112.8	V96 I99 F100 F103 L111 V147 S148 F149 Y154 A155 L156	V96-F152 HydrophobicContact CG1-CD1 3.97Å; V96-F152 HydrophobicContact CG1-CE1 4.29Å; I99-F152 HydrophobicContact CB-CE1 4.29Å; I99-F152 HydrophobicContact CB-CZ 4.49Å; I99-F152 HydrophobicContact CG2-CE1 3.98Å; I99-F152 HydrophobicContact CG2-CZ 3.69Å; F100-F152 HydrophobicContact CB-CD1 3.94Å; F100-F152 HydrophobicContact CB-CE1 4.07Å; F100-F152 HydrophobicContact CD2-CB 3.72Å; F100-F152 AromaticContact CD2-CD1 3.84Å; F100-F152 HydrophobicContact CD2-CD1 3.84Å; F100-F152 HydrophobicContact CD2-CD2 4.28Å; F100-F152 AromaticContact CD2-CG 3.69Å; F100-F152 HydrophobicContact CD2-CG 3.69Å; F100-F152 HydrophobicContact CE2-CB 4.09Å; F100-F152 HydrophobicContact CE2-CG 4.44Å; F100-F152 HydrophobicContact CG-CD1 4.39Å; F103-F152 AromaticContact CD2-CE2 3.98Å; F103-F152 HydrophobicContact CD2-CE2 3.98Å; F103-F152 AromaticContact CD2-CZ 3.97Å; F103-F152 HydrophobicContact CD2-CZ 3.97Å; F103-F152 HydrophobicContact CE2-CE2 4.01Å; F103-F152 AromaticContact CE2-CZ 3.83Å; F103-F152 HydrophobicContact CE2-CZ 3.83Å; L111-F152 HydrophobicContact CD1-CD2 4.17Å; L111-F152 HydrophobicContact CD1-CE2 4.35Å; V147-F152 HydrophobicContact CG1-CB 3.99Å; V147-F152 HydrophobicContact CG1-CD2 4.33Å; S148-F152 PolarHBondContact O-N 3.07Å; F149-F152 PolarHBondContact O-N 3.47Å; F152-Y154 VanDerWaalsContact C-N 3.33Å; F152-Y154 PolarHBondContact O-N 3.29Å; F152-A155 PolarHBondContact O-N 3.13Å; F152-L156 HydrophobicContact CD1-CD1 3.88Å; F152-L156 HydrophobicContact CE1-CD1 3.38Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.9Å; F152-L156 HydrophobicContact CZ-CG 4.5Å; F152-L156 PolarHBondContact O-N 3.31Å; F152-L156 VanDerWaalsContact O-N 3.11Å
153	E	87.4	Confident	77	Confident	59 Å²	59	77.2 Å²	77.2	28%	0.276	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-41.8	175.3	-176.9	178.4	-121.7	0	0	111.3	V96 F149 N157	V96-E153 HydrophobicContact CG1-CB 4.26Å; F149-E153 HydrophobicContact CE1-CB 4.45Å; F149-E153 VanDerWaalsContact O-CB 3.32Å; F149-E153 WeakPolarHBondContact O-CB 3.38Å; F149-E153 PolarHBondContact O-N 2.87Å; E153-N157 WeakPolarHBondContact O-CB 3.47Å; E153-N157 PolarHBondContact O-N 3.38Å
154	Y	85.9	Confident	76.3	Confident	84 Å²	84	76.3 Å²	76.3	33%	0.329	41%	0.406	S	S	.	.	H	α-helix	trans	-62.3	-46.7	176.7	-176.9	-91.3	0	0	0	112	R141 R150 D151 F152 L156 N157 Y158	R141-Y154 VanDerWaalsContact NH1-CD2 3.3Å; R150-Y154 WeakPolarHBondContact O-CB 3.44Å; R150-Y154 PolarHBondContact O-N 3.45Å; D151-Y154 PolarHBondContact O-N 3.28Å; F152-Y154 VanDerWaalsContact C-N 3.33Å; F152-Y154 PolarHBondContact O-N 3.29Å; Y154-L156 PolarHBondContact O-N 3.5Å; Y154-N157 PolarHBondContact O-N 2.88Å; Y154-Y158 HydrophobicContact CD1-CD2 4.18Å; Y154-Y158 HydrophobicContact CD2-CD2 4.5Å; Y154-Y158 AromaticContact CE1-CD2 3.55Å; Y154-Y158 HydrophobicContact CE1-CD2 3.55Å; Y154-Y158 AromaticContact CE1-CE2 3.79Å; Y154-Y158 HydrophobicContact CE1-CE2 3.79Å; Y154-Y158 HydrophobicContact CE1-CG 4.3Å; Y154-Y158 AromaticContact CE2-CD2 3.93Å; Y154-Y158 HydrophobicContact CE2-CD2 3.93Å; Y154-Y158 AromaticContact CE2-CE2 3.78Å; Y154-Y158 HydrophobicContact CE2-CE2 3.78Å; Y154-Y158 AromaticContact CZ-CD2 3.43Å; Y154-Y158 VanDerWaalsContact CZ-CD2 3.43Å; Y154-Y158 AromaticContact CZ-CE2 3.22Å; Y154-Y158 PolarHBondContact O-N 2.7Å; Y154-Y158 WeakPolarHBondContact OH-CE2 3.39Å
155	A	85.1	Confident	75.4	Confident	33 Å²	33	75.6 Å²	75.6	27%	0.273	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-43.7	179.7	0	0	0	0	0	112.4	V139 D151 F152 N157 Y158 G159	V139-A155 HydrophobicContact CB-CB 4.45Å; V139-A155 HydrophobicContact CG1-CB 4Å; V139-A155 HydrophobicContact CG2-CB 3.73Å; D151-A155 WeakPolarHBondContact O-CB 3.49Å; D151-A155 PolarHBondContact O-N 3.32Å; F152-A155 PolarHBondContact O-N 3.13Å; A155-N157 VanDerWaalsContact C-N 3.35Å; A155-N157 PolarHBondContact O-N 3.38Å; A155-Y158 PolarHBondContact O-N 2.87Å; A155-G159 PolarHBondContact O-N 3.13Å
156	L	81.3	Confident	74.4	Confident	66 Å²	66	77.8 Å²	77.8	35%	0.346	40%	0.403	S	S	.	.	H	α-helix	trans	-70.7	-28.8	178.3	-71.2	179.9	0	0	0	113.6	Y92 V96 F152 Y154	Y92-L156 PolarHBondContact OH-O 2.97Å; V96-L156 HydrophobicContact CB-CD1 4.37Å; V96-L156 HydrophobicContact CG1-CD1 3.95Å; V96-L156 HydrophobicContact CG2-CD1 3.93Å; F152-L156 HydrophobicContact CD1-CD1 3.88Å; F152-L156 HydrophobicContact CE1-CD1 3.38Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.9Å; F152-L156 HydrophobicContact CZ-CG 4.5Å; F152-L156 PolarHBondContact O-N 3.31Å; F152-L156 VanDerWaalsContact O-N 3.11Å; Y154-L156 PolarHBondContact O-N 3.5Å
157	N	75.4	Confident	73.3	Confident	67 Å²	67	78.5 Å²	78.5	36%	0.358	41%	0.409	S	S	.	.	H	α-helix	trans	-77.9	-30.7	175.9	-167.6	43.5	0	0	0	112.2	Y92 E153 Y154 A155 Q160	Y92-N157 PolarHBondContact OH-N 2.91Å; E153-N157 WeakPolarHBondContact O-CB 3.47Å; E153-N157 PolarHBondContact O-N 3.38Å; Y154-N157 PolarHBondContact O-N 2.88Å; A155-N157 VanDerWaalsContact C-N 3.35Å; A155-N157 PolarHBondContact O-N 3.38Å; N157-Q160 PolarHBondContact O-N 3.07Å
158	Y	64.9	Low	72	Confident	118 Å²	118	83.4 Å²	83.4	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-68.4	-40.4	175.7	-118.3	-97.2	0	0	0	112.3	Y154 A155 Q160 K161	Y154-Y158 HydrophobicContact CD1-CD2 4.18Å; Y154-Y158 HydrophobicContact CD2-CD2 4.5Å; Y154-Y158 AromaticContact CE1-CD2 3.55Å; Y154-Y158 HydrophobicContact CE1-CD2 3.55Å; Y154-Y158 AromaticContact CE1-CE2 3.79Å; Y154-Y158 HydrophobicContact CE1-CE2 3.79Å; Y154-Y158 HydrophobicContact CE1-CG 4.3Å; Y154-Y158 AromaticContact CE2-CD2 3.93Å; Y154-Y158 HydrophobicContact CE2-CD2 3.93Å; Y154-Y158 AromaticContact CE2-CE2 3.78Å; Y154-Y158 HydrophobicContact CE2-CE2 3.78Å; Y154-Y158 AromaticContact CZ-CD2 3.43Å; Y154-Y158 VanDerWaalsContact CZ-CD2 3.43Å; Y154-Y158 AromaticContact CZ-CE2 3.22Å; Y154-Y158 PolarHBondContact O-N 2.7Å; Y154-Y158 WeakPolarHBondContact OH-CE2 3.39Å; A155-Y158 PolarHBondContact O-N 2.87Å; Y158-Q160 PolarHBondContact O-N 2.98Å; Y158-Q160 VanDerWaalsContact O-N 3.07Å; Y158-K161 PolarHBondContact O-N 3.02Å; Y158-K161 VanDerWaalsContact O-N 3.08Å
159	G	56.7	Low	70.6	Confident	54 Å²	54	86.5 Å²	86.5	56%	0.557	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.8	176.3	0	0	0	0	0	115.1	A155	A155-G159 PolarHBondContact O-N 3.13Å
160	Q	48.8	Very low	69.1	Low	123 Å²	123	89.6 Å²	89.6	58%	0.575	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-16.1	175.7	-70.5	-166.9	-21.8	0	0	114.3	N157 Y158	N157-Q160 PolarHBondContact O-N 3.07Å; Y158-Q160 PolarHBondContact O-N 2.98Å; Y158-Q160 VanDerWaalsContact O-N 3.07Å
161	K	40.1	Very low	67.5	Low	156 Å²	156	83.7 Å²	83.7	68%	0.678	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-18.9	-179.1	-75.3	-173.7	178.5	179.6	0	113.8	Y158	Y158-K161 PolarHBondContact O-N 3.02Å; Y158-K161 VanDerWaalsContact O-N 3.08Å
162	E	35.7	Very low	65.4	Low	176 Å²	176	90.5 Å²	90.5	82%	0.822	49%	0.489	S	S	*	.			trans	-106.1	13.5	179.4	-58.5	-141.8	155.3	0	0	113.6
163	A	35	Very low	63.3	Low	137 Å²	137	97.5 Å²	97.5	100%	1.132	53%	0.528	S	S	*	.			trans	-112.8	0	-179.9	0	0	0	0	0	112.7

Retrieved 163 of 163 residues in 1365.7 ms (Link to these results)

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