A0A096NKT7_PAPAN Loading...

Small nuclear ribonucleoprotein U11/U12 subunit 48

AlphaFold DB (A0A2K5YVK3), UniProt , Accession A0A096NKT7, Species PAPAN (Papio anubis, Olive baboon), Gene SNRNP48, Length 339 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	39.1	Very low	67.9	Low	243 Å²	243	123.5 Å²	123.5	100%	1.197	66%	0.656	S	S	*	*				0	93	0	-76.1	-172.6	-81.2	0	0	106.4
2	E	48.6	Very low	69.3	Low	196 Å²	196	126.4 Å²	126.4	92%	0.916	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-77.8	116.1	161.1	-67.5	178.1	167.2	0	0	104.9
3	G	57.3	Low	70.8	Confident	67 Å²	67	129.6 Å²	129.6	69%	0.691	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.7	137.3	177.5	0	0	0	0	0	109.2
4	E	62.2	Low	72	Confident	188 Å²	188	126.7 Å²	126.7	88%	0.879	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-53.3	128	168.4	-72.3	-177	136.3	0	0	108.2
5	P	65.8	Low	73.2	Confident	91 Å²	91	127.7 Å²	127.7	59%	0.591	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.4	-172.3	30	-35.8	0	0	0	107.8	R11	P5-R11 PolarHBondContact O-NH2 2.92Å
6	P	69.5	Low	74.4	Confident	55 Å²	55	124.4 Å²	124.4	36%	0.357	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-53.7	152	-163.4	17.1	-31.2	0	0	0	112.6	E10 R11	P6-E10 HydrophobicContact CB-CB 4.36Å; P6-R11 HydrophobicContact CG-CG 3.97Å; P6-R11 PolarHBondContact O-NE 3.32Å; P6-R11 PolarHBondContact O-NH2 3.3Å
7	P	80.1	Confident	75.6	Confident	67 Å²	67	124 Å²	124	44%	0.435	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-51.6	149.8	-178.6	20	-31.9	0	0	0	112.1	E9 E10 R11	P7-E9 PolarHBondContact O-N 3.36Å; P7-E9 VanDerWaalsContact O-N 3.13Å; P7-E10 WeakPolarHBondContact CD-OE2 3.49Å; P7-E10 HydrophobicContact CG-CB 4.15Å; P7-E10 VanDerWaalsContact CG-CD 3.47Å; P7-E10 HydrophobicContact CG-CG 3.84Å; P7-E10 PolarHBondContact O-N 2.96Å; P7-R11 PolarHBondContact O-N 3.07Å; P7-R11 VanDerWaalsContact O-N 3.14Å
8	V	77.9	Confident	76.5	Confident	102 Å²	102	123.2 Å²	123.2	62%	0.618	61%	0.614	S	S	*	*	H	α-helix	trans	-59.3	-33	-169.8	179	0	0	0	0	111.1	R11 R12	V8-R11 PolarHBondContact O-N 2.96Å; V8-R12 WeakPolarHBondContact O-CB 3.49Å; V8-R12 PolarHBondContact O-N 3.19Å
9	E	80.9	Confident	77.4	Confident	131 Å²	131	119.6 Å²	119.6	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-64.9	-38.3	176.1	-61.9	70.7	-157.2	0	0	112.7	P7 R13	P7-E9 PolarHBondContact O-N 3.36Å; P7-E9 VanDerWaalsContact O-N 3.13Å; E9-R13 WeakPolarHBondContact O-CG 3.48Å; E9-R13 PolarHBondContact O-N 3.47Å
10	E	82.6	Confident	78.3	Confident	102 Å²	102	120.4 Å²	120.4	48%	0.477	60%	0.603	S	S	.	*	H	α-helix	trans	-73	-40.4	176.1	-76.1	176.1	-168.8	0	0	111.5	P6 P7 R12 R13 L14	P6-E10 HydrophobicContact CB-CB 4.36Å; P7-E10 WeakPolarHBondContact CD-OE2 3.49Å; P7-E10 HydrophobicContact CG-CB 4.15Å; P7-E10 VanDerWaalsContact CG-CD 3.47Å; P7-E10 HydrophobicContact CG-CG 3.84Å; P7-E10 PolarHBondContact O-N 2.96Å; E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.26Å; E10-R13 PolarHBondContact O-N 2.96Å; E10-L14 WeakPolarHBondContact O-CB 3.28Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 3.42Å
11	R	82.4	Confident	79	Confident	117 Å²	117	121.1 Å²	121.1	44%	0.442	60%	0.603	S	S	.	*	H	α-helix	trans	-62.1	-39.2	173.7	-64.2	-172.9	-141.3	162.4	15.5	111.7	P5 P6 P7 V8 L14 Q15	P5-R11 PolarHBondContact O-NH2 2.92Å; P6-R11 HydrophobicContact CG-CG 3.97Å; P6-R11 PolarHBondContact O-NE 3.32Å; P6-R11 PolarHBondContact O-NH2 3.3Å; P7-R11 PolarHBondContact O-N 3.07Å; P7-R11 VanDerWaalsContact O-N 3.14Å; V8-R11 PolarHBondContact O-N 2.96Å; R11-L14 PolarHBondContact O-N 3.08Å; R11-Q15 WeakPolarHBondContact O-CB 3.48Å; R11-Q15 PolarHBondContact O-N 2.93Å
12	R	85.6	Confident	81.6	Confident	158 Å²	158	113.6 Å²	113.6	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-64.1	-45.3	175.8	-178.5	179.6	164.9	174.4	-1.8	111.6	V8 E10 Q15 E16	V8-R12 WeakPolarHBondContact O-CB 3.49Å; V8-R12 PolarHBondContact O-N 3.19Å; E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.26Å; R12-Q15 WeakPolarHBondContact O-CB 3.5Å; R12-Q15 PolarHBondContact O-N 3.16Å; R12-E16 IonicContact CZ-OE1 3.24Å; R12-E16 VanDerWaalsContact CZ-OE1 3.24Å; R12-E16 IonicContact NE-OE1 2.74Å; R12-E16 PolarHBondContact NE-OE1 2.72Å; R12-E16 IonicContact NH2-OE1 2.83Å; R12-E16 PolarHBondContact NH2-OE1 2.76Å; R12-E16 WeakPolarHBondContact O-CG 3.36Å; R12-E16 PolarHBondContact O-N 3.05Å
13	R	87.8	Confident	83.8	Confident	168 Å²	168	108.9 Å²	108.9	63%	0.634	55%	0.548	S	S	*	.	H	α-helix	trans	-60.6	-45.7	175	-75.5	177.9	179.9	-171.9	0.5	112.3	E9 E10 Q15 E16 E17	E9-R13 WeakPolarHBondContact O-CG 3.48Å; E9-R13 PolarHBondContact O-N 3.47Å; E10-R13 PolarHBondContact O-N 2.96Å; R13-Q15 VanDerWaalsContact C-N 3.28Å; R13-Q15 PolarHBondContact O-N 2.98Å; R13-E16 PolarHBondContact O-N 3.33Å; R13-E17 WeakPolarHBondContact O-CB 3.49Å; R13-E17 WeakPolarHBondContact O-CG 3.17Å; R13-E17 PolarHBondContact O-N 3.25Å
14	L	88.3	Confident	85.5	Confident	89 Å²	89	108.9 Å²	108.9	47%	0.466	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-36.7	175.2	-76.4	163.8	0	0	0	112.2	E10 R11 L18	E10-L14 WeakPolarHBondContact O-CB 3.28Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 3.42Å; R11-L14 PolarHBondContact O-N 3.08Å; L14-L18 VanDerWaalsContact O-CB 3.25Å; L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 WeakPolarHBondContact O-CD1 3.46Å; L14-L18 WeakPolarHBondContact O-CG 3.31Å; L14-L18 PolarHBondContact O-N 2.98Å
15	Q	90.2	Very high	86.9	Confident	141 Å²	141	102 Å²	102	66%	0.659	51%	0.51	S	S	*	.	H	α-helix	trans	-66.9	-43	174	-176.2	-179.8	1.5	0	0	111.8	R11 R12 R13 L18 S19	R11-Q15 WeakPolarHBondContact O-CB 3.48Å; R11-Q15 PolarHBondContact O-N 2.93Å; R12-Q15 WeakPolarHBondContact O-CB 3.5Å; R12-Q15 PolarHBondContact O-N 3.16Å; R13-Q15 VanDerWaalsContact C-N 3.28Å; R13-Q15 PolarHBondContact O-N 2.98Å; Q15-L18 PolarHBondContact O-N 2.8Å; Q15-S19 WeakPolarHBondContact O-CB 3.46Å; Q15-S19 PolarHBondContact O-N 2.88Å; Q15-S19 PolarHBondContact O-OG 3.43Å
16	E	92.3	Very high	87.9	Confident	76 Å²	76	100 Å²	100	36%	0.355	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-51	175.9	-72.2	167.6	171.8	0	0	110.1	R12 R13 L18 S19 E20	R12-E16 IonicContact CZ-OE1 3.24Å; R12-E16 VanDerWaalsContact CZ-OE1 3.24Å; R12-E16 IonicContact NE-OE1 2.74Å; R12-E16 PolarHBondContact NE-OE1 2.72Å; R12-E16 IonicContact NH2-OE1 2.83Å; R12-E16 PolarHBondContact NH2-OE1 2.76Å; R12-E16 WeakPolarHBondContact O-CG 3.36Å; R12-E16 PolarHBondContact O-N 3.05Å; R13-E16 PolarHBondContact O-N 3.33Å; E16-L18 PolarHBondContact O-N 2.81Å; E16-S19 WeakPolarHBondContact CA-OG 3.47Å; E16-S19 PolarHBondContact O-N 3.33Å; E16-S19 VanDerWaalsContact O-N 3.11Å; E16-S19 PolarHBondContact O-OG 2.81Å; E16-E20 WeakPolarHBondContact O-CG 3.21Å; E16-E20 PolarHBondContact O-N 3.04Å
17	E	93.9	Very high	88.9	Confident	117 Å²	117	104.1 Å²	104.1	55%	0.547	51%	0.506	S	S	.	.	H	α-helix	trans	-57	-43	174.8	-72.5	171.3	-164.6	0	0	113.1	R13 F21	R13-E17 WeakPolarHBondContact O-CB 3.49Å; R13-E17 WeakPolarHBondContact O-CG 3.17Å; R13-E17 PolarHBondContact O-N 3.25Å; E17-F21 WeakPolarHBondContact O-CB 3.37Å; E17-F21 PolarHBondContact O-N 3.46Å
18	L	93.1	Very high	89.4	Confident	110 Å²	110	104.3 Å²	104.3	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-68	-36.7	176.1	-75	170.1	0	0	0	112.1	L14 Q15 E16 F21 V22	L14-L18 VanDerWaalsContact O-CB 3.25Å; L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 WeakPolarHBondContact O-CD1 3.46Å; L14-L18 WeakPolarHBondContact O-CG 3.31Å; L14-L18 PolarHBondContact O-N 2.98Å; Q15-L18 PolarHBondContact O-N 2.8Å; E16-L18 PolarHBondContact O-N 2.81Å; L18-F21 PolarHBondContact O-N 2.93Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.47Å; L18-V22 PolarHBondContact O-N 2.85Å
19	S	92.8	Very high	89.9	Confident	54 Å²	54	104 Å²	104	38%	0.378	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-43.3	175.8	64	0	0	0	0	112	Q15 E16 F21 V22 E23	Q15-S19 WeakPolarHBondContact O-CB 3.46Å; Q15-S19 PolarHBondContact O-N 2.88Å; Q15-S19 PolarHBondContact O-OG 3.43Å; E16-S19 WeakPolarHBondContact CA-OG 3.47Å; E16-S19 PolarHBondContact O-N 3.33Å; E16-S19 VanDerWaalsContact O-N 3.11Å; E16-S19 PolarHBondContact O-OG 2.81Å; S19-F21 VanDerWaalsContact C-N 3.31Å; S19-F21 PolarHBondContact O-N 2.83Å; S19-V22 PolarHBondContact O-N 3.09Å; S19-E23 WeakPolarHBondContact O-CG 3.37Å; S19-E23 PolarHBondContact O-N 3.39Å
20	E	94.9	Very high	90.2	Very high	136 Å²	136	102.4 Å²	102.4	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-62.4	-38.4	174.3	-70.2	-179.4	-177.1	0	0	111.8	E16 S24	E16-E20 WeakPolarHBondContact O-CG 3.21Å; E16-E20 PolarHBondContact O-N 3.04Å; E20-S24 WeakPolarHBondContact O-CB 3.18Å; E20-S24 PolarHBondContact O-N 2.97Å
21	F	94.8	Very high	90.6	Very high	136 Å²	136	104.4 Å²	104.4	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-65.3	-45.5	174.3	179.4	-99.7	0	0	0	112.3	E17 L18 S19 S24 C25	E17-F21 WeakPolarHBondContact O-CB 3.37Å; E17-F21 PolarHBondContact O-N 3.46Å; L18-F21 PolarHBondContact O-N 2.93Å; S19-F21 VanDerWaalsContact C-N 3.31Å; S19-F21 PolarHBondContact O-N 2.83Å; F21-S24 WeakPolarHBondContact O-CB 3.44Å; F21-S24 PolarHBondContact O-N 3.25Å; F21-C25 PolarHBondContact O-N 2.69Å; F21-C25 PolarHBondContact O-SG 3.24Å; F21-C25 VanDerWaalsContact O-SG 3.36Å
22	V	93.6	Very high	91	Very high	84 Å²	84	102.7 Å²	102.7	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-45.8	176.5	168.7	0	0	0	0	110.8	L18 S19 S24 C25 C26	L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.47Å; L18-V22 PolarHBondContact O-N 2.85Å; S19-V22 PolarHBondContact O-N 3.09Å; V22-S24 VanDerWaalsContact C-N 3.32Å; V22-S24 PolarHBondContact O-N 3.15Å; V22-C25 WeakPolarHBondContact O-CB 3.44Å; V22-C25 PolarHBondContact O-N 3.17Å; V22-C25 VanDerWaalsContact O-N 3.17Å; V22-C26 PolarHBondContact O-N 3.38Å; V22-C26 PolarHBondContact O-SG 3.49Å
23	E	93.8	Very high	91.1	Very high	98 Å²	98	95.9 Å²	95.9	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-59.5	-41.6	175	-76.4	-172.5	-150.4	0	0	112.4	S19 C26 R27	S19-E23 WeakPolarHBondContact O-CG 3.37Å; S19-E23 PolarHBondContact O-N 3.39Å; E23-C26 PolarHBondContact O-N 2.99Å; E23-R27 VanDerWaalsContact O-CG 3.28Å; E23-R27 WeakPolarHBondContact O-CG 3.25Å; E23-R27 PolarHBondContact O-N 2.87Å; E23-R27 IonicContact OE2-CZ 3.67Å; E23-R27 IonicContact OE2-NH2 2.78Å; E23-R27 PolarHBondContact OE2-NH2 3.4Å
24	S	93.6	Very high	91.1	Very high	66 Å²	66	91.1 Å²	91.1	46%	0.462	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-44.1	174.9	-171.9	0	0	0	0	111.4	E20 F21 V22 R27 T28	E20-S24 WeakPolarHBondContact O-CB 3.18Å; E20-S24 PolarHBondContact O-N 2.97Å; F21-S24 WeakPolarHBondContact O-CB 3.44Å; F21-S24 PolarHBondContact O-N 3.25Å; V22-S24 VanDerWaalsContact C-N 3.32Å; V22-S24 PolarHBondContact O-N 3.15Å; S24-R27 PolarHBondContact O-N 3.05Å; S24-T28 WeakPolarHBondContact O-CG2 3.25Å; S24-T28 PolarHBondContact O-N 3.13Å; S24-T28 PolarHBondContact O-OG1 2.93Å
25	C	90.6	Very high	91.1	Very high	45 Å²	45	91.4 Å²	91.4	30%	0.304	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-47.7	174.4	-70.9	0	0	0	0	112.2	F21 V22 R27 T28 L29	F21-C25 PolarHBondContact O-N 2.69Å; F21-C25 PolarHBondContact O-SG 3.24Å; F21-C25 VanDerWaalsContact O-SG 3.36Å; V22-C25 WeakPolarHBondContact O-CB 3.44Å; V22-C25 PolarHBondContact O-N 3.17Å; V22-C25 VanDerWaalsContact O-N 3.17Å; C25-R27 PolarHBondContact O-N 3.46Å; C25-T28 PolarHBondContact O-N 3.33Å; C25-T28 PolarHBondContact O-OG1 3.16Å; C25-L29 WeakPolarHBondContact O-CG 3.24Å; C25-L29 PolarHBondContact O-N 3.47Å
26	C	87.1	Confident	90.9	Very high	49 Å²	49	89.7 Å²	89.7	33%	0.331	48%	0.481	S	S	.	.	H	α-helix	trans	-56.4	-48.9	177.5	-67.2	0	0	0	0	111.6	V22 E23 T28 L29 E30	V22-C26 PolarHBondContact O-N 3.38Å; V22-C26 PolarHBondContact O-SG 3.49Å; E23-C26 PolarHBondContact O-N 2.99Å; C26-T28 VanDerWaalsContact C-N 3.34Å; C26-T28 PolarHBondContact O-N 3.49Å; C26-L29 CarbonylContact O-C 3.46Å; C26-L29 WeakPolarHBondContact O-CA 3.46Å; C26-L29 WeakPolarHBondContact O-CB 3.47Å; C26-L29 PolarHBondContact O-N 3.47Å; C26-E30 WeakPolarHBondContact O-CG 3.45Å; C26-E30 PolarHBondContact O-N 3.36Å
27	R	89.8	Confident	90.5	Very high	140 Å²	140	89.1 Å²	89.1	53%	0.528	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-41.3	177.2	-65.7	172.1	-155	177.1	8.2	112.4	E23 S24 C25 L29 E30 E31	E23-R27 VanDerWaalsContact O-CG 3.28Å; E23-R27 WeakPolarHBondContact O-CG 3.25Å; E23-R27 PolarHBondContact O-N 2.87Å; E23-R27 IonicContact OE2-CZ 3.67Å; E23-R27 IonicContact OE2-NH2 2.78Å; E23-R27 PolarHBondContact OE2-NH2 3.4Å; S24-R27 PolarHBondContact O-N 3.05Å; C25-R27 PolarHBondContact O-N 3.46Å; R27-L29 VanDerWaalsContact C-N 3.3Å; R27-L29 PolarHBondContact O-N 3.26Å; R27-E30 PolarHBondContact O-N 2.96Å; R27-E31 WeakPolarHBondContact O-CG 3.37Å; R27-E31 PolarHBondContact O-N 2.76Å
28	T	90.9	Very high	89.9	Confident	71 Å²	71	90.2 Å²	90.2	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-30.6	175.1	58.9	0	0	0	0	113.2	S24 C25 C26 V32	S24-T28 WeakPolarHBondContact O-CG2 3.25Å; S24-T28 PolarHBondContact O-N 3.13Å; S24-T28 PolarHBondContact O-OG1 2.93Å; C25-T28 PolarHBondContact O-N 3.33Å; C25-T28 PolarHBondContact O-OG1 3.16Å; C26-T28 VanDerWaalsContact C-N 3.34Å; C26-T28 PolarHBondContact O-N 3.49Å; T28-V32 VanDerWaalsContact O-CG2 3.25Å; T28-V32 WeakPolarHBondContact O-CG2 3.4Å; T28-V32 PolarHBondContact O-N 3.25Å
29	L	88.4	Confident	89.2	Confident	96 Å²	96	90.7 Å²	90.7	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-46.2	174.1	-70.3	169.6	0	0	0	110.6	C25 C26 R27 E31 V32 T33	C25-L29 WeakPolarHBondContact O-CG 3.24Å; C25-L29 PolarHBondContact O-N 3.47Å; C26-L29 CarbonylContact O-C 3.46Å; C26-L29 WeakPolarHBondContact O-CA 3.46Å; C26-L29 WeakPolarHBondContact O-CB 3.47Å; C26-L29 PolarHBondContact O-N 3.47Å; R27-L29 VanDerWaalsContact C-N 3.3Å; R27-L29 PolarHBondContact O-N 3.26Å; L29-E31 PolarHBondContact O-N 2.69Å; L29-V32 CarbonylContact O-C 3.6Å; L29-V32 PolarHBondContact O-N 3.36Å; L29-V32 VanDerWaalsContact O-N 3.13Å; L29-T33 WeakPolarHBondContact O-CG2 3.33Å; L29-T33 PolarHBondContact O-N 3.41Å; L29-T33 PolarHBondContact O-OG1 3.27Å
30	E	88.4	Confident	88.1	Confident	98 Å²	98	90.9 Å²	90.9	46%	0.458	49%	0.494	S	S	.	.	H	α-helix	trans	-55.5	-45.9	173.8	-69.9	163.8	-154.8	0	0	111.9	C26 R27 V32 T33 A34 L40	C26-E30 WeakPolarHBondContact O-CG 3.45Å; C26-E30 PolarHBondContact O-N 3.36Å; R27-E30 PolarHBondContact O-N 2.96Å; E30-V32 VanDerWaalsContact C-N 3.34Å; E30-V32 PolarHBondContact O-N 3.18Å; E30-T33 PolarHBondContact O-N 3.36Å; E30-T33 PolarHBondContact O-OG1 2.81Å; E30-A34 WeakPolarHBondContact O-CB 3.33Å; E30-A34 PolarHBondContact O-N 2.63Å; E30-L40 HydrophobicContact CG-CB 4.47Å; E30-L40 HydrophobicContact CG-CD2 3.75Å
31	E	90.8	Very high	86.8	Confident	143 Å²	143	91.4 Å²	91.4	67%	0.668	50%	0.502	S	S	*	.	H	α-helix	trans	-60.8	-41.5	175.8	-76.1	178.7	-173.2	0	0	112.1	R27 L29 S35	R27-E31 WeakPolarHBondContact O-CG 3.37Å; R27-E31 PolarHBondContact O-N 2.76Å; L29-E31 PolarHBondContact O-N 2.69Å; E31-S35 WeakPolarHBondContact O-CB 3.38Å; E31-S35 PolarHBondContact O-N 3.01Å
32	V	90.8	Very high	85.4	Confident	82 Å²	82	88.5 Å²	88.5	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-70.6	-45.5	178.2	169.6	0	0	0	0	111.4	T28 L29 E30 S35 L36	T28-V32 VanDerWaalsContact O-CG2 3.25Å; T28-V32 WeakPolarHBondContact O-CG2 3.4Å; T28-V32 PolarHBondContact O-N 3.25Å; L29-V32 CarbonylContact O-C 3.6Å; L29-V32 PolarHBondContact O-N 3.36Å; L29-V32 VanDerWaalsContact O-N 3.13Å; E30-V32 VanDerWaalsContact C-N 3.34Å; E30-V32 PolarHBondContact O-N 3.18Å; V32-S35 PolarHBondContact O-N 3.37Å; V32-S35 PolarHBondContact O-OG 3.16Å; V32-L36 HydrophobicContact CG1-CD1 4.33Å; V32-L36 WeakPolarHBondContact O-CG 3.37Å; V32-L36 PolarHBondContact O-N 3.37Å
33	T	87.1	Confident	83.9	Confident	15 Å²	15	88.3 Å²	88.3	9%	0.092	49%	0.494	C	S	.	.	H	α-helix	trans	-67	-41.8	179.4	60.3	0	0	0	0	110.9	L29 E30 S35 L36 G37 W38 L40 L43	L29-T33 WeakPolarHBondContact O-CG2 3.33Å; L29-T33 PolarHBondContact O-N 3.41Å; L29-T33 PolarHBondContact O-OG1 3.27Å; E30-T33 PolarHBondContact O-N 3.36Å; E30-T33 PolarHBondContact O-OG1 2.81Å; T33-S35 VanDerWaalsContact C-N 3.28Å; T33-S35 PolarHBondContact O-N 3Å; T33-L36 CarbonylContact O-C 3.6Å; T33-L36 WeakPolarHBondContact O-CA 3.14Å; T33-L36 WeakPolarHBondContact O-CB 3.32Å; T33-L36 PolarHBondContact O-N 2.88Å; T33-G37 PolarHBondContact O-N 3.25Å; T33-W38 CarbonylContact C-O 3.54Å; T33-W38 WeakPolarHBondContact CB-O 3.49Å; T33-W38 PolarHBondContact O-N 3.4Å; T33-W38 VanDerWaalsContact O-O 3.1Å; T33-W38 PolarHBondContact OG1-O 2.87Å; T33-L40 HydrophobicContact CG2-CD1 4.09Å; T33-L43 HydrophobicContact CG2-CD1 3.59Å
34	A	87.9	Confident	82.1	Confident	67 Å²	67	89.4 Å²	89.4	55%	0.554	50%	0.503	S	S	*	.	H	α-helix	trans	-59.9	-37.6	173.3	0	0	0	0	0	112.1	E30 L36 G37 W38	E30-A34 WeakPolarHBondContact O-CB 3.33Å; E30-A34 PolarHBondContact O-N 2.63Å; A34-L36 PolarHBondContact O-N 3.37Å; A34-G37 PolarHBondContact O-N 3.26Å; A34-G37 VanDerWaalsContact O-N 3.08Å; A34-W38 PolarHBondContact N-O 2.89Å
35	S	89.1	Confident	80.2	Confident	96 Å²	96	89.8 Å²	89.8	67%	0.671	50%	0.504	S	S	*	.	H	α-helix	trans	-65	-24.8	174.3	83.1	0	0	0	0	113.7	E31 V32 T33	E31-S35 WeakPolarHBondContact O-CB 3.38Å; E31-S35 PolarHBondContact O-N 3.01Å; V32-S35 PolarHBondContact O-N 3.37Å; V32-S35 PolarHBondContact O-OG 3.16Å; T33-S35 VanDerWaalsContact C-N 3.28Å; T33-S35 PolarHBondContact O-N 3Å
36	L	85.9	Confident	78.1	Confident	105 Å²	105	89.4 Å²	89.4	55%	0.55	51%	0.507	S	S	.	.	H	α-helix	trans	-91.1	-4.5	175	-63.4	171.4	0	0	0	112.9	V32 T33 A34 W38	V32-L36 HydrophobicContact CG1-CD1 4.33Å; V32-L36 WeakPolarHBondContact O-CG 3.37Å; V32-L36 PolarHBondContact O-N 3.37Å; T33-L36 CarbonylContact O-C 3.6Å; T33-L36 WeakPolarHBondContact O-CA 3.14Å; T33-L36 WeakPolarHBondContact O-CB 3.32Å; T33-L36 PolarHBondContact O-N 2.88Å; A34-L36 PolarHBondContact O-N 3.37Å; L36-W38 HydrophobicContact CB-CD2 4.38Å; L36-W38 HydrophobicContact CB-CG 4.46Å; L36-W38 HydrophobicContact CD1-CE3 4.36Å; L36-W38 HydrophobicContact CD1-CZ3 4.49Å
37	G	82.6	Confident	76.5	Confident	64 Å²	64	95.8 Å²	95.8	66%	0.66	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	27.5	-174.6	0	0	0	0	0	113.7	T33 A34	T33-G37 PolarHBondContact O-N 3.25Å; A34-G37 PolarHBondContact O-N 3.26Å; A34-G37 VanDerWaalsContact O-N 3.08Å
38	W	82.7	Confident	74.6	Confident	140 Å²	140	98.1 Å²	98.1	53%	0.53	55%	0.549	S	S	.	.			trans	-113	129.8	176.2	-62.2	-12.7	0	0	0	110.2	T33 A34 L36 L43	T33-W38 CarbonylContact C-O 3.54Å; T33-W38 WeakPolarHBondContact CB-O 3.49Å; T33-W38 PolarHBondContact O-N 3.4Å; T33-W38 VanDerWaalsContact O-O 3.1Å; T33-W38 PolarHBondContact OG1-O 2.87Å; A34-W38 PolarHBondContact N-O 2.89Å; L36-W38 HydrophobicContact CB-CD2 4.38Å; L36-W38 HydrophobicContact CB-CG 4.46Å; L36-W38 HydrophobicContact CD1-CE3 4.36Å; L36-W38 HydrophobicContact CD1-CZ3 4.49Å; W38-L43 HydrophobicContact CB-CD1 3.97Å; W38-L43 HydrophobicContact CB-CD2 4.32Å; W38-L43 HydrophobicContact CB-CG 4.29Å; W38-L43 HydrophobicContact CD2-CD1 4.38Å; W38-L43 HydrophobicContact CD2-CD2 4.04Å; W38-L43 HydrophobicContact CE3-CD1 3.73Å; W38-L43 HydrophobicContact CE3-CD2 3.78Å; W38-L43 HydrophobicContact CE3-CG 4.39Å; W38-L43 HydrophobicContact CG-CD2 4.31Å; W38-L43 HydrophobicContact CZ3-CD2 4.38Å
39	D	78.3	Confident	72.4	Confident	120 Å²	120	102.9 Å²	102.9	64%	0.642	57%	0.567	S	S	*	*			trans	-80.8	134.1	170.4	-60.6	-43.5	0	0	0	108.6	D41 S42	D39-D41 VanDerWaalsContact C-N 3.26Å; D39-D41 PolarHBondContact O-N 3.09Å; D39-S42 WeakPolarHBondContact O-CB 3.46Å; D39-S42 PolarHBondContact O-N 3.06Å; D39-S42 PolarHBondContact O-OG 3.32Å
40	L	69.5	Low	70.4	Confident	57 Å²	57	101.8 Å²	101.8	30%	0.298	57%	0.571	S	S	.	*	H	α-helix	trans	-61.6	-37.8	-175.1	-171.6	61.2	0	0	0	111.5	E30 T33 S42 L43 D44	E30-L40 HydrophobicContact CG-CB 4.47Å; E30-L40 HydrophobicContact CG-CD2 3.75Å; T33-L40 HydrophobicContact CG2-CD1 4.09Å; L40-S42 PolarHBondContact O-N 3.34Å; L40-S42 VanDerWaalsContact O-N 3.15Å; L40-L43 PolarHBondContact O-N 3.04Å; L40-D44 PolarHBondContact O-N 3.49Å
41	D	67.9	Low	68.6	Low	147 Å²	147	100.7 Å²	100.7	79%	0.786	58%	0.579	S	S	*	*	H	α-helix	trans	-62.9	-13.6	173.3	-53.2	-32.5	0	0	0	114.1	D39	D39-D41 VanDerWaalsContact C-N 3.26Å; D39-D41 PolarHBondContact O-N 3.09Å
42	S	63.7	Low	66.8	Low	75 Å²	75	102.4 Å²	102.4	52%	0.524	59%	0.587	S	S	.	*	H	α-helix	trans	-95.5	-11.9	175.4	75.3	0	0	0	0	113.6	D39 L40	D39-S42 WeakPolarHBondContact O-CB 3.46Å; D39-S42 PolarHBondContact O-N 3.06Å; D39-S42 PolarHBondContact O-OG 3.32Å; L40-S42 PolarHBondContact O-N 3.34Å; L40-S42 VanDerWaalsContact O-N 3.15Å
43	L	62.9	Low	65.5	Low	81 Å²	81	102 Å²	102	42%	0.424	58%	0.582	S	S	.	*	H	α-helix	trans	-99.6	-32.1	-179.8	-62.2	174.8	0	0	0	112.3	T33 W38 L40 P45	T33-L43 HydrophobicContact CG2-CD1 3.59Å; W38-L43 HydrophobicContact CB-CD1 3.97Å; W38-L43 HydrophobicContact CB-CD2 4.32Å; W38-L43 HydrophobicContact CB-CG 4.29Å; W38-L43 HydrophobicContact CD2-CD1 4.38Å; W38-L43 HydrophobicContact CD2-CD2 4.04Å; W38-L43 HydrophobicContact CE3-CD1 3.73Å; W38-L43 HydrophobicContact CE3-CD2 3.78Å; W38-L43 HydrophobicContact CE3-CG 4.39Å; W38-L43 HydrophobicContact CG-CD2 4.31Å; W38-L43 HydrophobicContact CZ3-CD2 4.38Å; L40-L43 PolarHBondContact O-N 3.04Å; L43-P45 WeakPolarHBondContact O-CD 3.23Å
44	D	55.8	Low	65.1	Low	121 Å²	121	106.6 Å²	106.6	65%	0.647	60%	0.602	S	S	*	*	S	Bend	trans	-103	84.6	159	-167.4	28	0	0	0	107.6	L40 G46	L40-D44 PolarHBondContact O-N 3.49Å; D44-G46 PolarHBondContact O-N 3.42Å
45	P	53.7	Low	65	Low	74 Å²	74	108.4 Å²	108.4	48%	0.481	61%	0.606	S	S	.	*			trans	-62.5	93	160.5	28.6	-31.6	0	0	0	105.7	L43 E49	L43-P45 WeakPolarHBondContact O-CD 3.23Å; P45-E49 HydrophobicContact CB-CB 4.24Å
46	G	47.1	Very low	65	Low	36 Å²	36	105.3 Å²	105.3	37%	0.371	58%	0.583	S	S	.	*			trans	-51.5	165.8	176.4	0	0	0	0	0	110.4	D44 E48 E49	D44-G46 PolarHBondContact O-N 3.42Å; G46-E48 PolarHBondContact O-N 3.24Å; G46-E49 PolarHBondContact O-N 2.77Å; G46-E49 VanDerWaalsContact O-N 3.09Å
47	E	52.4	Low	65.2	Low	183 Å²	183	105.1 Å²	105.1	86%	0.855	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.7	-7.2	-166.7	-57.1	179.1	142.8	0	0	115.7
48	E	49.8	Very low	65.6	Low	190 Å²	190	102.3 Å²	102.3	89%	0.888	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-35.5	173.2	-53.4	-168.2	160.8	0	0	115.6	G46	G46-E48 PolarHBondContact O-N 3.24Å
49	E	45.4	Very low	65.9	Low	171 Å²	171	100.2 Å²	100.2	80%	0.799	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-15.5	174.7	-83.3	-138	165.3	0	0	113.6	P45 G46 A51	P45-E49 HydrophobicContact CB-CB 4.24Å; G46-E49 PolarHBondContact O-N 2.77Å; G46-E49 VanDerWaalsContact O-N 3.09Å; E49-A51 PolarHBondContact O-N 3.41Å
50	A	47	Very low	66.3	Low	73 Å²	73	98.3 Å²	98.3	60%	0.603	54%	0.541	S	S	*	.	S	Bend	trans	-75.7	65.6	161.2	0	0	0	0	0	109.6	E52	A50-E52 PolarHBondContact O-N 3.26Å
51	A	49.6	Very low	67.1	Low	74 Å²	74	97.5 Å²	97.5	61%	0.612	54%	0.537	S	S	*	.			trans	-30.8	126.4	-173.8	0	0	0	0	0	112.8	E49 D53	E49-A51 PolarHBondContact O-N 3.41Å; A51-D53 WeakPolarHBondContact O-CB 3.2Å; A51-D53 PolarHBondContact O-N 2.89Å
52	E	54.4	Low	68	Low	180 Å²	180	94.7 Å²	94.7	84%	0.841	53%	0.529	S	S	*	.			trans	-51.2	79.5	-174.7	-63.6	-175.8	175.3	0	0	113.1	A50 E54	A50-E52 PolarHBondContact O-N 3.26Å; E52-E54 PolarHBondContact O-N 2.98Å
53	D	61.7	Low	69.1	Low	73 Å²	73	97 Å²	97	39%	0.39	54%	0.535	S	S	.	.			trans	-85.7	69.1	-174.1	-146.8	-5.6	0	0	0	106.9	A51 V55 P67 S69	A51-D53 WeakPolarHBondContact O-CB 3.2Å; A51-D53 PolarHBondContact O-N 2.89Å; D53-V55 PolarHBondContact O-N 3.43Å; D53-P67 HydrophobicContact CB-CB 3.8Å; D53-P67 HydrophobicContact CB-CG 4.4Å; D53-P67 VanDerWaalsContact CG-CB 3.41Å; D53-P67 WeakPolarHBondContact O-CA 3.29Å; D53-P67 WeakPolarHBondContact OD2-CB 3.49Å; D53-S69 VanDerWaalsContact CG-OG 3.29Å; D53-S69 VanDerWaalsContact OD1-CB 3.31Å; D53-S69 WeakPolarHBondContact OD1-CB 3.41Å; D53-S69 PolarHBondContact OD1-N 2.95Å; D53-S69 PolarHBondContact OD1-OG 2.94Å; D53-S69 WeakPolarHBondContact OD2-CB 3.43Å; D53-S69 PolarHBondContact OD2-OG 3.45Å
54	E	80.5	Confident	70.3	Confident	112 Å²	112	96.6 Å²	96.6	52%	0.523	53%	0.531	S	S	.	.			trans	-33.6	117.1	-166.5	-84.4	179.7	-99.6	0	0	111.9	E52 V56 K68	E52-E54 PolarHBondContact O-N 2.98Å; E54-V56 PolarHBondContact O-N 3.37Å; E54-V56 VanDerWaalsContact O-N 3.11Å; E54-K68 HydrophobicContact CB-CD 3.87Å; E54-K68 HydrophobicContact CB-CG 4.2Å; E54-K68 WeakPolarHBondContact O-CG 3.45Å; E54-K68 PolarHBondContact O-N 3.3Å; E54-K68 IonicContact OE1-NZ 2.65Å; E54-K68 PolarHBondContact OE1-NZ 3.27Å; E54-K68 VanDerWaalsContact OE2-CE 3.3Å; E54-K68 WeakPolarHBondContact OE2-CE 3.43Å; E54-K68 IonicContact OE2-NZ 3.46Å; E54-K68 PolarHBondContact OE2-NZ 3.4Å
55	V	85.4	Confident	71.9	Confident	104 Å²	104	96.8 Å²	96.8	63%	0.63	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	111.1	-175.2	-177.7	0	0	0	0	109.4	D53 H65	D53-V55 PolarHBondContact O-N 3.43Å; V55-H65 HydrophobicContact CG1-CB 3.78Å
56	V	88.3	Confident	73.6	Confident	32 Å²	32	94.7 Å²	94.7	19%	0.194	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	151.3	-178.4	-75	0	0	0	0	111.8	E54 M66 K68 L71	E54-V56 PolarHBondContact O-N 3.37Å; E54-V56 VanDerWaalsContact O-N 3.11Å; V56-M66 VanDerWaalsContact CG2-O 3.25Å; V56-M66 WeakPolarHBondContact CG2-O 3.13Å; V56-M66 PolarHBondContact N-O 2.82Å; V56-M66 PolarHBondContact O-N 2.84Å; V56-K68 HydrophobicContact CB-CG 4.38Å; V56-K68 HydrophobicContact CG1-CD 4.3Å; V56-K68 HydrophobicContact CG1-CG 3.61Å; V56-K68 HydrophobicContact CG2-CB 4.42Å; V56-K68 HydrophobicContact CG2-CG 3.8Å; V56-L71 HydrophobicContact CG2-CB 4.14Å; V56-L71 HydrophobicContact CG2-CD1 4.29Å; V56-L71 HydrophobicContact CG2-CD2 3.97Å; V56-L71 HydrophobicContact CG2-CG 4.34Å
57	L	91.3	Very high	75.6	Confident	100 Å²	100	95.2 Å²	95.2	52%	0.524	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	141.5	178.1	-62.7	175.8	0	0	0	111.3	H64 H65	L57-H64 WeakPolarHBondContact CA-O 3.46Å; L57-H65 WeakPolarHBondContact CD2-CD2 3.24Å; L57-H65 VanDerWaalsContact CD2-NE2 3.32Å; L57-H65 WeakPolarHBondContact CD2-NE2 3.47Å
58	C	90.7	Very high	77.3	Confident	6 Å²	6	91.2 Å²	91.2	4%	0.041	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.5	173.3	-175.5	0	0	0	0	111.8	Y60 D61 H64 H74	C58-Y60 PolarHBondContact O-N 3.14Å; C58-Y60 VanDerWaalsContact O-N 3.11Å; C58-Y60 PolarHBondContact SG-N 3.13Å; C58-Y60 VanDerWaalsContact SG-N 3.44Å; C58-D61 CarbonylContact O-C 3.44Å; C58-D61 PolarHBondContact O-N 3.36Å; C58-H64 HydrophobicContact CB-CB 3.68Å; C58-H64 PolarHBondContact N-O 3.3Å; C58-H74 PolarHBondContact SG-CD2 2.93Å; C58-H74 PolarHBondContact SG-NE2 3.38Å
59	P	89.4	Confident	79.1	Confident	95 Å²	95	86.1 Å²	86.1	62%	0.617	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	174.6	-25.1	35.3	0	0	0	115.3	M75	P59-M75 HydrophobicContact CG-CE 4.24Å; P59-M75 HydrophobicContact CG-SD 4.46Å
60	Y	85.7	Confident	81.1	Confident	80 Å²	80	79.4 Å²	79.4	31%	0.314	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-20.9	-177	-58.4	-64	0	0	0	113.9	C58 M75 C78 R79 K82	C58-Y60 PolarHBondContact O-N 3.14Å; C58-Y60 VanDerWaalsContact O-N 3.11Å; C58-Y60 PolarHBondContact SG-N 3.13Å; C58-Y60 VanDerWaalsContact SG-N 3.44Å; Y60-M75 HydrophobicContact CE2-CB 4.07Å; Y60-M75 HydrophobicContact CE2-CE 4.33Å; Y60-M75 HydrophobicContact CE2-CG 4.25Å; Y60-M75 WeakPolarHBondContact CE2-O 3.43Å; Y60-C78 HydrophobicContact CD2-CB 4.43Å; Y60-R79 HydrophobicContact CD2-CB 4.29Å; Y60-R79 HydrophobicContact CE1-CB 4.47Å; Y60-R79 HydrophobicContact CE1-CG 4.49Å; Y60-R79 HydrophobicContact CE2-CB 3.88Å; Y60-K82 WeakPolarHBondContact O-CE 3.22Å; Y60-K82 PolarHBondContact O-NZ 2.98Å
61	D	86.8	Confident	83.2	Confident	40 Å²	40	77.8 Å²	77.8	21%	0.214	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	120	176.3	-155.6	-62.6	0	0	0	110.5	C58 N63 H64 K82	C58-D61 CarbonylContact O-C 3.44Å; C58-D61 PolarHBondContact O-N 3.36Å; D61-N63 PolarHBondContact O-N 3.27Å; D61-N63 VanDerWaalsContact O-N 3.15Å; D61-N63 WeakPolarHBondContact OD1-CB 3.32Å; D61-N63 PolarHBondContact OD1-N 2.88Å; D61-N63 PolarHBondContact OD1-ND2 3.49Å; D61-H64 PolarHBondContact O-N 2.74Å; D61-K82 IonicContact OD2-NZ 3.26Å
62	S	86.4	Confident	85	Confident	89 Å²	89	77.9 Å²	77.9	62%	0.622	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	-13.5	-177.7	53.4	0	0	0	0	114
63	N	87	Confident	86.7	Confident	122 Å²	122	77.5 Å²	77.5	65%	0.652	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	-14.2	179	-51.9	-58.6	0	0	0	112.6	D61 H65	D61-N63 PolarHBondContact O-N 3.27Å; D61-N63 VanDerWaalsContact O-N 3.15Å; D61-N63 WeakPolarHBondContact OD1-CB 3.32Å; D61-N63 PolarHBondContact OD1-N 2.88Å; D61-N63 PolarHBondContact OD1-ND2 3.49Å; N63-H65 PolarHBondContact O-N 3.44Å; N63-H65 PolarHBondContact O-ND1 3.45Å
64	H	87.6	Confident	88.1	Confident	74 Å²	74	75.9 Å²	75.9	34%	0.343	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.1	179.3	-66.5	168.6	0	0	0	110.8	L57 C58 D61 H74 C78	L57-H64 WeakPolarHBondContact CA-O 3.46Å; C58-H64 HydrophobicContact CB-CB 3.68Å; C58-H64 PolarHBondContact N-O 3.3Å; D61-H64 PolarHBondContact O-N 2.74Å; H64-H74 AromaticContact CG-CE1 3.75Å; H64-H74 AromaticContact CG-NE2 3.86Å; H64-H74 AromaticContact ND1-CE1 3.26Å; H64-H74 PolarHBondContact ND1-CE1 3.48Å; H64-H74 VanDerWaalsContact ND1-CE1 3.26Å; H64-H74 AromaticContact ND1-NE2 3.31Å; H64-H74 PolarHBondContact ND1-NE2 2.89Å; H64-C78 PolarHBondContact ND1-SG 3.11Å; H64-C78 VanDerWaalsContact ND1-SG 3.38Å
65	H	89.1	Confident	88.5	Confident	125 Å²	125	73.5 Å²	73.5	58%	0.579	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.8	178.4	-63.3	73.4	0	0	0	108.7	V55 L57 N63	V55-H65 HydrophobicContact CG1-CB 3.78Å; L57-H65 WeakPolarHBondContact CD2-CD2 3.24Å; L57-H65 VanDerWaalsContact CD2-NE2 3.32Å; L57-H65 WeakPolarHBondContact CD2-NE2 3.47Å; N63-H65 PolarHBondContact O-N 3.44Å; N63-H65 PolarHBondContact O-ND1 3.45Å
66	M	89.2	Confident	88.7	Confident	30 Å²	30	71.1 Å²	71.1	15%	0.148	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	163.4	178	66.6	-154.1	-47.5	0	0	115	V56 S70 L71 H74	V56-M66 VanDerWaalsContact CG2-O 3.25Å; V56-M66 WeakPolarHBondContact CG2-O 3.13Å; V56-M66 PolarHBondContact N-O 2.82Å; V56-M66 PolarHBondContact O-N 2.84Å; M66-S70 VanDerWaalsContact CE-OG 3.29Å; M66-S70 WeakPolarHBondContact CE-OG 3.22Å; M66-L71 HydrophobicContact CG-CD1 4.45Å; M66-L71 HydrophobicContact SD-CD1 4.38Å; M66-H74 HydrophobicContact CE-CB 3.14Å; M66-H74 VanDerWaalsContact CE-CG 3.41Å; M66-H74 HydrophobicContact SD-CB 3.35Å; M66-H74 WeakPolarHBondContact SD-CB 3.34Å; M66-H74 PolarHBondContact SD-CD2 3.19Å
67	P	90.9	Very high	88.7	Confident	47 Å²	47	71.3 Å²	71.3	31%	0.305	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	141.7	174.2	-27.3	36	0	0	0	114.7	D53 S69 S70 L71	D53-P67 HydrophobicContact CB-CB 3.8Å; D53-P67 HydrophobicContact CB-CG 4.4Å; D53-P67 VanDerWaalsContact CG-CB 3.41Å; D53-P67 WeakPolarHBondContact O-CA 3.29Å; D53-P67 WeakPolarHBondContact OD2-CB 3.49Å; P67-S69 PolarHBondContact O-N 2.93Å; P67-S70 PolarHBondContact O-N 2.88Å; P67-S70 PolarHBondContact O-OG 3.43Å; P67-L71 PolarHBondContact O-N 3.38Å; P67-L71 VanDerWaalsContact O-N 3.16Å
68	K	87.6	Confident	88.7	Confident	99 Å²	99	66.9 Å²	66.9	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-51.1	-41.6	173.5	-82.2	-179.1	-172.3	176	0	112.5	E54 V56 S70 L71	E54-K68 HydrophobicContact CB-CD 3.87Å; E54-K68 HydrophobicContact CB-CG 4.2Å; E54-K68 WeakPolarHBondContact O-CG 3.45Å; E54-K68 PolarHBondContact O-N 3.3Å; E54-K68 IonicContact OE1-NZ 2.65Å; E54-K68 PolarHBondContact OE1-NZ 3.27Å; E54-K68 VanDerWaalsContact OE2-CE 3.3Å; E54-K68 WeakPolarHBondContact OE2-CE 3.43Å; E54-K68 IonicContact OE2-NZ 3.46Å; E54-K68 PolarHBondContact OE2-NZ 3.4Å; V56-K68 HydrophobicContact CB-CG 4.38Å; V56-K68 HydrophobicContact CG1-CD 4.3Å; V56-K68 HydrophobicContact CG1-CG 3.61Å; V56-K68 HydrophobicContact CG2-CB 4.42Å; V56-K68 HydrophobicContact CG2-CG 3.8Å; K68-S70 PolarHBondContact O-N 3.16Å; K68-S70 VanDerWaalsContact O-N 3.16Å; K68-L71 PolarHBondContact O-N 2.86Å
69	S	87.4	Confident	88.6	Confident	82 Å²	82	73.7 Å²	73.7	57%	0.573	40%	0.4	S	S	*	.	H	α-helix	trans	-53.7	-31.9	176.2	66.2	0	0	0	0	113.8	D53 P67	D53-S69 VanDerWaalsContact CG-OG 3.29Å; D53-S69 VanDerWaalsContact OD1-CB 3.31Å; D53-S69 WeakPolarHBondContact OD1-CB 3.41Å; D53-S69 PolarHBondContact OD1-N 2.95Å; D53-S69 PolarHBondContact OD1-OG 2.94Å; D53-S69 WeakPolarHBondContact OD2-CB 3.43Å; D53-S69 PolarHBondContact OD2-OG 3.45Å; P67-S69 PolarHBondContact O-N 2.93Å
70	S	88.3	Confident	88.6	Confident	31 Å²	31	70.1 Å²	70.1	22%	0.217	38%	0.375	C	S	.	.	H	α-helix	trans	-98.2	-18.2	-175.5	76.1	0	0	0	0	114.3	M66 P67 K68 A72 K73 H74	M66-S70 VanDerWaalsContact CE-OG 3.29Å; M66-S70 WeakPolarHBondContact CE-OG 3.22Å; P67-S70 PolarHBondContact O-N 2.88Å; P67-S70 PolarHBondContact O-OG 3.43Å; K68-S70 PolarHBondContact O-N 3.16Å; K68-S70 VanDerWaalsContact O-N 3.16Å; S70-A72 VanDerWaalsContact C-N 3.33Å; S70-A72 PolarHBondContact O-N 3.04Å; S70-K73 PolarHBondContact O-N 3.36Å; S70-K73 VanDerWaalsContact O-N 3.14Å; S70-H74 PolarHBondContact O-N 2.94Å; S70-H74 VanDerWaalsContact O-N 3.16Å
71	L	89.2	Confident	88.8	Confident	38 Å²	38	73.5 Å²	73.5	20%	0.199	39%	0.387	C	S	.	.	H	α-helix	trans	-53.3	-46	-171.4	179	67	0	0	0	112.5	V56 M66 P67 K68 K73 H74 M75	V56-L71 HydrophobicContact CG2-CB 4.14Å; V56-L71 HydrophobicContact CG2-CD1 4.29Å; V56-L71 HydrophobicContact CG2-CD2 3.97Å; V56-L71 HydrophobicContact CG2-CG 4.34Å; M66-L71 HydrophobicContact CG-CD1 4.45Å; M66-L71 HydrophobicContact SD-CD1 4.38Å; P67-L71 PolarHBondContact O-N 3.38Å; P67-L71 VanDerWaalsContact O-N 3.16Å; K68-L71 PolarHBondContact O-N 2.86Å; L71-K73 PolarHBondContact O-N 2.97Å; L71-H74 PolarHBondContact O-N 3.26Å; L71-M75 HydrophobicContact CD1-CG 4.08Å; L71-M75 HydrophobicContact CD1-SD 4.26Å; L71-M75 HydrophobicContact CD2-SD 4.23Å; L71-M75 HydrophobicContact CG-CG 4.18Å; L71-M75 HydrophobicContact CG-SD 3.89Å; L71-M75 VanDerWaalsContact O-CG 3.32Å; L71-M75 WeakPolarHBondContact O-CG 3.42Å; L71-M75 PolarHBondContact O-N 3.36Å
72	A	89.2	Confident	88.9	Confident	77 Å²	77	77.9 Å²	77.9	64%	0.636	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-41.1	-177.4	0	0	0	0	0	112.9	S70 M75	S70-A72 VanDerWaalsContact C-N 3.33Å; S70-A72 PolarHBondContact O-N 3.04Å; A72-M75 PolarHBondContact O-N 3.47Å
73	K	88.8	Confident	88.8	Confident	172 Å²	172	77.3 Å²	77.3	75%	0.748	39%	0.393	S	S	*	.	H	α-helix	trans	-65	-44.3	176.7	-67.5	176.3	179.6	172	0	110.5	S70 L71 A76 S77	S70-K73 PolarHBondContact O-N 3.36Å; S70-K73 VanDerWaalsContact O-N 3.14Å; L71-K73 PolarHBondContact O-N 2.97Å; K73-A76 PolarHBondContact O-N 3.35Å; K73-S77 PolarHBondContact O-N 3.47Å
74	H	90.7	Very high	88.9	Confident	39 Å²	39	73.8 Å²	73.8	18%	0.181	39%	0.385	C	S	.	.	H	α-helix	trans	-69.6	-34.5	178.1	171.6	99.1	0	0	0	114	C58 H64 M66 S70 L71 A76 S77 C78	C58-H74 PolarHBondContact SG-CD2 2.93Å; C58-H74 PolarHBondContact SG-NE2 3.38Å; H64-H74 AromaticContact CG-CE1 3.75Å; H64-H74 AromaticContact CG-NE2 3.86Å; H64-H74 AromaticContact ND1-CE1 3.26Å; H64-H74 PolarHBondContact ND1-CE1 3.48Å; H64-H74 VanDerWaalsContact ND1-CE1 3.26Å; H64-H74 AromaticContact ND1-NE2 3.31Å; H64-H74 PolarHBondContact ND1-NE2 2.89Å; M66-H74 HydrophobicContact CE-CB 3.14Å; M66-H74 VanDerWaalsContact CE-CG 3.41Å; M66-H74 HydrophobicContact SD-CB 3.35Å; M66-H74 WeakPolarHBondContact SD-CB 3.34Å; M66-H74 PolarHBondContact SD-CD2 3.19Å; S70-H74 PolarHBondContact O-N 2.94Å; S70-H74 VanDerWaalsContact O-N 3.16Å; L71-H74 PolarHBondContact O-N 3.26Å; H74-A76 PolarHBondContact O-N 2.96Å; H74-S77 PolarHBondContact O-N 3.33Å; H74-C78 WeakPolarHBondContact NE2-CB 3.36Å; H74-C78 WeakPolarHBondContact O-CA 3.18Å; H74-C78 WeakPolarHBondContact O-CB 3.35Å; H74-C78 PolarHBondContact O-N 3.15Å
75	M	90.3	Very high	88.9	Confident	61 Å²	61	71 Å²	71	30%	0.3	37%	0.372	S	S	.	.	H	α-helix	trans	-57.3	-34.6	176.4	-79.4	177.9	68.4	0	0	111.5	P59 Y60 L71 A72 R79	P59-M75 HydrophobicContact CG-CE 4.24Å; P59-M75 HydrophobicContact CG-SD 4.46Å; Y60-M75 HydrophobicContact CE2-CB 4.07Å; Y60-M75 HydrophobicContact CE2-CE 4.33Å; Y60-M75 HydrophobicContact CE2-CG 4.25Å; Y60-M75 WeakPolarHBondContact CE2-O 3.43Å; L71-M75 HydrophobicContact CD1-CG 4.08Å; L71-M75 HydrophobicContact CD1-SD 4.26Å; L71-M75 HydrophobicContact CD2-SD 4.23Å; L71-M75 HydrophobicContact CG-CG 4.18Å; L71-M75 HydrophobicContact CG-SD 3.89Å; L71-M75 VanDerWaalsContact O-CG 3.32Å; L71-M75 WeakPolarHBondContact O-CG 3.42Å; L71-M75 PolarHBondContact O-N 3.36Å; A72-M75 PolarHBondContact O-N 3.47Å; M75-R79 WeakPolarHBondContact O-CB 3.25Å; M75-R79 PolarHBondContact O-N 3.26Å; M75-R79 VanDerWaalsContact O-N 3.12Å
76	A	88.8	Confident	89	Confident	55 Å²	55	68.2 Å²	68.2	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-60.3	171.8	0	0	0	0	0	111.9	K73 H74 C78 R79 L80	K73-A76 PolarHBondContact O-N 3.35Å; H74-A76 PolarHBondContact O-N 2.96Å; A76-C78 PolarHBondContact O-N 3.46Å; A76-R79 PolarHBondContact O-N 2.87Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.47Å
77	S	88.7	Confident	88.9	Confident	36 Å²	36	72.6 Å²	72.6	25%	0.252	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-38.8	-177.7	-50	0	0	0	0	113.4	K73 H74 L80 R81 E90	K73-S77 PolarHBondContact O-N 3.47Å; H74-S77 PolarHBondContact O-N 3.33Å; S77-L80 PolarHBondContact O-N 3.19Å; S77-R81 WeakPolarHBondContact O-CG 3.45Å; S77-R81 PolarHBondContact O-N 3.49Å; S77-E90 VanDerWaalsContact CA-OE1 3.24Å; S77-E90 WeakPolarHBondContact CA-OE1 3.3Å; S77-E90 WeakPolarHBondContact CB-OE1 3.4Å; S77-E90 PolarHBondContact OG-OE1 2.73Å
78	C	90.4	Very high	88.7	Confident	7 Å²	7	77.6 Å²	77.6	5%	0.047	40%	0.401	C	S	.	.	H	α-helix	trans	-70.2	-36.3	179	-168.3	0	0	0	0	111.6	Y60 H64 H74 A76 R81 K82	Y60-C78 HydrophobicContact CD2-CB 4.43Å; H64-C78 PolarHBondContact ND1-SG 3.11Å; H64-C78 VanDerWaalsContact ND1-SG 3.38Å; H74-C78 WeakPolarHBondContact NE2-CB 3.36Å; H74-C78 WeakPolarHBondContact O-CA 3.18Å; H74-C78 WeakPolarHBondContact O-CB 3.35Å; H74-C78 PolarHBondContact O-N 3.15Å; A76-C78 PolarHBondContact O-N 3.46Å; C78-R81 PolarHBondContact O-N 3.01Å; C78-K82 WeakPolarHBondContact O-CB 3.32Å; C78-K82 PolarHBondContact O-N 2.97Å
79	R	89.5	Confident	88.6	Confident	149 Å²	149	74.3 Å²	74.3	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-62.2	-46.3	170.4	-179.9	-178.6	175.5	-170.1	-2.8	110.7	Y60 M75 A76 R81 K82 M83	Y60-R79 HydrophobicContact CD2-CB 4.29Å; Y60-R79 HydrophobicContact CE1-CB 4.47Å; Y60-R79 HydrophobicContact CE1-CG 4.49Å; Y60-R79 HydrophobicContact CE2-CB 3.88Å; M75-R79 WeakPolarHBondContact O-CB 3.25Å; M75-R79 PolarHBondContact O-N 3.26Å; M75-R79 VanDerWaalsContact O-N 3.12Å; A76-R79 PolarHBondContact O-N 2.87Å; R79-R81 PolarHBondContact O-N 3.1Å; R79-K82 PolarHBondContact O-N 3.46Å; R79-M83 WeakPolarHBondContact O-CG 3.39Å; R79-M83 PolarHBondContact O-N 3.01Å; R79-M83 VanDerWaalsContact O-N 3.09Å
80	L	89.4	Confident	88.6	Confident	20 Å²	20	72.1 Å²	72.1	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-59.5	-46.1	176.7	-71.2	173.5	0	0	0	111.8	A76 S77 K82 M83 G84 Y85 E90 M93 L147	A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.47Å; S77-L80 PolarHBondContact O-N 3.19Å; L80-K82 PolarHBondContact O-N 2.87Å; L80-M83 CarbonylContact O-C 3.6Å; L80-M83 WeakPolarHBondContact O-CA 3.27Å; L80-M83 WeakPolarHBondContact O-CB 3.47Å; L80-M83 PolarHBondContact O-N 2.83Å; L80-M83 VanDerWaalsContact O-N 3.11Å; L80-G84 PolarHBondContact O-N 2.78Å; L80-Y85 HydrophobicContact CD2-CD2 4.23Å; L80-Y85 HydrophobicContact CD2-CG 4.28Å; L80-Y85 PolarHBondContact O-N 2.87Å; L80-E90 HydrophobicContact CD1-CB 4.22Å; L80-E90 HydrophobicContact CD1-CG 3.75Å; L80-M93 HydrophobicContact CD1-SD 4.4Å; L80-M93 HydrophobicContact CD2-CE 4.28Å; L80-M93 HydrophobicContact CD2-SD 4.28Å; L80-L147 HydrophobicContact CD2-CD1 3.61Å
81	R	90	Very high	88.4	Confident	150 Å²	150	76 Å²	76	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-62.7	-38.4	175.1	-71.9	179.1	-174.4	-139.1	1.9	113.3	S77 C78 R79 M83 G84	S77-R81 WeakPolarHBondContact O-CG 3.45Å; S77-R81 PolarHBondContact O-N 3.49Å; C78-R81 PolarHBondContact O-N 3.01Å; R79-R81 PolarHBondContact O-N 3.1Å; R81-M83 PolarHBondContact O-N 2.91Å; R81-G84 WeakPolarHBondContact O-CA 3.37Å; R81-G84 PolarHBondContact O-N 2.76Å
82	K	88.3	Confident	88.2	Confident	132 Å²	132	78.2 Å²	78.2	57%	0.574	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-32.4	174.2	-153.3	81.8	179.4	-166.5	0	112.1	Y60 D61 C78 R79 L80 G84	Y60-K82 WeakPolarHBondContact O-CE 3.22Å; Y60-K82 PolarHBondContact O-NZ 2.98Å; D61-K82 IonicContact OD2-NZ 3.26Å; C78-K82 WeakPolarHBondContact O-CB 3.32Å; C78-K82 PolarHBondContact O-N 2.97Å; R79-K82 PolarHBondContact O-N 3.46Å; L80-K82 PolarHBondContact O-N 2.87Å; K82-G84 PolarHBondContact O-N 2.95Å
83	M	85.1	Confident	88	Confident	78 Å²	78	77.6 Å²	77.6	38%	0.384	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	3	174.4	-59.6	-73.1	-74.3	0	0	112.9	R79 L80 R81 Y85 E144	R79-M83 WeakPolarHBondContact O-CG 3.39Å; R79-M83 PolarHBondContact O-N 3.01Å; R79-M83 VanDerWaalsContact O-N 3.09Å; L80-M83 CarbonylContact O-C 3.6Å; L80-M83 WeakPolarHBondContact O-CA 3.27Å; L80-M83 WeakPolarHBondContact O-CB 3.47Å; L80-M83 PolarHBondContact O-N 2.83Å; L80-M83 VanDerWaalsContact O-N 3.11Å; R81-M83 PolarHBondContact O-N 2.91Å; M83-Y85 HydrophobicContact CB-CD2 3.86Å; M83-Y85 HydrophobicContact CB-CE2 4.03Å; M83-E144 HydrophobicContact CE-CB 3.89Å; M83-E144 HydrophobicContact CE-CG 3.58Å
84	G	88.2	Confident	87.5	Confident	47 Å²	47	78.2 Å²	78.2	49%	0.485	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	19.3	176.6	0	0	0	0	0	115.4	L80 R81 K82 R151	L80-G84 PolarHBondContact O-N 2.78Å; R81-G84 WeakPolarHBondContact O-CA 3.37Å; R81-G84 PolarHBondContact O-N 2.76Å; K82-G84 PolarHBondContact O-N 2.95Å; G84-R151 PolarHBondContact O-NH2 3.04Å
85	Y	88.9	Confident	87.1	Confident	15 Å²	15	81.1 Å²	81.1	6%	0.059	40%	0.396	C	S	.	.			trans	-77.1	140.3	170.8	-72.2	-103.8	0	0	0	110.7	L80 M83 E89 L147 N148 R151	L80-Y85 HydrophobicContact CD2-CD2 4.23Å; L80-Y85 HydrophobicContact CD2-CG 4.28Å; L80-Y85 PolarHBondContact O-N 2.87Å; M83-Y85 HydrophobicContact CB-CD2 3.86Å; M83-Y85 HydrophobicContact CB-CE2 4.03Å; Y85-E89 WeakPolarHBondContact CA-OE2 3.35Å; Y85-E89 HydrophobicContact CD1-CB 4.17Å; Y85-L147 HydrophobicContact CE1-CB 4.28Å; Y85-L147 PolarHBondContact OH-N 3.06Å; Y85-N148 HydrophobicContact CE1-CB 4.32Å; Y85-R151 HydrophobicContact CE1-CG 3.79Å
86	T	89.4	Confident	86.6	Confident	67 Å²	67	81.3 Å²	81.3	41%	0.411	40%	0.402	S	S	.	.			trans	-81.6	164.1	172.2	74.4	0	0	0	0	111.1	E88 E89 E90	T86-E88 VanDerWaalsContact C-N 3.25Å; T86-E88 PolarHBondContact O-N 3.37Å; T86-E88 PolarHBondContact OG1-N 2.9Å; T86-E89 PolarHBondContact N-OE2 2.94Å; T86-E89 PolarHBondContact O-N 3.15Å; T86-E89 PolarHBondContact OG1-N 2.98Å; T86-E89 VanDerWaalsContact OG1-N 3.15Å; T86-E90 PolarHBondContact O-N 3.08Å; T86-E90 VanDerWaalsContact O-N 3.1Å
87	K	87.6	Confident	86.2	Confident	122 Å²	122	84.8 Å²	84.8	53%	0.53	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-35.8	173.9	-164.7	-167.7	171.3	-165.5	0	111.7	E89 E90 D91	K87-E89 VanDerWaalsContact C-N 3.35Å; K87-E89 PolarHBondContact O-N 2.96Å; K87-E90 WeakPolarHBondContact O-CB 3.09Å; K87-E90 PolarHBondContact O-N 3.37Å; K87-D91 PolarHBondContact O-N 3.28Å
88	E	87.3	Confident	85.9	Confident	153 Å²	153	90.4 Å²	90.4	72%	0.715	43%	0.429	S	S	*	.	H	α-helix	trans	-64.4	-38.5	176.4	-61.6	166.6	-169.3	0	0	111.8	T86 E90 E92	T86-E88 VanDerWaalsContact C-N 3.25Å; T86-E88 PolarHBondContact O-N 3.37Å; T86-E88 PolarHBondContact OG1-N 2.9Å; E88-E90 VanDerWaalsContact C-N 3.32Å; E88-E92 WeakPolarHBondContact O-CG 3.41Å; E88-E92 PolarHBondContact O-N 3.47Å
89	E	85.9	Confident	85.4	Confident	29 Å²	29	95.7 Å²	95.7	14%	0.136	45%	0.452	C	S	.	.	H	α-helix	trans	-69.4	-29.8	174	-71.1	177.8	119.1	0	0	112.8	Y85 T86 K87 M93 N148 R151	Y85-E89 WeakPolarHBondContact CA-OE2 3.35Å; Y85-E89 HydrophobicContact CD1-CB 4.17Å; T86-E89 PolarHBondContact N-OE2 2.94Å; T86-E89 PolarHBondContact O-N 3.15Å; T86-E89 PolarHBondContact OG1-N 2.98Å; T86-E89 VanDerWaalsContact OG1-N 3.15Å; K87-E89 VanDerWaalsContact C-N 3.35Å; K87-E89 PolarHBondContact O-N 2.96Å; E89-M93 WeakPolarHBondContact O-CG 3.39Å; E89-N148 PolarHBondContact O-ND2 3.25Å; E89-N148 VanDerWaalsContact O-ND2 3.16Å; E89-R151 IonicContact OE1-CZ 3.64Å; E89-R151 IonicContact OE1-NE 3.74Å; E89-R151 PolarHBondContact OE1-NE 3.04Å; E89-R151 IonicContact OE1-NH2 2.73Å; E89-R151 PolarHBondContact OE1-NH2 3.18Å; E89-R151 IonicContact OE2-CZ 3.55Å; E89-R151 IonicContact OE2-NE 2.68Å; E89-R151 IonicContact OE2-NH2 3.8Å; E89-R151 PolarHBondContact OE2-NH2 3.03Å
90	E	86.2	Confident	85.1	Confident	37 Å²	37	95 Å²	95	17%	0.173	45%	0.45	C	S	.	.	H	α-helix	trans	-73	-44.6	175.7	176.6	176	-163.1	0	0	111.6	S77 L80 T86 K87 E88 E92 M93	S77-E90 VanDerWaalsContact CA-OE1 3.24Å; S77-E90 WeakPolarHBondContact CA-OE1 3.3Å; S77-E90 WeakPolarHBondContact CB-OE1 3.4Å; S77-E90 PolarHBondContact OG-OE1 2.73Å; L80-E90 HydrophobicContact CD1-CB 4.22Å; L80-E90 HydrophobicContact CD1-CG 3.75Å; T86-E90 PolarHBondContact O-N 3.08Å; T86-E90 VanDerWaalsContact O-N 3.1Å; K87-E90 WeakPolarHBondContact O-CB 3.09Å; K87-E90 PolarHBondContact O-N 3.37Å; E88-E90 VanDerWaalsContact C-N 3.32Å; E90-E92 PolarHBondContact O-N 3.12Å; E90-M93 WeakPolarHBondContact O-CB 3.48Å; E90-M93 PolarHBondContact O-N 2.91Å
91	D	85.3	Confident	84.6	Confident	113 Å²	113	101.4 Å²	101.4	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-65.5	-22.1	177.9	-67.9	-29.6	0	0	0	112.3	K87	K87-D91 PolarHBondContact O-N 3.28Å
92	E	85	Confident	84.1	Confident	84 Å²	84	101.5 Å²	101.5	39%	0.393	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-8.4	172	-75.3	-177.4	168.5	0	0	114.6	E88 E90 Y94 K150	E88-E92 WeakPolarHBondContact O-CG 3.41Å; E88-E92 PolarHBondContact O-N 3.47Å; E90-E92 PolarHBondContact O-N 3.12Å; E92-Y94 VanDerWaalsContact O-CD2 3.31Å; E92-Y94 WeakPolarHBondContact O-CD2 3.44Å; E92-Y94 WeakPolarHBondContact O-CE2 3.39Å; E92-K150 IonicContact OE1-NZ 2.77Å; E92-K150 PolarHBondContact OE1-NZ 3Å; E92-K150 WeakPolarHBondContact OE2-CE 3.49Å; E92-K150 IonicContact OE2-NZ 2.63Å; E92-K150 PolarHBondContact OE2-NZ 3.42Å
93	M	83.5	Confident	83.7	Confident	64 Å²	64	99.2 Å²	99.2	32%	0.315	49%	0.488	S	S	.	.			trans	-82.5	123.4	-177.7	-77.1	173.8	57	0	0	111.8	L80 E89 E90 L147 N148	L80-M93 HydrophobicContact CD1-SD 4.4Å; L80-M93 HydrophobicContact CD2-CE 4.28Å; L80-M93 HydrophobicContact CD2-SD 4.28Å; E89-M93 WeakPolarHBondContact O-CG 3.39Å; E90-M93 WeakPolarHBondContact O-CB 3.48Å; E90-M93 PolarHBondContact O-N 2.91Å; M93-L147 HydrophobicContact CE-CB 3.66Å; M93-L147 HydrophobicContact CE-CD1 4.45Å; M93-L147 HydrophobicContact SD-CB 4.2Å; M93-N148 HydrophobicContact CG-CB 4.19Å
94	Y	79.5	Confident	83.3	Confident	184 Å²	184	105.8 Å²	105.8	72%	0.722	51%	0.514	S	S	*	.			trans	-96.2	136.7	174.5	-63.9	-85.5	0	0	0	110.8	E92 P96 F99	E92-Y94 VanDerWaalsContact O-CD2 3.31Å; E92-Y94 WeakPolarHBondContact O-CD2 3.44Å; E92-Y94 WeakPolarHBondContact O-CE2 3.39Å; Y94-P96 WeakPolarHBondContact O-CD 3.34Å; Y94-F99 HydrophobicContact CD1-CE2 4.38Å; Y94-F99 HydrophobicContact CD1-CZ 4.42Å
95	N	80.9	Confident	83	Confident	100 Å²	100	107.6 Å²	107.6	54%	0.535	51%	0.512	S	S	.	.			trans	-77.1	112.1	172.8	-177.2	-17.6	0	0	0	109.3	E97 F98 F99	N95-E97 VanDerWaalsContact C-N 3.32Å; N95-E97 PolarHBondContact O-N 3.17Å; N95-E97 WeakPolarHBondContact OD1-CB 3.35Å; N95-E97 PolarHBondContact OD1-N 3.12Å; N95-E97 VanDerWaalsContact OD1-N 3.12Å; N95-E97 PolarHBondContact OD1-OE2 3.06Å; N95-F98 PolarHBondContact O-N 3Å; N95-F99 WeakPolarHBondContact O-CD2 3.35Å
96	P	80.6	Confident	82.7	Confident	65 Å²	65	108.2 Å²	108.2	42%	0.422	52%	0.518	S	S	.	.	H	α-helix	trans	-70.8	-27.1	-175.5	28.8	-32.3	0	0	0	112.7	Y94 F98 F99 Y100	Y94-P96 WeakPolarHBondContact O-CD 3.34Å; P96-F98 PolarHBondContact O-N 3.46Å; P96-F99 PolarHBondContact O-N 2.88Å; P96-F99 VanDerWaalsContact O-N 3.11Å; P96-Y100 HydrophobicContact CB-CD2 4.31Å; P96-Y100 HydrophobicContact CB-CE2 4.43Å; P96-Y100 WeakPolarHBondContact O-CD2 3.31Å; P96-Y100 PolarHBondContact O-N 3.02Å
97	E	81.2	Confident	82.5	Confident	129 Å²	129	109.3 Å²	109.3	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-56	-38.6	177.3	-76.1	58.5	-139.8	0	0	111.6	N95 F99 Y100 E101	N95-E97 VanDerWaalsContact C-N 3.32Å; N95-E97 PolarHBondContact O-N 3.17Å; N95-E97 WeakPolarHBondContact OD1-CB 3.35Å; N95-E97 PolarHBondContact OD1-N 3.12Å; N95-E97 VanDerWaalsContact OD1-N 3.12Å; N95-E97 PolarHBondContact OD1-OE2 3.06Å; E97-F99 VanDerWaalsContact C-N 3.32Å; E97-F99 PolarHBondContact O-N 3Å; E97-Y100 PolarHBondContact O-N 2.64Å; E97-E101 WeakPolarHBondContact O-CB 3.41Å; E97-E101 PolarHBondContact O-N 3.37Å
98	F	82.3	Confident	82.5	Confident	154 Å²	154	105.8 Å²	105.8	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-60	-36.9	178	178.3	-98.6	0	0	0	113.6	N95 P96	N95-F98 PolarHBondContact O-N 3Å; P96-F98 PolarHBondContact O-N 3.46Å
99	F	79	Confident	82.5	Confident	118 Å²	118	104.4 Å²	104.4	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-82.7	-22.1	-177.7	-66.5	-82.2	0	0	0	113.2	Y94 N95 P96 E97	Y94-F99 HydrophobicContact CD1-CE2 4.38Å; Y94-F99 HydrophobicContact CD1-CZ 4.42Å; N95-F99 WeakPolarHBondContact O-CD2 3.35Å; P96-F99 PolarHBondContact O-N 2.88Å; P96-F99 VanDerWaalsContact O-N 3.11Å; E97-F99 VanDerWaalsContact C-N 3.32Å; E97-F99 PolarHBondContact O-N 3Å
100	Y	82.6	Confident	82.6	Confident	133 Å²	133	105.3 Å²	105.3	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-117.4	-1.7	-171.7	-59.1	-58.9	0	0	0	114.5	P96 E97 N102 V103 I105	P96-Y100 HydrophobicContact CB-CD2 4.31Å; P96-Y100 HydrophobicContact CB-CE2 4.43Å; P96-Y100 WeakPolarHBondContact O-CD2 3.31Å; P96-Y100 PolarHBondContact O-N 3.02Å; E97-Y100 PolarHBondContact O-N 2.64Å; Y100-N102 PolarHBondContact O-N 3.07Å; Y100-N102 VanDerWaalsContact O-N 3.14Å; Y100-V103 PolarHBondContact O-N 2.95Å; Y100-V103 VanDerWaalsContact O-O 3.06Å; Y100-I105 HydrophobicContact CD1-CD1 3.48Å; Y100-I105 VanDerWaalsContact CD1-CD1 3.48Å; Y100-I105 HydrophobicContact CD1-CG1 4.36Å; Y100-I105 HydrophobicContact CE1-CD1 3.62Å; Y100-I105 HydrophobicContact CG-CD1 4.45Å
101	E	79.8	Confident	82.8	Confident	156 Å²	156	109 Å²	109	73%	0.729	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-42.9	177.5	-176.4	172.4	-155.9	0	0	113.2	E97	E97-E101 WeakPolarHBondContact O-CB 3.41Å; E97-E101 PolarHBondContact O-N 3.37Å
102	N	78.5	Confident	82.9	Confident	152 Å²	152	106.9 Å²	106.9	81%	0.813	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-1.4	-176.4	-64.6	-61.8	0	0	0	114.3	Y100	Y100-N102 PolarHBondContact O-N 3.07Å; Y100-N102 VanDerWaalsContact O-N 3.14Å
103	V	79.9	Confident	83.1	Confident	83 Å²	83	108.1 Å²	108.1	50%	0.503	54%	0.538	S	S	.	.	S	Bend	trans	-121.5	127.2	-172.1	-164.5	0	0	0	0	110.5	Y100 I105	Y100-V103 PolarHBondContact O-N 2.95Å; Y100-V103 VanDerWaalsContact O-O 3.06Å; V103-I105 HydrophobicContact CB-CD1 4.35Å; V103-I105 HydrophobicContact CB-CG1 3.94Å; V103-I105 HydrophobicContact CG1-CD1 3.97Å; V103-I105 HydrophobicContact CG1-CG1 3.49Å; V103-I105 VanDerWaalsContact CG1-CG1 3.49Å; V103-I105 PolarHBondContact O-N 3.38Å
104	K	78.4	Confident	83.4	Confident	216 Å²	216	106.8 Å²	106.8	94%	0.939	54%	0.535	S	S	*	.			trans	-74.7	56.5	178.6	-62.8	-178.3	-178.7	177.5	0	112.5
105	I	80.9	Confident	83.9	Confident	85 Å²	85	98.3 Å²	98.3	44%	0.436	50%	0.502	S	S	.	.			trans	-83.8	129.6	175.3	-51.1	-166.8	0	0	0	109.1	Y100 V103 S107	Y100-I105 HydrophobicContact CD1-CD1 3.48Å; Y100-I105 VanDerWaalsContact CD1-CD1 3.48Å; Y100-I105 HydrophobicContact CD1-CG1 4.36Å; Y100-I105 HydrophobicContact CE1-CD1 3.62Å; Y100-I105 HydrophobicContact CG-CD1 4.45Å; V103-I105 HydrophobicContact CB-CD1 4.35Å; V103-I105 HydrophobicContact CB-CG1 3.94Å; V103-I105 HydrophobicContact CG1-CD1 3.97Å; V103-I105 HydrophobicContact CG1-CG1 3.49Å; V103-I105 VanDerWaalsContact CG1-CG1 3.49Å; V103-I105 PolarHBondContact O-N 3.38Å; I105-S107 PolarHBondContact O-N 2.98Å
106	P	83.8	Confident	84.3	Confident	28 Å²	28	96.5 Å²	96.5	18%	0.182	49%	0.49	C	S	.	.			trans	-62.4	107.6	172.2	-19.3	30.4	0	0	0	111	T172 K175 R176	P106-T172 HydrophobicContact CB-CG2 4.01Å; P106-T172 WeakPolarHBondContact O-CG2 3.46Å; P106-K175 HydrophobicContact CB-CB 4.03Å; P106-K175 HydrophobicContact CB-CD 4.28Å; P106-R176 HydrophobicContact CG-CG 3.8Å
107	S	84.4	Confident	84.8	Confident	91 Å²	91	98.7 Å²	98.7	64%	0.636	49%	0.494	S	S	*	.			trans	-92.5	156.8	175	62	0	0	0	0	111.9	I105 K175	I105-S107 PolarHBondContact O-N 2.98Å; S107-K175 PolarHBondContact O-NZ 3.22Å
108	I	86.6	Confident	85.3	Confident	47 Å²	47	93.1 Å²	93.1	24%	0.241	47%	0.468	C	S	.	.			trans	-138.6	121.8	176.4	-60	179	0	0	0	108.2	L110 V168 E171 T172	I108-L110 HydrophobicContact CG2-CD2 4.01Å; I108-L110 HydrophobicContact CG2-CG 4.43Å; I108-V168 HydrophobicContact CD1-CB 4.39Å; I108-V168 HydrophobicContact CD1-CG1 4.23Å; I108-V168 HydrophobicContact CD1-CG2 4.33Å; I108-E171 HydrophobicContact CD1-CB 3.33Å; I108-E171 HydrophobicContact CD1-CG 4.34Å; I108-T172 HydrophobicContact CD1-CG2 3.79Å; I108-T172 HydrophobicContact CG1-CG2 4.19Å
109	T	88.1	Confident	85.6	Confident	124 Å²	124	86 Å²	86	76%	0.761	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-89.9	123.3	172.7	47.4	0	0	0	0	109.5
110	L	87.9	Confident	86.1	Confident	48 Å²	48	86.4 Å²	86.4	25%	0.251	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-103.2	121.7	177.8	-65.5	178.2	0	0	0	110.3	I108 I118 L164 F167	I108-L110 HydrophobicContact CG2-CD2 4.01Å; I108-L110 HydrophobicContact CG2-CG 4.43Å; L110-I118 HydrophobicContact CD2-CD1 3.95Å; L110-L164 HydrophobicContact CD1-CD2 4.26Å; L110-F167 HydrophobicContact CD2-CE1 4.14Å
111	N	90.4	Very high	86.5	Confident	114 Å²	114	85.5 Å²	85.5	61%	0.61	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-87.4	158.4	167.4	-65.5	-38.2	0	0	0	110.3	D113 S114 Q115	N111-D113 VanDerWaalsContact C-N 3.29Å; N111-D113 PolarHBondContact O-N 3.2Å; N111-S114 WeakPolarHBondContact CA-OG 3.3Å; N111-S114 PolarHBondContact N-OG 3.39Å; N111-S114 PolarHBondContact O-N 3.17Å; N111-S114 VanDerWaalsContact O-N 3.08Å; N111-S114 PolarHBondContact O-OG 3.14Å; N111-Q115 PolarHBondContact O-N 2.99Å
112	K	88.5	Confident	86.8	Confident	69 Å²	69	79 Å²	79	30%	0.3	41%	0.413	S	S	.	.	H	α-helix	trans	-48.5	-48.6	176.7	-172.1	-174.7	-172.3	172.3	0	112.6	Q115 F116 P142 E144 V145	K112-Q115 PolarHBondContact O-N 2.99Å; K112-F116 WeakPolarHBondContact O-CB 3.47Å; K112-F116 PolarHBondContact O-N 3.44Å; K112-P142 WeakPolarHBondContact CE-O 3.44Å; K112-E144 WeakPolarHBondContact CD-OE2 3.46Å; K112-E144 VanDerWaalsContact CE-OE1 3.3Å; K112-E144 WeakPolarHBondContact CE-OE1 3.43Å; K112-E144 IonicContact NZ-OE1 2.8Å; K112-E144 PolarHBondContact NZ-OE1 3.46Å; K112-E144 IonicContact NZ-OE2 3.23Å; K112-V145 HydrophobicContact CB-CG2 4.29Å
113	D	88.6	Confident	87.1	Confident	111 Å²	111	75.6 Å²	75.6	59%	0.594	39%	0.388	S	S	*	.	H	α-helix	trans	-67.5	-39.6	-179.4	-61.5	-49.9	0	0	0	112.6	N111 F116 Q117	N111-D113 VanDerWaalsContact C-N 3.29Å; N111-D113 PolarHBondContact O-N 3.2Å; D113-F116 PolarHBondContact O-N 3.16Å; D113-Q117 WeakPolarHBondContact O-CB 3.47Å; D113-Q117 WeakPolarHBondContact O-CG 3.39Å; D113-Q117 PolarHBondContact O-N 2.95Å
114	S	90.1	Very high	87.3	Confident	36 Å²	36	75.9 Å²	75.9	25%	0.252	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-41.8	176.1	46.4	0	0	0	0	111.9	N111 F116 Q117 I118	N111-S114 WeakPolarHBondContact CA-OG 3.3Å; N111-S114 PolarHBondContact N-OG 3.39Å; N111-S114 PolarHBondContact O-N 3.17Å; N111-S114 VanDerWaalsContact O-N 3.08Å; N111-S114 PolarHBondContact O-OG 3.14Å; S114-F116 PolarHBondContact O-N 2.63Å; S114-Q117 PolarHBondContact O-N 2.84Å; S114-I118 WeakPolarHBondContact O-CD1 3.32Å; S114-I118 WeakPolarHBondContact O-CG1 3.45Å; S114-I118 PolarHBondContact O-N 2.84Å
115	Q	90.3	Very high	87.5	Confident	5 Å²	5	69.2 Å²	69.2	2%	0.023	38%	0.376	C	S	.	.	H	α-helix	trans	-59.8	-47.3	174.8	179.7	179.7	-13.1	0	0	111.1	N111 K112 Q117 I118 I119 V145 L156 L164	N111-Q115 PolarHBondContact O-N 2.99Å; K112-Q115 PolarHBondContact O-N 2.99Å; Q115-Q117 VanDerWaalsContact C-N 3.34Å; Q115-Q117 PolarHBondContact O-N 2.78Å; Q115-I118 PolarHBondContact O-N 3.01Å; Q115-I119 HydrophobicContact CG-CD1 4.01Å; Q115-I119 WeakPolarHBondContact O-CG1 3.34Å; Q115-I119 PolarHBondContact O-N 2.96Å; Q115-V145 VanDerWaalsContact OE1-CA 3.32Å; Q115-L156 VanDerWaalsContact NE2-CD2 3.29Å; Q115-L164 HydrophobicContact CB-CD2 4.43Å; Q115-L164 HydrophobicContact CG-CD1 4.02Å; Q115-L164 HydrophobicContact CG-CD2 3.89Å
116	F	89.1	Confident	87	Confident	62 Å²	62	68 Å²	68	27%	0.272	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-36.9	176.9	-176.4	-112.8	0	0	0	112.6	K112 D113 S114 K120 P142	K112-F116 WeakPolarHBondContact O-CB 3.47Å; K112-F116 PolarHBondContact O-N 3.44Å; D113-F116 PolarHBondContact O-N 3.16Å; S114-F116 PolarHBondContact O-N 2.63Å; F116-K120 WeakPolarHBondContact O-CB 3.39Å; F116-K120 PolarHBondContact O-N 2.89Å; F116-P142 HydrophobicContact CB-CB 4.32Å; F116-P142 HydrophobicContact CD1-CB 4.45Å; F116-P142 HydrophobicContact CD2-CB 3.9Å; F116-P142 HydrophobicContact CE2-CB 4.31Å; F116-P142 HydrophobicContact CG-CB 3.97Å
117	Q	90.6	Very high	85.8	Confident	111 Å²	111	69 Å²	69	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-43.5	174.2	-76.1	175.9	28	0	0	112.3	D113 S114 Q115 K120 Q121	D113-Q117 WeakPolarHBondContact O-CB 3.47Å; D113-Q117 WeakPolarHBondContact O-CG 3.39Å; D113-Q117 PolarHBondContact O-N 2.95Å; S114-Q117 PolarHBondContact O-N 2.84Å; Q115-Q117 VanDerWaalsContact C-N 3.34Å; Q115-Q117 PolarHBondContact O-N 2.78Å; Q117-K120 PolarHBondContact O-N 2.73Å; Q117-Q121 WeakPolarHBondContact O-CB 3.36Å; Q117-Q121 VanDerWaalsContact O-CG 3.28Å; Q117-Q121 WeakPolarHBondContact O-CG 3.4Å; Q117-Q121 PolarHBondContact O-N 3.35Å
118	I	91.3	Very high	84.6	Confident	12 Å²	12	73.3 Å²	73.3	6%	0.062	39%	0.394	C	S	.	.	H	α-helix	trans	-60.9	-49.1	176.7	-64.9	155.4	0	0	0	110.4	L110 S114 Q115 K120 Q121 A122 L164 F167	L110-I118 HydrophobicContact CD2-CD1 3.95Å; S114-I118 WeakPolarHBondContact O-CD1 3.32Å; S114-I118 WeakPolarHBondContact O-CG1 3.45Å; S114-I118 PolarHBondContact O-N 2.84Å; Q115-I118 PolarHBondContact O-N 3.01Å; I118-K120 VanDerWaalsContact C-N 3.33Å; I118-K120 PolarHBondContact O-N 3.08Å; I118-Q121 PolarHBondContact O-N 2.65Å; I118-A122 PolarHBondContact O-N 3.28Å; I118-L164 HydrophobicContact CB-CD2 4.08Å; I118-L164 HydrophobicContact CD1-CD2 3.9Å; I118-L164 HydrophobicContact CG2-CD2 3.93Å; I118-F167 HydrophobicContact CD1-CB 4.42Å; I118-F167 HydrophobicContact CD1-CD1 3.37Å; I118-F167 HydrophobicContact CD1-CD2 4.15Å; I118-F167 HydrophobicContact CD1-CE1 3.51Å; I118-F167 HydrophobicContact CD1-CE2 4.26Å; I118-F167 HydrophobicContact CD1-CG 3.71Å; I118-F167 HydrophobicContact CD1-CZ 3.96Å; I118-F167 HydrophobicContact CG1-CB 4.48Å; I118-F167 HydrophobicContact CG1-CD1 4.04Å; I118-F167 HydrophobicContact CG1-CD2 3.88Å; I118-F167 HydrophobicContact CG1-CE1 4.23Å; I118-F167 HydrophobicContact CG1-CE2 4.07Å; I118-F167 HydrophobicContact CG1-CG 3.85Å; I118-F167 HydrophobicContact CG1-CZ 4.24Å; I118-F167 HydrophobicContact CG2-CB 3.83Å; I118-F167 HydrophobicContact CG2-CD2 4.49Å; I118-F167 HydrophobicContact CG2-CG 4.13Å
119	I	89.8	Confident	83.1	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.026	42%	0.424	C	S	.	.	H	α-helix	trans	-59.1	-44.5	176.9	-68.9	167.2	0	0	0	110.9	Q115 Q121 A122 R123 Y138 D160	Q115-I119 HydrophobicContact CG-CD1 4.01Å; Q115-I119 WeakPolarHBondContact O-CG1 3.34Å; Q115-I119 PolarHBondContact O-N 2.96Å; I119-Q121 PolarHBondContact O-N 3.28Å; I119-A122 PolarHBondContact O-N 3.33Å; I119-R123 WeakPolarHBondContact O-CB 3.21Å; I119-R123 PolarHBondContact O-N 2.94Å; I119-Y138 HydrophobicContact CG2-CD1 4.45Å; I119-D160 HydrophobicContact CD1-CB 3.92Å; I119-D160 HydrophobicContact CG1-CB 4.02Å; I119-D160 WeakPolarHBondContact CG2-OD1 3.43Å
120	K	88.9	Confident	81.4	Confident	127 Å²	127	75.7 Å²	75.7	55%	0.552	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-41.1	176.9	-174.9	179.3	178.6	-176.9	0	112.1	F116 Q117 I118 R123 T124	F116-K120 WeakPolarHBondContact O-CB 3.39Å; F116-K120 PolarHBondContact O-N 2.89Å; Q117-K120 PolarHBondContact O-N 2.73Å; I118-K120 VanDerWaalsContact C-N 3.33Å; I118-K120 PolarHBondContact O-N 3.08Å; K120-R123 PolarHBondContact O-N 3.11Å; K120-T124 WeakPolarHBondContact O-CG2 3.33Å; K120-T124 PolarHBondContact O-N 2.94Å; K120-T124 PolarHBondContact O-OG1 3.12Å
121	Q	90.1	Very high	79.7	Confident	114 Å²	114	79.1 Å²	79.1	53%	0.533	43%	0.426	S	S	.	.	H	α-helix	trans	-63.6	-49.4	176.7	-75.3	175.3	18.7	0	0	111.2	Q117 I118 I119 R123 T124 A125	Q117-Q121 WeakPolarHBondContact O-CB 3.36Å; Q117-Q121 VanDerWaalsContact O-CG 3.28Å; Q117-Q121 WeakPolarHBondContact O-CG 3.4Å; Q117-Q121 PolarHBondContact O-N 3.35Å; I118-Q121 PolarHBondContact O-N 2.65Å; I119-Q121 PolarHBondContact O-N 3.28Å; Q121-R123 VanDerWaalsContact C-N 3.32Å; Q121-R123 PolarHBondContact O-N 3.32Å; Q121-T124 WeakPolarHBondContact CA-OG1 3.5Å; Q121-T124 CarbonylContact O-C 3.53Å; Q121-T124 PolarHBondContact O-N 2.87Å; Q121-T124 PolarHBondContact O-OG1 2.86Å; Q121-A125 PolarHBondContact O-N 3.45Å
122	A	87.6	Confident	78.1	Confident	20 Å²	20	78.3 Å²	78.3	17%	0.165	43%	0.429	C	S	.	.	H	α-helix	trans	-56.8	-45.4	176	0	0	0	0	0	111.8	I118 I119 T124 A125 V126 Y138 A163	I118-A122 PolarHBondContact O-N 3.28Å; I119-A122 PolarHBondContact O-N 3.33Å; A122-T124 VanDerWaalsContact C-N 3.29Å; A122-T124 PolarHBondContact O-N 2.75Å; A122-A125 WeakPolarHBondContact O-CB 3.22Å; A122-A125 PolarHBondContact O-N 2.92Å; A122-A125 VanDerWaalsContact O-N 3.11Å; A122-V126 PolarHBondContact O-N 3.31Å; A122-Y138 HydrophobicContact CB-CD1 4.47Å; A122-Y138 HydrophobicContact CB-CE1 3.79Å; A122-A163 HydrophobicContact CB-CB 3.55Å
123	R	84.8	Confident	76.7	Confident	79 Å²	79	83.7 Å²	83.7	30%	0.298	45%	0.448	S	S	.	.	H	α-helix	trans	-59.3	-35.3	174.8	-168.5	-179.6	-171.7	-146.6	0.6	113.2	I119 K120 Q121 Q135 Y138	I119-R123 WeakPolarHBondContact O-CB 3.21Å; I119-R123 PolarHBondContact O-N 2.94Å; K120-R123 PolarHBondContact O-N 3.11Å; Q121-R123 VanDerWaalsContact C-N 3.32Å; Q121-R123 PolarHBondContact O-N 3.32Å; R123-Q135 HydrophobicContact CG-CG 4.13Å; R123-Q135 PolarHBondContact NE-O 3.25Å; R123-Q135 PolarHBondContact NH2-O 3.47Å; R123-Y138 HydrophobicContact CB-CD2 4.02Å; R123-Y138 HydrophobicContact CB-CG 4.07Å; R123-Y138 HydrophobicContact CG-CD2 4.08Å; R123-Y138 HydrophobicContact CG-CG 4.35Å
124	T	83.8	Confident	75.2	Confident	89 Å²	89	80.7 Å²	80.7	55%	0.546	43%	0.432	S	S	.	.	H	α-helix	trans	-78.2	-28.1	174.6	54.5	0	0	0	0	113.9	K120 Q121 A122 G127	K120-T124 WeakPolarHBondContact O-CG2 3.33Å; K120-T124 PolarHBondContact O-N 2.94Å; K120-T124 PolarHBondContact O-OG1 3.12Å; Q121-T124 WeakPolarHBondContact CA-OG1 3.5Å; Q121-T124 CarbonylContact O-C 3.53Å; Q121-T124 PolarHBondContact O-N 2.87Å; Q121-T124 PolarHBondContact O-OG1 2.86Å; A122-T124 VanDerWaalsContact C-N 3.29Å; A122-T124 PolarHBondContact O-N 2.75Å; T124-G127 PolarHBondContact O-N 3.18Å
125	A	81.4	Confident	73.8	Confident	76 Å²	76	83.8 Å²	83.8	63%	0.628	44%	0.443	S	S	*	.	H	α-helix	trans	-68.2	-41	177.8	0	0	0	0	0	111.8	Q121 A122 G127	Q121-A125 PolarHBondContact O-N 3.45Å; A122-A125 WeakPolarHBondContact O-CB 3.22Å; A122-A125 PolarHBondContact O-N 2.92Å; A122-A125 VanDerWaalsContact O-N 3.11Å; A125-G127 VanDerWaalsContact C-N 3.29Å; A125-G127 PolarHBondContact O-N 3.45Å
126	V	70.6	Confident	72.6	Confident	60 Å²	60	94 Å²	94	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-69.4	-27.1	175.7	179.8	0	0	0	0	112.2	A122 K128 N134 Y138	A122-V126 PolarHBondContact O-N 3.31Å; V126-K128 VanDerWaalsContact C-N 3.27Å; V126-K128 PolarHBondContact O-N 3.4Å; V126-K128 VanDerWaalsContact O-N 3.09Å; V126-N134 HydrophobicContact CG1-CB 3.8Å; V126-Y138 HydrophobicContact CG2-CE2 4.11Å
127	G	59.4	Low	72	Confident	48 Å²	48	95 Å²	95	50%	0.495	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	16.8	-170.1	0	0	0	0	0	117.5	T124 A125	T124-G127 PolarHBondContact O-N 3.18Å; A125-G127 VanDerWaalsContact C-N 3.29Å; A125-G127 PolarHBondContact O-N 3.45Å
128	K	58.9	Low	71.6	Confident	182 Å²	182	91.6 Å²	91.6	79%	0.791	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-29.5	178.1	-78.4	-173.2	175.9	179.4	0	115.3	V126	V126-K128 VanDerWaalsContact C-N 3.27Å; V126-K128 PolarHBondContact O-N 3.4Å; V126-K128 VanDerWaalsContact O-N 3.09Å
129	D	54.8	Low	71	Confident	162 Å²	162	92 Å²	92	87%	0.866	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	-10.8	-167.8	-68	-45.2	0	0	0	116.7
130	S	53.3	Low	70.1	Confident	59 Å²	59	95.4 Å²	95.4	41%	0.413	50%	0.499	S	S	.	.	S	Bend	trans	-156.3	128.9	176.9	168.3	0	0	0	0	115.6	N134	S130-N134 PolarHBondContact O-ND2 2.86Å; S130-N134 PolarHBondContact OG-ND2 3.32Å
131	D	52.1	Low	69.4	Low	121 Å²	121	95.4 Å²	95.4	65%	0.647	50%	0.504	S	S	*	.			trans	46.1	132.6	149.9	-56.7	-56.9	0	0	0	121.3	Y133 N134	D131-Y133 PolarHBondContact O-N 3.01Å; D131-N134 PolarHBondContact O-N 3.13Å; D131-N134 PolarHBondContact O-ND2 2.71Å
132	C	56.1	Low	68.7	Low	97 Å²	97	92.9 Å²	92.9	66%	0.655	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-14.4	180	62	0	0	0	0	115.4
133	Y	59	Low	68.3	Low	182 Å²	182	93.9 Å²	93.9	71%	0.714	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-39.8	174.2	-77.6	-88.2	0	0	0	112.5	D131 Q135 R136	D131-Y133 PolarHBondContact O-N 3.01Å; Y133-Q135 PolarHBondContact O-N 2.87Å; Y133-R136 PolarHBondContact O-N 2.74Å
134	N	58.3	Low	68.2	Low	48 Å²	48	94 Å²	94	26%	0.257	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-63.3	-28	-177.8	-64.7	-52.4	0	0	0	112.3	V126 S130 D131 R136 I137	V126-N134 HydrophobicContact CG1-CB 3.8Å; S130-N134 PolarHBondContact O-ND2 2.86Å; S130-N134 PolarHBondContact OG-ND2 3.32Å; D131-N134 PolarHBondContact O-N 3.13Å; D131-N134 PolarHBondContact O-ND2 2.71Å; N134-R136 PolarHBondContact O-N 2.97Å; N134-I137 HydrophobicContact CB-CD1 4.45Å; N134-I137 WeakPolarHBondContact O-CG1 3.36Å; N134-I137 PolarHBondContact O-N 3.08Å
135	Q	59.7	Low	68.3	Low	101 Å²	101	91.5 Å²	91.5	47%	0.472	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-76.6	-6.1	-177.3	-143.9	170.1	36.1	0	0	114.1	R123 Y133	R123-Q135 HydrophobicContact CG-CG 4.13Å; R123-Q135 PolarHBondContact NE-O 3.25Å; R123-Q135 PolarHBondContact NH2-O 3.47Å; Y133-Q135 PolarHBondContact O-N 2.87Å
136	R	65.1	Low	68.5	Low	218 Å²	218	88.8 Å²	88.8	82%	0.823	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-97.6	-7.2	171.4	-66	-171.4	-177.5	-172	1.8	114.1	Y133 N134 Y138	Y133-R136 PolarHBondContact O-N 2.74Å; N134-R136 PolarHBondContact O-N 2.97Å; R136-Y138 VanDerWaalsContact C-N 3.34Å
137	I	77	Confident	69.2	Low	84 Å²	84	90.1 Å²	90.1	43%	0.431	47%	0.471	S	S	.	.	S	Bend	trans	-75.3	-28.4	-176.5	-51.6	178.1	0	0	0	111.1	N134 T157 A159	N134-I137 HydrophobicContact CB-CD1 4.45Å; N134-I137 WeakPolarHBondContact O-CG1 3.36Å; N134-I137 PolarHBondContact O-N 3.08Å; I137-T157 WeakPolarHBondContact O-CB 3.38Å; I137-T157 WeakPolarHBondContact O-CG2 3.26Å; I137-T157 PolarHBondContact O-OG1 3.42Å; I137-A159 HydrophobicContact CB-CB 4.49Å; I137-A159 HydrophobicContact CG2-CB 3.59Å
138	Y	80.7	Confident	70.5	Confident	39 Å²	39	88.5 Å²	88.5	15%	0.153	45%	0.451	C	S	.	.	S	Bend	trans	-93.3	150.1	178.4	-64.3	-85.3	0	0	0	112.7	I119 A122 R123 V126 R136 S140 A159 D160 A163	I119-Y138 HydrophobicContact CG2-CD1 4.45Å; A122-Y138 HydrophobicContact CB-CD1 4.47Å; A122-Y138 HydrophobicContact CB-CE1 3.79Å; R123-Y138 HydrophobicContact CB-CD2 4.02Å; R123-Y138 HydrophobicContact CB-CG 4.07Å; R123-Y138 HydrophobicContact CG-CD2 4.08Å; R123-Y138 HydrophobicContact CG-CG 4.35Å; V126-Y138 HydrophobicContact CG2-CE2 4.11Å; R136-Y138 VanDerWaalsContact C-N 3.34Å; Y138-S140 PolarHBondContact O-N 3.04Å; Y138-A159 HydrophobicContact CD1-CB 3.93Å; Y138-A159 HydrophobicContact CE1-CB 3.62Å; Y138-A159 HydrophobicContact CE2-CB 4.39Å; Y138-A159 HydrophobicContact CG-CB 4.44Å; Y138-D160 WeakPolarHBondContact CA-OD1 3.34Å; Y138-D160 WeakPolarHBondContact CD1-OD1 3.22Å; Y138-A163 HydrophobicContact CE1-CB 4.31Å
139	S	80.6	Confident	71.9	Confident	20 Å²	20	86.5 Å²	86.5	14%	0.14	44%	0.444	C	S	.	.			trans	-60.9	130.1	174.4	-69.2	0	0	0	0	111.8	D160	S139-D160 VanDerWaalsContact CB-OD2 3.27Å; S139-D160 WeakPolarHBondContact CB-OD2 3.28Å; S139-D160 PolarHBondContact N-OD1 3.47Å; S139-D160 PolarHBondContact N-OD2 3.38Å; S139-D160 PolarHBondContact OG-OD2 3.44Å
140	S	69.3	Low	73.4	Confident	77 Å²	77	83.8 Å²	83.8	54%	0.538	43%	0.425	S	S	.	.			trans	-92.4	-22.1	-177.4	56.7	0	0	0	0	114.1	Y138	Y138-S140 PolarHBondContact O-N 3.04Å
141	L	75.6	Confident	75	Confident	127 Å²	127	83.5 Å²	83.5	67%	0.665	42%	0.415	S	S	*	.	S	Bend	trans	-106.1	153.1	179.1	-64.9	177.8	0	0	0	110.6	V143	L141-V143 PolarHBondContact O-N 2.9Å
142	P	75.6	Confident	76.7	Confident	62 Å²	62	81 Å²	81	40%	0.403	40%	0.398	S	S	.	.			trans	-71.6	95.5	173.7	30.2	-34.6	0	0	0	110.5	K112 F116	K112-P142 WeakPolarHBondContact CE-O 3.44Å; F116-P142 HydrophobicContact CB-CB 4.32Å; F116-P142 HydrophobicContact CD1-CB 4.45Å; F116-P142 HydrophobicContact CD2-CB 3.9Å; F116-P142 HydrophobicContact CE2-CB 4.31Å; F116-P142 HydrophobicContact CG-CB 3.97Å
143	V	78.9	Confident	78.2	Confident	41 Å²	41	79.1 Å²	79.1	25%	0.248	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-67.5	145.6	170.9	-170	0	0	0	0	109.2	L141 D155 L156	L141-V143 PolarHBondContact O-N 2.9Å; V143-D155 HydrophobicContact CG1-CB 3.97Å; V143-L156 HydrophobicContact CB-CD2 4.09Å; V143-L156 HydrophobicContact CG1-CD2 4.06Å; V143-L156 HydrophobicContact CG2-CD2 4.34Å
144	E	82.1	Confident	79.6	Confident	81 Å²	81	75.4 Å²	75.4	38%	0.379	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-66.8	153.3	171	-72.4	-64.2	167.5	0	0	111.3	M83 K112 P146	M83-E144 HydrophobicContact CE-CB 3.89Å; M83-E144 HydrophobicContact CE-CG 3.58Å; K112-E144 WeakPolarHBondContact CD-OE2 3.46Å; K112-E144 VanDerWaalsContact CE-OE1 3.3Å; K112-E144 WeakPolarHBondContact CE-OE1 3.43Å; K112-E144 IonicContact NZ-OE1 2.8Å; K112-E144 PolarHBondContact NZ-OE1 3.46Å; K112-E144 IonicContact NZ-OE2 3.23Å; E144-P146 WeakPolarHBondContact O-CD 3.44Å
145	V	85.4	Confident	80.9	Confident	37 Å²	37	76.1 Å²	76.1	22%	0.224	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-66.9	116.9	178.6	-169.4	0	0	0	0	109.1	K112 Q115 L147	K112-V145 HydrophobicContact CB-CG2 4.29Å; Q115-V145 VanDerWaalsContact OE1-CA 3.32Å; V145-L147 PolarHBondContact O-N 3.05Å
146	P	86.1	Confident	82.3	Confident	19 Å²	19	71.5 Å²	71.5	12%	0.123	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-71	127.1	-178.8	-20.4	35.6	0	0	0	110.9	E144 R151 F152 D155 L156	E144-P146 WeakPolarHBondContact O-CD 3.44Å; P146-R151 HydrophobicContact CB-CB 3.86Å; P146-F152 HydrophobicContact CB-CB 3.96Å; P146-F152 HydrophobicContact CG-CB 4.49Å; P146-D155 HydrophobicContact CG-CB 4.44Å; P146-L156 HydrophobicContact CG-CD1 4.01Å; P146-L156 HydrophobicContact CG-CG 4.08Å
147	L	85.6	Confident	83.4	Confident	87 Å²	87	63.3 Å²	63.3	46%	0.455	34%	0.34	S	S	.	.			trans	-96.5	-13	-175.9	-57.3	177.1	0	0	0	113.3	L80 Y85 M93 V145	L80-L147 HydrophobicContact CD2-CD1 3.61Å; Y85-L147 HydrophobicContact CE1-CB 4.28Å; Y85-L147 PolarHBondContact OH-N 3.06Å; M93-L147 HydrophobicContact CE-CB 3.66Å; M93-L147 HydrophobicContact CE-CD1 4.45Å; M93-L147 HydrophobicContact SD-CB 4.2Å; V145-L147 PolarHBondContact O-N 3.05Å
148	N	87	Confident	84	Confident	15 Å²	15	66.3 Å²	66.3	8%	0.08	35%	0.352	C	S	.	.	S	Bend	trans	-121.6	145.1	174.8	-178.3	-43.1	0	0	0	109.2	Y85 E89 M93 K150 R151 F152	Y85-N148 HydrophobicContact CE1-CB 4.32Å; E89-N148 PolarHBondContact O-ND2 3.25Å; E89-N148 VanDerWaalsContact O-ND2 3.16Å; M93-N148 HydrophobicContact CG-CB 4.19Å; N148-K150 VanDerWaalsContact C-N 3.26Å; N148-K150 PolarHBondContact O-N 3.08Å; N148-K150 PolarHBondContact OD1-N 2.99Å; N148-R151 WeakPolarHBondContact O-CB 3.39Å; N148-R151 PolarHBondContact O-N 3.43Å; N148-R151 VanDerWaalsContact O-N 3.16Å; N148-F152 PolarHBondContact O-N 3.49Å
149	H	86.9	Confident	84.5	Confident	139 Å²	139	65.2 Å²	65.2	64%	0.644	35%	0.351	S	S	*	.	H	α-helix	trans	-54.4	-37.7	177.5	-177.7	74.4	0	0	0	113.4	R151 F152 V153	H149-R151 PolarHBondContact O-N 3.09Å; H149-F152 WeakPolarHBondContact O-CB 3.44Å; H149-F152 PolarHBondContact O-N 3.31Å; H149-V153 WeakPolarHBondContact O-CG2 3.45Å; H149-V153 PolarHBondContact O-N 2.95Å
150	K	87.6	Confident	84.9	Confident	105 Å²	105	64.2 Å²	64.2	46%	0.457	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-49.2	176.7	-69.1	175.6	179.6	167.4	0	111.3	E92 N148 V153 C154	E92-K150 IonicContact OE1-NZ 2.77Å; E92-K150 PolarHBondContact OE1-NZ 3Å; E92-K150 WeakPolarHBondContact OE2-CE 3.49Å; E92-K150 IonicContact OE2-NZ 2.63Å; E92-K150 PolarHBondContact OE2-NZ 3.42Å; N148-K150 VanDerWaalsContact C-N 3.26Å; N148-K150 PolarHBondContact O-N 3.08Å; N148-K150 PolarHBondContact OD1-N 2.99Å; K150-V153 PolarHBondContact O-N 3.25Å; K150-C154 PolarHBondContact O-N 2.93Å; K150-C154 PolarHBondContact O-SG 3.48Å; K150-C154 VanDerWaalsContact O-SG 3.39Å
151	R	87.1	Confident	86	Confident	53 Å²	53	63.6 Å²	63.6	20%	0.2	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-43.3	175.3	-67.4	-88.8	-178.9	145.2	3.3	111.3	G84 Y85 E89 P146 N148 H149 V153 C154 D155	G84-R151 PolarHBondContact O-NH2 3.04Å; Y85-R151 HydrophobicContact CE1-CG 3.79Å; E89-R151 IonicContact OE1-CZ 3.64Å; E89-R151 IonicContact OE1-NE 3.74Å; E89-R151 PolarHBondContact OE1-NE 3.04Å; E89-R151 IonicContact OE1-NH2 2.73Å; E89-R151 PolarHBondContact OE1-NH2 3.18Å; E89-R151 IonicContact OE2-CZ 3.55Å; E89-R151 IonicContact OE2-NE 2.68Å; E89-R151 IonicContact OE2-NH2 3.8Å; E89-R151 PolarHBondContact OE2-NH2 3.03Å; P146-R151 HydrophobicContact CB-CB 3.86Å; N148-R151 WeakPolarHBondContact O-CB 3.39Å; N148-R151 PolarHBondContact O-N 3.43Å; N148-R151 VanDerWaalsContact O-N 3.16Å; H149-R151 PolarHBondContact O-N 3.09Å; R151-V153 PolarHBondContact O-N 3.05Å; R151-C154 PolarHBondContact O-N 3.46Å; R151-C154 VanDerWaalsContact O-N 3.14Å; R151-D155 WeakPolarHBondContact CB-OD2 3.3Å; R151-D155 WeakPolarHBondContact CD-OD2 3.43Å; R151-D155 VanDerWaalsContact O-CB 3.26Å; R151-D155 WeakPolarHBondContact O-CB 3.32Å; R151-D155 VanDerWaalsContact O-CG 3.25Å; R151-D155 PolarHBondContact O-N 3.33Å
152	F	87.4	Confident	86.8	Confident	69 Å²	69	62 Å²	62	30%	0.303	32%	0.322	S	S	.	.	H	α-helix	trans	-57.7	-35	175.1	-178.4	-100	0	0	0	113.1	P146 N148 H149 L156 R161 L164	P146-F152 HydrophobicContact CB-CB 3.96Å; P146-F152 HydrophobicContact CG-CB 4.49Å; N148-F152 PolarHBondContact O-N 3.49Å; H149-F152 WeakPolarHBondContact O-CB 3.44Å; H149-F152 PolarHBondContact O-N 3.31Å; F152-L156 HydrophobicContact CD2-CD1 3.68Å; F152-L156 HydrophobicContact CE2-CD1 3.75Å; F152-R161 HydrophobicContact CD1-CG 4.26Å; F152-R161 HydrophobicContact CE1-CB 4.21Å; F152-R161 HydrophobicContact CE1-CG 3.65Å; F152-R161 HydrophobicContact CE2-CG 4.13Å; F152-R161 HydrophobicContact CZ-CB 4.03Å; F152-R161 HydrophobicContact CZ-CG 3.58Å; F152-R161 WeakPolarHBondContact O-CD 3.36Å; F152-R161 PolarHBondContact O-NE 3.31Å; F152-L164 HydrophobicContact CE2-CD1 4.44Å
153	V	88	Confident	87.6	Confident	58 Å²	58	59.6 Å²	59.6	35%	0.352	31%	0.307	S	S	.	.	H	α-helix	trans	-82.6	-24.8	178.6	171.3	0	0	0	0	113.4	H149 K150 R151 R161	H149-V153 WeakPolarHBondContact O-CG2 3.45Å; H149-V153 PolarHBondContact O-N 2.95Å; K150-V153 PolarHBondContact O-N 3.25Å; R151-V153 PolarHBondContact O-N 3.05Å; V153-R161 VanDerWaalsContact O-CZ 3.3Å; V153-R161 PolarHBondContact O-NH2 2.9Å
154	C	86.6	Confident	88.2	Confident	103 Å²	103	58.1 Å²	58.1	70%	0.696	30%	0.297	S	S	*	.	H	α-helix	trans	-94.4	-44.6	179.9	-68.4	0	0	0	0	113.5	K150 R151	K150-C154 PolarHBondContact O-N 2.93Å; K150-C154 PolarHBondContact O-SG 3.48Å; K150-C154 VanDerWaalsContact O-SG 3.39Å; R151-C154 PolarHBondContact O-N 3.46Å; R151-C154 VanDerWaalsContact O-N 3.14Å
155	D	86.4	Confident	88.7	Confident	64 Å²	64	61.3 Å²	61.3	34%	0.342	31%	0.307	S	S	.	.	H	α-helix	trans	-81.7	-22	-168.8	-56.9	-18	0	0	0	112.6	V143 P146 R151	V143-D155 HydrophobicContact CG1-CB 3.97Å; P146-D155 HydrophobicContact CG-CB 4.44Å; R151-D155 WeakPolarHBondContact CB-OD2 3.3Å; R151-D155 WeakPolarHBondContact CD-OD2 3.43Å; R151-D155 VanDerWaalsContact O-CB 3.26Å; R151-D155 WeakPolarHBondContact O-CB 3.32Å; R151-D155 VanDerWaalsContact O-CG 3.25Å; R151-D155 PolarHBondContact O-N 3.33Å
156	L	88.7	Confident	89.1	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.016	32%	0.319	C	S	.	.	S	Bend	trans	-113.2	140.5	-179.1	-58.1	179.2	0	0	0	111.6	Q115 V143 P146 F152 D160 R161 L164	Q115-L156 VanDerWaalsContact NE2-CD2 3.29Å; V143-L156 HydrophobicContact CB-CD2 4.09Å; V143-L156 HydrophobicContact CG1-CD2 4.06Å; V143-L156 HydrophobicContact CG2-CD2 4.34Å; P146-L156 HydrophobicContact CG-CD1 4.01Å; P146-L156 HydrophobicContact CG-CG 4.08Å; F152-L156 HydrophobicContact CD2-CD1 3.68Å; F152-L156 HydrophobicContact CE2-CD1 3.75Å; L156-D160 HydrophobicContact CB-CB 4.24Å; L156-R161 HydrophobicContact CB-CG 3.88Å; L156-R161 HydrophobicContact CD1-CG 4.35Å; L156-R161 VanDerWaalsContact O-CZ 3.26Å; L156-R161 PolarHBondContact O-NE 2.85Å; L156-R161 PolarHBondContact O-NH2 2.85Å; L156-L164 HydrophobicContact CD1-CD1 3.87Å
157	T	89.6	Confident	89.4	Confident	46 Å²	46	66 Å²	66	28%	0.282	33%	0.326	S	S	.	.			trans	-68.4	164.9	173.9	72.5	0	0	0	0	111.2	I137 A159 D160 R161	I137-T157 WeakPolarHBondContact O-CB 3.38Å; I137-T157 WeakPolarHBondContact O-CG2 3.26Å; I137-T157 PolarHBondContact O-OG1 3.42Å; T157-A159 VanDerWaalsContact C-N 3.26Å; T157-A159 PolarHBondContact O-N 2.92Å; T157-A159 PolarHBondContact OG1-N 3.41Å; T157-D160 WeakPolarHBondContact CB-OD2 3.45Å; T157-D160 WeakPolarHBondContact CG2-OD2 3.46Å; T157-D160 PolarHBondContact N-OD2 3.49Å; T157-D160 PolarHBondContact O-N 3.2Å; T157-D160 PolarHBondContact OG1-N 2.94Å; T157-D160 VanDerWaalsContact OG1-N 3.1Å; T157-D160 PolarHBondContact OG1-OD2 3.19Å; T157-R161 WeakPolarHBondContact O-CG 3.33Å; T157-R161 PolarHBondContact O-N 3.11Å; T157-R161 VanDerWaalsContact O-N 3.09Å; T157-R161 PolarHBondContact O-NE 3.32Å
158	Q	89.4	Confident	89.7	Confident	148 Å²	148	64 Å²	64	69%	0.692	32%	0.318	S	S	*	.	H	α-helix	trans	-60.2	-37	174.7	-173.3	177.4	8.6	0	0	112	R161 L162	Q158-R161 PolarHBondContact O-N 3.24Å; Q158-L162 HydrophobicContact CG-CD1 4.41Å; Q158-L162 WeakPolarHBondContact O-CG 3.29Å; Q158-L162 PolarHBondContact O-N 3.3Å
159	A	89.9	Confident	89.9	Confident	15 Å²	15	65 Å²	65	12%	0.124	33%	0.325	C	S	.	.	H	α-helix	trans	-72.8	-36.2	179.4	0	0	0	0	0	112.6	I137 Y138 T157 R161 L162 A163	I137-A159 HydrophobicContact CB-CB 4.49Å; I137-A159 HydrophobicContact CG2-CB 3.59Å; Y138-A159 HydrophobicContact CD1-CB 3.93Å; Y138-A159 HydrophobicContact CE1-CB 3.62Å; Y138-A159 HydrophobicContact CE2-CB 4.39Å; Y138-A159 HydrophobicContact CG-CB 4.44Å; T157-A159 VanDerWaalsContact C-N 3.26Å; T157-A159 PolarHBondContact O-N 2.92Å; T157-A159 PolarHBondContact OG1-N 3.41Å; A159-R161 VanDerWaalsContact C-N 3.34Å; A159-L162 PolarHBondContact O-N 3.03Å; A159-A163 WeakPolarHBondContact O-CB 3.42Å; A159-A163 PolarHBondContact O-N 3.08Å
160	D	89.9	Confident	90.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-44.6	172.3	-57.5	-40.4	0	0	0	110.7	I119 Y138 S139 L156 T157 L162 A163 L164	I119-D160 HydrophobicContact CD1-CB 3.92Å; I119-D160 HydrophobicContact CG1-CB 4.02Å; I119-D160 WeakPolarHBondContact CG2-OD1 3.43Å; Y138-D160 WeakPolarHBondContact CA-OD1 3.34Å; Y138-D160 WeakPolarHBondContact CD1-OD1 3.22Å; S139-D160 VanDerWaalsContact CB-OD2 3.27Å; S139-D160 WeakPolarHBondContact CB-OD2 3.28Å; S139-D160 PolarHBondContact N-OD1 3.47Å; S139-D160 PolarHBondContact N-OD2 3.38Å; S139-D160 PolarHBondContact OG-OD2 3.44Å; L156-D160 HydrophobicContact CB-CB 4.24Å; T157-D160 WeakPolarHBondContact CB-OD2 3.45Å; T157-D160 WeakPolarHBondContact CG2-OD2 3.46Å; T157-D160 PolarHBondContact N-OD2 3.49Å; T157-D160 PolarHBondContact O-N 3.2Å; T157-D160 PolarHBondContact OG1-N 2.94Å; T157-D160 VanDerWaalsContact OG1-N 3.1Å; T157-D160 PolarHBondContact OG1-OD2 3.19Å; D160-L162 PolarHBondContact O-N 3.38Å; D160-A163 PolarHBondContact O-N 2.96Å; D160-L164 VanDerWaalsContact O-CG 3.29Å; D160-L164 WeakPolarHBondContact O-CG 3.36Å; D160-L164 PolarHBondContact O-N 3.01Å
161	R	92.1	Very high	90.2	Very high	64 Å²	64	60.3 Å²	60.3	24%	0.242	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-39.8	178.6	-71.5	179.7	-103.6	166.2	-11.2	112.6	F152 V153 L156 T157 Q158 A159 Y165	F152-R161 HydrophobicContact CD1-CG 4.26Å; F152-R161 HydrophobicContact CE1-CB 4.21Å; F152-R161 HydrophobicContact CE1-CG 3.65Å; F152-R161 HydrophobicContact CE2-CG 4.13Å; F152-R161 HydrophobicContact CZ-CB 4.03Å; F152-R161 HydrophobicContact CZ-CG 3.58Å; F152-R161 WeakPolarHBondContact O-CD 3.36Å; F152-R161 PolarHBondContact O-NE 3.31Å; V153-R161 VanDerWaalsContact O-CZ 3.3Å; V153-R161 PolarHBondContact O-NH2 2.9Å; L156-R161 HydrophobicContact CB-CG 3.88Å; L156-R161 HydrophobicContact CD1-CG 4.35Å; L156-R161 VanDerWaalsContact O-CZ 3.26Å; L156-R161 PolarHBondContact O-NE 2.85Å; L156-R161 PolarHBondContact O-NH2 2.85Å; T157-R161 WeakPolarHBondContact O-CG 3.33Å; T157-R161 PolarHBondContact O-N 3.11Å; T157-R161 VanDerWaalsContact O-N 3.09Å; T157-R161 PolarHBondContact O-NE 3.32Å; Q158-R161 PolarHBondContact O-N 3.24Å; A159-R161 VanDerWaalsContact C-N 3.34Å; R161-Y165 WeakPolarHBondContact O-CB 3.5Å; R161-Y165 PolarHBondContact O-N 3.5Å
162	L	91.5	Very high	90.3	Very high	94 Å²	94	58.8 Å²	58.8	49%	0.492	30%	0.301	S	S	.	.	H	α-helix	trans	-65.2	-46.1	173.8	-72.2	170.5	0	0	0	111.5	Q158 A159 D160 L164 Y165 D166	Q158-L162 HydrophobicContact CG-CD1 4.41Å; Q158-L162 WeakPolarHBondContact O-CG 3.29Å; Q158-L162 PolarHBondContact O-N 3.3Å; A159-L162 PolarHBondContact O-N 3.03Å; D160-L162 PolarHBondContact O-N 3.38Å; L162-L164 VanDerWaalsContact C-N 3.29Å; L162-L164 PolarHBondContact O-N 3.09Å; L162-Y165 WeakPolarHBondContact O-CB 3.34Å; L162-Y165 PolarHBondContact O-N 2.98Å; L162-Y165 VanDerWaalsContact O-N 3.13Å; L162-D166 PolarHBondContact O-N 3.24Å
163	A	92.3	Very high	90.3	Very high	11 Å²	11	60.6 Å²	60.6	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-38.3	177.6	0	0	0	0	0	113	A122 Y138 A159 D160 F167	A122-A163 HydrophobicContact CB-CB 3.55Å; Y138-A163 HydrophobicContact CE1-CB 4.31Å; A159-A163 WeakPolarHBondContact O-CB 3.42Å; A159-A163 PolarHBondContact O-N 3.08Å; D160-A163 PolarHBondContact O-N 2.96Å; A163-F167 VanDerWaalsContact O-CB 3.32Å; A163-F167 WeakPolarHBondContact O-CB 3.21Å; A163-F167 PolarHBondContact O-N 2.58Å; A163-F167 VanDerWaalsContact O-N 3.08Å
164	L	92.4	Very high	90.2	Very high	9 Å²	9	62.3 Å²	62.3	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-69.6	-40.4	174.8	-66.7	169.1	0	0	0	112.1	L110 Q115 I118 F152 L156 D160 L162 V168	L110-L164 HydrophobicContact CD1-CD2 4.26Å; Q115-L164 HydrophobicContact CB-CD2 4.43Å; Q115-L164 HydrophobicContact CG-CD1 4.02Å; Q115-L164 HydrophobicContact CG-CD2 3.89Å; I118-L164 HydrophobicContact CB-CD2 4.08Å; I118-L164 HydrophobicContact CD1-CD2 3.9Å; I118-L164 HydrophobicContact CG2-CD2 3.93Å; F152-L164 HydrophobicContact CE2-CD1 4.44Å; L156-L164 HydrophobicContact CD1-CD1 3.87Å; D160-L164 VanDerWaalsContact O-CG 3.29Å; D160-L164 WeakPolarHBondContact O-CG 3.36Å; D160-L164 PolarHBondContact O-N 3.01Å; L162-L164 VanDerWaalsContact C-N 3.29Å; L162-L164 PolarHBondContact O-N 3.09Å; L164-V168 WeakPolarHBondContact O-CB 3.37Å; L164-V168 VanDerWaalsContact O-CG2 3.3Å; L164-V168 WeakPolarHBondContact O-CG2 3.21Å; L164-V168 PolarHBondContact O-N 3.31Å
165	Y	92.3	Very high	90	Very high	149 Å²	149	61.4 Å²	61.4	58%	0.584	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-50.8	174.7	172.7	-95.1	0	0	0	111.6	R161 L162 F167 V168 V169	R161-Y165 WeakPolarHBondContact O-CB 3.5Å; R161-Y165 PolarHBondContact O-N 3.5Å; L162-Y165 WeakPolarHBondContact O-CB 3.34Å; L162-Y165 PolarHBondContact O-N 2.98Å; L162-Y165 VanDerWaalsContact O-N 3.13Å; Y165-F167 VanDerWaalsContact C-N 3.33Å; Y165-F167 PolarHBondContact O-N 3.27Å; Y165-V168 PolarHBondContact O-N 2.82Å; Y165-V169 HydrophobicContact CD1-CG2 4.23Å; Y165-V169 HydrophobicContact CD2-CG2 4.29Å; Y165-V169 HydrophobicContact CE1-CG2 3.79Å; Y165-V169 HydrophobicContact CE2-CG2 3.86Å; Y165-V169 HydrophobicContact CG-CG2 4.46Å; Y165-V169 WeakPolarHBondContact O-CG2 3.46Å; Y165-V169 PolarHBondContact O-N 3.16Å
166	D	93.6	Very high	89.4	Confident	91 Å²	91	64.8 Å²	64.8	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-43.3	179.9	-68.3	-24.4	0	0	0	111	L162 V169 E170	L162-D166 PolarHBondContact O-N 3.24Å; D166-V169 PolarHBondContact O-N 3.16Å; D166-E170 WeakPolarHBondContact O-CG 3.5Å; D166-E170 PolarHBondContact O-N 3.14Å
167	F	93.4	Very high	88.3	Confident	62 Å²	62	68.2 Å²	68.2	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-48.3	173.9	175.4	-94.4	0	0	0	112.4	L110 I118 A163 Y165 V169 E170 E171	L110-F167 HydrophobicContact CD2-CE1 4.14Å; I118-F167 HydrophobicContact CD1-CB 4.42Å; I118-F167 HydrophobicContact CD1-CD1 3.37Å; I118-F167 HydrophobicContact CD1-CD2 4.15Å; I118-F167 HydrophobicContact CD1-CE1 3.51Å; I118-F167 HydrophobicContact CD1-CE2 4.26Å; I118-F167 HydrophobicContact CD1-CG 3.71Å; I118-F167 HydrophobicContact CD1-CZ 3.96Å; I118-F167 HydrophobicContact CG1-CB 4.48Å; I118-F167 HydrophobicContact CG1-CD1 4.04Å; I118-F167 HydrophobicContact CG1-CD2 3.88Å; I118-F167 HydrophobicContact CG1-CE1 4.23Å; I118-F167 HydrophobicContact CG1-CE2 4.07Å; I118-F167 HydrophobicContact CG1-CG 3.85Å; I118-F167 HydrophobicContact CG1-CZ 4.24Å; I118-F167 HydrophobicContact CG2-CB 3.83Å; I118-F167 HydrophobicContact CG2-CD2 4.49Å; I118-F167 HydrophobicContact CG2-CG 4.13Å; A163-F167 VanDerWaalsContact O-CB 3.32Å; A163-F167 WeakPolarHBondContact O-CB 3.21Å; A163-F167 PolarHBondContact O-N 2.58Å; A163-F167 VanDerWaalsContact O-N 3.08Å; Y165-F167 VanDerWaalsContact C-N 3.33Å; Y165-F167 PolarHBondContact O-N 3.27Å; F167-V169 VanDerWaalsContact C-N 3.32Å; F167-V169 PolarHBondContact O-N 2.94Å; F167-E170 PolarHBondContact O-N 3.4Å; F167-E171 HydrophobicContact CD1-CG 4.28Å; F167-E171 HydrophobicContact CD2-CG 4.28Å; F167-E171 HydrophobicContact CE1-CG 3.81Å; F167-E171 HydrophobicContact CE2-CG 3.81Å; F167-E171 HydrophobicContact CZ-CG 3.55Å; F167-E171 WeakPolarHBondContact O-CB 3.33Å; F167-E171 WeakPolarHBondContact O-CG 3.31Å; F167-E171 PolarHBondContact O-N 3.48Å
168	V	92.1	Very high	86.9	Confident	47 Å²	47	72.4 Å²	72.4	29%	0.285	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-39.3	178.6	165.7	0	0	0	0	111.1	I108 L164 Y165 T172	I108-V168 HydrophobicContact CD1-CB 4.39Å; I108-V168 HydrophobicContact CD1-CG1 4.23Å; I108-V168 HydrophobicContact CD1-CG2 4.33Å; L164-V168 WeakPolarHBondContact O-CB 3.37Å; L164-V168 VanDerWaalsContact O-CG2 3.3Å; L164-V168 WeakPolarHBondContact O-CG2 3.21Å; L164-V168 PolarHBondContact O-N 3.31Å; Y165-V168 PolarHBondContact O-N 2.82Å; V168-T172 HydrophobicContact CG1-CG2 4.24Å; V168-T172 WeakPolarHBondContact O-CB 3.36Å; V168-T172 VanDerWaalsContact O-CG2 3.26Å; V168-T172 WeakPolarHBondContact O-CG2 3.42Å; V168-T172 PolarHBondContact O-N 3.26Å; V168-T172 PolarHBondContact O-OG1 3.16Å
169	V	90.9	Very high	85.4	Confident	35 Å²	35	69.5 Å²	69.5	21%	0.212	35%	0.345	C	S	.	.	H	α-helix	trans	-63.7	-45.3	175.8	168	0	0	0	0	111.3	Y165 D166 F167 T172 K173	Y165-V169 HydrophobicContact CD1-CG2 4.23Å; Y165-V169 HydrophobicContact CD2-CG2 4.29Å; Y165-V169 HydrophobicContact CE1-CG2 3.79Å; Y165-V169 HydrophobicContact CE2-CG2 3.86Å; Y165-V169 HydrophobicContact CG-CG2 4.46Å; Y165-V169 WeakPolarHBondContact O-CG2 3.46Å; Y165-V169 PolarHBondContact O-N 3.16Å; D166-V169 PolarHBondContact O-N 3.16Å; F167-V169 VanDerWaalsContact C-N 3.32Å; F167-V169 PolarHBondContact O-N 2.94Å; V169-T172 PolarHBondContact O-OG1 3.24Å; V169-K173 HydrophobicContact CG1-CD 4.19Å; V169-K173 VanDerWaalsContact CG1-CE 3.48Å; V169-K173 WeakPolarHBondContact O-CB 3.47Å; V169-K173 WeakPolarHBondContact O-CG 3.39Å; V169-K173 PolarHBondContact O-N 3.39Å
170	E	90.9	Very high	83.4	Confident	91 Å²	91	73.6 Å²	73.6	43%	0.425	36%	0.362	S	S	.	.	H	α-helix	trans	-67.5	-41.9	178.2	-69.1	-54.2	118.3	0	0	112.7	D166 F167 K173 K174	D166-E170 WeakPolarHBondContact O-CG 3.5Å; D166-E170 PolarHBondContact O-N 3.14Å; F167-E170 PolarHBondContact O-N 3.4Å; E170-K173 PolarHBondContact O-N 3.22Å; E170-K173 IonicContact OE1-NZ 2.93Å; E170-K173 PolarHBondContact OE1-NZ 3.48Å; E170-K174 WeakPolarHBondContact O-CG 3.32Å; E170-K174 PolarHBondContact O-N 3.16Å; E170-K174 VanDerWaalsContact O-N 3.08Å
171	E	89.6	Confident	81.3	Confident	54 Å²	54	81 Å²	81	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-68.2	-38.5	176.2	-73.6	-59.5	124	0	0	112.8	I108 F167 K174 K175	I108-E171 HydrophobicContact CD1-CB 3.33Å; I108-E171 HydrophobicContact CD1-CG 4.34Å; F167-E171 HydrophobicContact CD1-CG 4.28Å; F167-E171 HydrophobicContact CD2-CG 4.28Å; F167-E171 HydrophobicContact CE1-CG 3.81Å; F167-E171 HydrophobicContact CE2-CG 3.81Å; F167-E171 HydrophobicContact CZ-CG 3.55Å; F167-E171 WeakPolarHBondContact O-CB 3.33Å; F167-E171 WeakPolarHBondContact O-CG 3.31Å; F167-E171 PolarHBondContact O-N 3.48Å; E171-K174 PolarHBondContact O-N 3.22Å; E171-K174 IonicContact OE1-NZ 2.69Å; E171-K174 PolarHBondContact OE1-NZ 2.98Å; E171-K175 WeakPolarHBondContact O-CG 3.49Å; E171-K175 PolarHBondContact O-N 3.39Å
172	T	88.7	Confident	79.3	Confident	22 Å²	22	80.5 Å²	80.5	14%	0.135	40%	0.401	C	S	.	.	H	α-helix	trans	-70.7	-32.1	175.4	53.9	0	0	0	0	112.4	P106 I108 V168 V169 R176	P106-T172 HydrophobicContact CB-CG2 4.01Å; P106-T172 WeakPolarHBondContact O-CG2 3.46Å; I108-T172 HydrophobicContact CD1-CG2 3.79Å; I108-T172 HydrophobicContact CG1-CG2 4.19Å; V168-T172 HydrophobicContact CG1-CG2 4.24Å; V168-T172 WeakPolarHBondContact O-CB 3.36Å; V168-T172 VanDerWaalsContact O-CG2 3.26Å; V168-T172 WeakPolarHBondContact O-CG2 3.42Å; V168-T172 PolarHBondContact O-N 3.26Å; V168-T172 PolarHBondContact O-OG1 3.16Å; V169-T172 PolarHBondContact O-OG1 3.24Å; T172-R176 WeakPolarHBondContact O-CG 3.41Å; T172-R176 PolarHBondContact O-N 3.44Å
173	K	87.4	Confident	77.4	Confident	106 Å²	106	84.9 Å²	84.9	46%	0.461	42%	0.419	S	S	.	.	H	α-helix	trans	-59.9	-48.4	168.1	-76.7	167.6	-175.6	171.1	0	111.5	V169 E170 R176 S177	V169-K173 HydrophobicContact CG1-CD 4.19Å; V169-K173 VanDerWaalsContact CG1-CE 3.48Å; V169-K173 WeakPolarHBondContact O-CB 3.47Å; V169-K173 WeakPolarHBondContact O-CG 3.39Å; V169-K173 PolarHBondContact O-N 3.39Å; E170-K173 PolarHBondContact O-N 3.22Å; E170-K173 IonicContact OE1-NZ 2.93Å; E170-K173 PolarHBondContact OE1-NZ 3.48Å; K173-R176 WeakPolarHBondContact O-CB 3.32Å; K173-R176 PolarHBondContact O-N 2.96Å; K173-R176 VanDerWaalsContact O-N 3.17Å; K173-S177 PolarHBondContact O-N 2.62Å; K173-S177 PolarHBondContact O-OG 3.03Å
174	K	86.4	Confident	75.3	Confident	94 Å²	94	89.9 Å²	89.9	41%	0.409	44%	0.444	S	S	.	.	H	α-helix	trans	-58.3	-50.3	176.1	-66.6	167.6	-161.1	173.2	0	111.2	E170 E171 R176 S177 D178	E170-K174 WeakPolarHBondContact O-CG 3.32Å; E170-K174 PolarHBondContact O-N 3.16Å; E170-K174 VanDerWaalsContact O-N 3.08Å; E171-K174 PolarHBondContact O-N 3.22Å; E171-K174 IonicContact OE1-NZ 2.69Å; E171-K174 PolarHBondContact OE1-NZ 2.98Å; K174-R176 PolarHBondContact O-N 3.27Å; K174-S177 WeakPolarHBondContact CA-OG 3.31Å; K174-S177 PolarHBondContact O-N 2.81Å; K174-S177 PolarHBondContact O-OG 2.95Å; K174-D178 WeakPolarHBondContact O-CB 3.3Å; K174-D178 PolarHBondContact O-N 2.59Å
175	K	82	Confident	73.2	Confident	85 Å²	85	93.5 Å²	93.5	37%	0.37	46%	0.464	S	S	.	.	H	α-helix	trans	-57.6	-35	176.4	-70.5	-176.7	-175.9	-165	0	112.9	P106 S107 E171 S179	P106-K175 HydrophobicContact CB-CB 4.03Å; P106-K175 HydrophobicContact CB-CD 4.28Å; S107-K175 PolarHBondContact O-NZ 3.22Å; E171-K175 WeakPolarHBondContact O-CG 3.49Å; E171-K175 PolarHBondContact O-N 3.39Å; K175-S179 VanDerWaalsContact O-CB 3.3Å; K175-S179 WeakPolarHBondContact O-CB 3.48Å; K175-S179 PolarHBondContact O-N 3.19Å; K175-S179 PolarHBondContact O-OG 2.63Å
176	R	73.6	Confident	71.3	Confident	135 Å²	135	91.1 Å²	91.1	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-68.2	-46.8	172.7	-74.5	175.5	178.8	163.7	0.9	112	P106 T172 K173 K174 D178 Q180	P106-R176 HydrophobicContact CG-CG 3.8Å; T172-R176 WeakPolarHBondContact O-CG 3.41Å; T172-R176 PolarHBondContact O-N 3.44Å; K173-R176 WeakPolarHBondContact O-CB 3.32Å; K173-R176 PolarHBondContact O-N 2.96Å; K173-R176 VanDerWaalsContact O-N 3.17Å; K174-R176 PolarHBondContact O-N 3.27Å; R176-D178 VanDerWaalsContact C-N 3.28Å; R176-D178 PolarHBondContact O-N 3.46Å; R176-Q180 CarbonylContact O-C 3.03Å; R176-Q180 VanDerWaalsContact O-CA 3.3Å; R176-Q180 WeakPolarHBondContact O-CA 3.32Å; R176-Q180 WeakPolarHBondContact O-CB 3.14Å; R176-Q180 PolarHBondContact O-N 3.1Å
177	S	65.8	Low	69.5	Low	75 Å²	75	93.3 Å²	93.3	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-33.6	175.9	53.1	0	0	0	0	113.1	K173 K174	K173-S177 PolarHBondContact O-N 2.62Å; K173-S177 PolarHBondContact O-OG 3.03Å; K174-S177 WeakPolarHBondContact CA-OG 3.31Å; K174-S177 PolarHBondContact O-N 2.81Å; K174-S177 PolarHBondContact O-OG 2.95Å
178	D	59.8	Low	67.7	Low	134 Å²	134	96.6 Å²	96.6	72%	0.717	50%	0.5	S	S	*	.	H	α-helix	trans	-79	-38.2	-177	-61.7	-14.1	0	0	0	112.6	K174 R176	K174-D178 WeakPolarHBondContact O-CB 3.3Å; K174-D178 PolarHBondContact O-N 2.59Å; R176-D178 VanDerWaalsContact C-N 3.28Å; R176-D178 PolarHBondContact O-N 3.46Å
179	S	57.9	Low	65.8	Low	87 Å²	87	102.5 Å²	102.5	61%	0.608	52%	0.522	S	S	*	.	H	α-helix	trans	-83.8	-13.7	176.1	59.7	0	0	0	0	113.4	K175	K175-S179 VanDerWaalsContact O-CB 3.3Å; K175-S179 WeakPolarHBondContact O-CB 3.48Å; K175-S179 PolarHBondContact O-N 3.19Å; K175-S179 PolarHBondContact O-OG 2.63Å
180	Q	48.4	Very low	64.4	Low	101 Å²	101	104.3 Å²	104.3	47%	0.472	53%	0.533	S	S	.	.			trans	-153.1	86.2	-162.4	-114.2	-175.8	-20.2	0	0	111.3	R176 I182	R176-Q180 CarbonylContact O-C 3.03Å; R176-Q180 VanDerWaalsContact O-CA 3.3Å; R176-Q180 WeakPolarHBondContact O-CA 3.32Å; R176-Q180 WeakPolarHBondContact O-CB 3.14Å; R176-Q180 PolarHBondContact O-N 3.1Å; Q180-I182 HydrophobicContact CB-CD1 4.14Å; Q180-I182 HydrophobicContact CB-CG1 3.5Å; Q180-I182 VanDerWaalsContact CB-CG1 3.5Å; Q180-I182 HydrophobicContact CG-CD1 4.24Å; Q180-I182 HydrophobicContact CG-CG1 3.62Å; Q180-I182 PolarHBondContact O-N 3.36Å
181	I	47.2	Very low	62.9	Low	154 Å²	154	104.6 Å²	104.6	79%	0.79	54%	0.538	S	S	*	.			trans	-60.2	83.1	139.1	-59.6	172.3	0	0	0	105.8	E183	I181-E183 HydrophobicContact CG2-CG 4.22Å; I181-E183 PolarHBondContact O-N 3.48Å; I181-E183 VanDerWaalsContact O-N 3.09Å
182	I	49.6	Very low	61.4	Low	54 Å²	54	106.2 Å²	106.2	28%	0.277	55%	0.548	S	S	.	.			trans	-76.4	97.1	175.1	-41.9	-175.9	0	0	0	106.8	Q180 N184 D185	Q180-I182 HydrophobicContact CB-CD1 4.14Å; Q180-I182 HydrophobicContact CB-CG1 3.5Å; Q180-I182 VanDerWaalsContact CB-CG1 3.5Å; Q180-I182 HydrophobicContact CG-CD1 4.24Å; Q180-I182 HydrophobicContact CG-CG1 3.62Å; Q180-I182 PolarHBondContact O-N 3.36Å; I182-N184 HydrophobicContact CG2-CB 4.14Å; I182-N184 PolarHBondContact O-N 3.37Å; I182-D185 HydrophobicContact CB-CB 4.37Å; I182-D185 HydrophobicContact CD1-CB 4.48Å; I182-D185 WeakPolarHBondContact CD1-OD2 3.27Å; I182-D185 HydrophobicContact CG2-CB 4.05Å
183	E	50.3	Low	60.1	Low	187 Å²	187	108 Å²	108	87%	0.874	56%	0.564	S	S	*	*	S	Bend	trans	-63.4	5.9	173.7	-61.1	-175.8	131	0	0	113.5	I181	I181-E183 HydrophobicContact CG2-CG 4.22Å; I181-E183 PolarHBondContact O-N 3.48Å; I181-E183 VanDerWaalsContact O-N 3.09Å
184	N	48.7	Very low	59.1	Low	116 Å²	116	104.7 Å²	104.7	62%	0.62	56%	0.557	S	S	*	*	S	Bend	trans	-133.5	-28	-163.1	-145.9	3.7	0	0	0	116	I182 S186 D187	I182-N184 HydrophobicContact CG2-CB 4.14Å; I182-N184 PolarHBondContact O-N 3.37Å; N184-S186 PolarHBondContact O-N 2.99Å; N184-D187 PolarHBondContact O-N 2.67Å
185	D	49.4	Very low	58	Low	85 Å²	85	105.7 Å²	105.7	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-73.7	-13.7	178.9	-86.1	4	0	0	0	113.1	I182 D187	I182-D185 HydrophobicContact CB-CB 4.37Å; I182-D185 HydrophobicContact CD1-CB 4.48Å; I182-D185 WeakPolarHBondContact CD1-OD2 3.27Å; I182-D185 HydrophobicContact CG2-CB 4.05Å; D185-D187 VanDerWaalsContact C-N 3.26Å; D185-D187 PolarHBondContact O-N 2.95Å
186	S	52.6	Low	57	Low	99 Å²	99	105.1 Å²	105.1	69%	0.692	56%	0.561	S	S	*	*	H	α-helix	trans	-68.7	-22.6	175.4	-62.4	0	0	0	0	113.2	N184	N184-S186 PolarHBondContact O-N 2.99Å
187	D	53.8	Low	56.4	Low	136 Å²	136	103.9 Å²	103.9	73%	0.727	57%	0.565	S	S	*	*	H	α-helix	trans	-90.6	-22.8	-179	-115.5	0.7	0	0	0	112.7	N184 D185	N184-D187 PolarHBondContact O-N 2.67Å; D185-D187 VanDerWaalsContact C-N 3.26Å; D185-D187 PolarHBondContact O-N 2.95Å
188	L	56.5	Low	56.2	Low	132 Å²	132	105.7 Å²	105.7	69%	0.691	57%	0.565	S	S	*	*	H	α-helix	trans	-76.6	-30.1	175.9	-77.4	167.6	0	0	0	113.1
189	F	51.3	Low	55.8	Low	170 Å²	170	103.2 Å²	103.2	75%	0.746	55%	0.552	S	S	*	*			trans	-117	72.9	178	-65.3	-80.3	0	0	0	111.2	D191	F189-D191 PolarHBondContact O-N 3.19Å
190	V	61.6	Low	55.6	Low	73 Å²	73	103.1 Å²	103.1	44%	0.442	55%	0.545	S	S	.	.			trans	-58.7	103.9	163.2	175.4	0	0	0	0	108.6	L192 K195	V190-L192 VanDerWaalsContact C-N 3.28Å; V190-L192 PolarHBondContact O-N 3.24Å; V190-K195 HydrophobicContact CG1-CD 3.65Å; V190-K195 VanDerWaalsContact CG1-NZ 3.25Å
191	D	59.5	Low	55.9	Low	98 Å²	98	103 Å²	103	52%	0.524	56%	0.555	S	S	.	*			trans	-63.9	92	173.5	-177	-6.9	0	0	0	109.7	F189 A193 A194 K195	F189-D191 PolarHBondContact O-N 3.19Å; D191-A193 PolarHBondContact O-N 3.28Å; D191-A193 WeakPolarHBondContact OD1-CA 3.33Å; D191-A193 WeakPolarHBondContact OD1-CB 3.37Å; D191-A193 PolarHBondContact OD1-N 3.36Å; D191-A194 HydrophobicContact CB-CB 3.94Å; D191-A194 VanDerWaalsContact CG-CB 3.49Å; D191-A194 PolarHBondContact O-N 3.45Å; D191-A194 PolarHBondContact OD1-N 3.07Å; D191-A194 WeakPolarHBondContact OD2-CB 3.32Å; D191-K195 PolarHBondContact O-N 2.9Å
192	L	58.9	Low	56.2	Low	88 Å²	88	104.7 Å²	104.7	46%	0.461	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-26.8	-178.1	-170.1	61.3	0	0	0	110.9	V190 I196 Y237	V190-L192 VanDerWaalsContact C-N 3.28Å; V190-L192 PolarHBondContact O-N 3.24Å; L192-I196 HydrophobicContact CG-CD1 4.01Å; L192-I196 WeakPolarHBondContact O-CB 3.42Å; L192-I196 WeakPolarHBondContact O-CD1 3.37Å; L192-I196 WeakPolarHBondContact O-CG1 3.19Å; L192-I196 PolarHBondContact O-N 3.36Å; L192-Y237 HydrophobicContact CD2-CE2 4.35Å
193	A	62.1	Low	56.4	Low	58 Å²	58	108.4 Å²	108.4	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-70.4	-43.6	174.5	0	0	0	0	0	110.9	D191 I196 N197	D191-A193 PolarHBondContact O-N 3.28Å; D191-A193 WeakPolarHBondContact OD1-CA 3.33Å; D191-A193 WeakPolarHBondContact OD1-CB 3.37Å; D191-A193 PolarHBondContact OD1-N 3.36Å; A193-I196 PolarHBondContact O-N 3.26Å; A193-N197 PolarHBondContact O-N 3.09Å; A193-N197 PolarHBondContact O-ND2 2.57Å
194	A	66.3	Low	56.7	Low	37 Å²	37	103.8 Å²	103.8	31%	0.306	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-45.2	171.9	0	0	0	0	0	112.1	D191 N197 Q198	D191-A194 HydrophobicContact CB-CB 3.94Å; D191-A194 VanDerWaalsContact CG-CB 3.49Å; D191-A194 PolarHBondContact O-N 3.45Å; D191-A194 PolarHBondContact OD1-N 3.07Å; D191-A194 WeakPolarHBondContact OD2-CB 3.32Å; A194-N197 PolarHBondContact O-N 2.98Å; A194-Q198 WeakPolarHBondContact O-CG 3.46Å; A194-Q198 PolarHBondContact O-N 2.93Å
195	K	62.7	Low	57.5	Low	115 Å²	115	104.2 Å²	104.2	50%	0.5	56%	0.563	S	S	.	*	H	α-helix	trans	-62.6	-42.7	175.5	-81.1	-175.2	179.3	169.9	0	112.7	V190 D191 N197 Q198 D199	V190-K195 HydrophobicContact CG1-CD 3.65Å; V190-K195 VanDerWaalsContact CG1-NZ 3.25Å; D191-K195 PolarHBondContact O-N 2.9Å; K195-N197 VanDerWaalsContact C-N 3.3Å; K195-N197 PolarHBondContact O-N 2.58Å; K195-Q198 PolarHBondContact O-N 3.5Å; K195-D199 WeakPolarHBondContact O-CB 3.38Å; K195-D199 PolarHBondContact O-N 2.89Å
196	I	60.6	Low	58.5	Low	73 Å²	73	104.6 Å²	104.6	37%	0.374	56%	0.56	S	S	.	*	H	α-helix	trans	-60.9	-39.7	176.7	-74.8	164.6	0	0	0	111.3	L192 A193 D199 N200	L192-I196 HydrophobicContact CG-CD1 4.01Å; L192-I196 WeakPolarHBondContact O-CB 3.42Å; L192-I196 WeakPolarHBondContact O-CD1 3.37Å; L192-I196 WeakPolarHBondContact O-CG1 3.19Å; L192-I196 PolarHBondContact O-N 3.36Å; A193-I196 PolarHBondContact O-N 3.26Å; I196-D199 PolarHBondContact O-N 2.65Å; I196-N200 VanDerWaalsContact O-CG 3.29Å; I196-N200 PolarHBondContact O-N 2.63Å; I196-N200 PolarHBondContact O-ND2 2.88Å; I196-N200 VanDerWaalsContact O-ND2 3.16Å
197	N	62.4	Low	59.7	Low	109 Å²	109	103.1 Å²	103.1	58%	0.583	55%	0.55	S	S	*	*	H	α-helix	trans	-68.2	-38.2	177.2	-73	-41.2	0	0	0	112.6	A193 A194 K195 N200 S201	A193-N197 PolarHBondContact O-N 3.09Å; A193-N197 PolarHBondContact O-ND2 2.57Å; A194-N197 PolarHBondContact O-N 2.98Å; K195-N197 VanDerWaalsContact C-N 3.3Å; K195-N197 PolarHBondContact O-N 2.58Å; N197-N200 PolarHBondContact O-N 2.64Å; N197-S201 PolarHBondContact O-N 2.92Å
198	Q	59.6	Low	61	Low	114 Å²	114	104.8 Å²	104.8	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-37.7	171.9	-67.2	-179.9	20.8	0	0	112.7	A194 K195 N200 S201 R202	A194-Q198 WeakPolarHBondContact O-CG 3.46Å; A194-Q198 PolarHBondContact O-N 2.93Å; K195-Q198 PolarHBondContact O-N 3.5Å; Q198-N200 VanDerWaalsContact C-N 3.26Å; Q198-N200 PolarHBondContact O-N 3.1Å; Q198-S201 PolarHBondContact O-N 3.19Å; Q198-S201 PolarHBondContact O-OG 3.39Å; Q198-R202 WeakPolarHBondContact O-CG 3.47Å; Q198-R202 PolarHBondContact O-N 3.16Å; Q198-R202 VanDerWaalsContact O-N 3.13Å
199	D	53.3	Low	62.1	Low	81 Å²	81	104.5 Å²	104.5	43%	0.433	55%	0.546	S	S	.	.	H	α-helix	trans	-72.4	-17.8	175.8	-98.1	1.4	0	0	0	113.4	K195 I196 K203	K195-D199 WeakPolarHBondContact O-CB 3.38Å; K195-D199 PolarHBondContact O-N 2.89Å; I196-D199 PolarHBondContact O-N 2.65Å; D199-K203 VanDerWaalsContact O-CD 3.25Å; D199-K203 WeakPolarHBondContact O-CD 3.41Å; D199-K203 VanDerWaalsContact O-CE 3.25Å; D199-K203 WeakPolarHBondContact O-CE 3.48Å; D199-K203 VanDerWaalsContact O-CG 3.24Å; D199-K203 WeakPolarHBondContact O-CG 3.2Å; D199-K203 PolarHBondContact O-NZ 3.37Å
200	N	53.3	Low	63.5	Low	86 Å²	86	100.8 Å²	100.8	46%	0.46	53%	0.531	S	S	.	.	H	α-helix	trans	-82.5	-35.1	170.7	-73.9	-31.7	0	0	0	111.9	I196 N197 Q198 R202 K203	I196-N200 VanDerWaalsContact O-CG 3.29Å; I196-N200 PolarHBondContact O-N 2.63Å; I196-N200 PolarHBondContact O-ND2 2.88Å; I196-N200 VanDerWaalsContact O-ND2 3.16Å; N197-N200 PolarHBondContact O-N 2.64Å; Q198-N200 VanDerWaalsContact C-N 3.26Å; Q198-N200 PolarHBondContact O-N 3.1Å; N200-R202 VanDerWaalsContact C-N 3.3Å; N200-R202 PolarHBondContact O-N 3.2Å; N200-K203 PolarHBondContact O-N 3.27Å; N200-K203 VanDerWaalsContact O-N 3.16Å
201	S	54.2	Low	64.3	Low	97 Å²	97	100.9 Å²	100.9	68%	0.678	53%	0.528	S	S	*	.	H	α-helix	trans	-68.8	-29.3	172.6	73.5	0	0	0	0	112.7	N197 Q198 K203	N197-S201 PolarHBondContact O-N 2.92Å; Q198-S201 PolarHBondContact O-N 3.19Å; Q198-S201 PolarHBondContact O-OG 3.39Å; S201-K203 VanDerWaalsContact C-N 3.3Å; S201-K203 PolarHBondContact O-N 2.64Å
202	R	52.8	Low	65.3	Low	191 Å²	191	99.5 Å²	99.5	72%	0.721	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.1	171.1	-71.5	177.7	173	-175	-1.5	114.4	Q198 N200 S204	Q198-R202 WeakPolarHBondContact O-CG 3.47Å; Q198-R202 PolarHBondContact O-N 3.16Å; Q198-R202 VanDerWaalsContact O-N 3.13Å; N200-R202 VanDerWaalsContact C-N 3.3Å; N200-R202 PolarHBondContact O-N 3.2Å; R202-S204 PolarHBondContact O-N 3.02Å
203	K	54.3	Low	66.3	Low	131 Å²	131	97.2 Å²	97.2	57%	0.57	51%	0.514	S	S	*	.			trans	-96.3	61.6	174.5	-70.1	165.3	-162.3	139.9	0	110.7	D199 N200 S201	D199-K203 VanDerWaalsContact O-CD 3.25Å; D199-K203 WeakPolarHBondContact O-CD 3.41Å; D199-K203 VanDerWaalsContact O-CE 3.25Å; D199-K203 WeakPolarHBondContact O-CE 3.48Å; D199-K203 VanDerWaalsContact O-CG 3.24Å; D199-K203 WeakPolarHBondContact O-CG 3.2Å; D199-K203 PolarHBondContact O-NZ 3.37Å; N200-K203 PolarHBondContact O-N 3.27Å; N200-K203 VanDerWaalsContact O-N 3.16Å; S201-K203 VanDerWaalsContact C-N 3.3Å; S201-K203 PolarHBondContact O-N 2.64Å
204	S	57.9	Low	67.2	Low	90 Å²	90	99.3 Å²	99.3	63%	0.629	51%	0.514	S	S	*	.			trans	-55	145.1	155.3	56.5	0	0	0	0	108.9	R202 K206	R202-S204 PolarHBondContact O-N 3.02Å; S204-K206 PolarHBondContact O-N 3.2Å
205	P	65.3	Low	67.7	Low	125 Å²	125	100.4 Å²	100.4	81%	0.812	52%	0.517	S	S	*	.			trans	-56.7	126.9	178.3	22.4	-32.5	0	0	0	109.5	S207	P205-S207 PolarHBondContact O-N 2.76Å
206	K	69.4	Low	68.6	Low	94 Å²	94	101.8 Å²	101.8	41%	0.409	52%	0.519	S	S	.	.			trans	-45.7	133.9	-174.1	-74.8	-178.5	161.4	177.1	0	111.6	S204 E210 I211 E214	S204-K206 PolarHBondContact O-N 3.2Å; K206-E210 WeakPolarHBondContact CA-OE2 3.43Å; K206-E210 WeakPolarHBondContact CE-OE1 3.2Å; K206-I211 HydrophobicContact CB-CD1 4.36Å; K206-I211 HydrophobicContact CB-CG1 3.89Å; K206-I211 WeakPolarHBondContact O-CD1 3.45Å; K206-E214 IonicContact NZ-OE1 2.65Å; K206-E214 PolarHBondContact NZ-OE1 3.22Å; K206-E214 IonicContact NZ-OE2 3.87Å; K206-E214 PolarHBondContact NZ-OE2 3.11Å
207	S	78.3	Confident	69.3	Low	68 Å²	68	100.8 Å²	100.8	48%	0.476	51%	0.514	S	S	.	.			trans	-58.8	144.4	-179.1	174.7	0	0	0	0	110.4	P205 L209 E210 I211	P205-S207 PolarHBondContact O-N 2.76Å; S207-L209 PolarHBondContact O-N 3.24Å; S207-L209 VanDerWaalsContact O-N 3.09Å; S207-E210 PolarHBondContact N-OE2 2.73Å; S207-E210 WeakPolarHBondContact O-CA 3.1Å; S207-E210 WeakPolarHBondContact O-CB 3.24Å; S207-E210 PolarHBondContact O-N 3.38Å; S207-I211 PolarHBondContact O-N 3.38Å
208	Y	80.2	Confident	69.7	Low	170 Å²	170	102 Å²	102	67%	0.667	51%	0.511	S	S	*	.	H	α-helix	trans	-54.1	-34.7	179.6	-178.9	-111	0	0	0	112.7	L212	Y208-L212 HydrophobicContact CD1-CD1 4.02Å; Y208-L212 HydrophobicContact CE1-CD1 3.56Å; Y208-L212 HydrophobicContact CE1-CG 4.39Å; Y208-L212 WeakPolarHBondContact O-CG 3.34Å; Y208-L212 PolarHBondContact O-N 3.24Å
209	L	80.8	Confident	70.4	Confident	126 Å²	126	104.5 Å²	104.5	66%	0.66	52%	0.521	S	S	*	.	H	α-helix	trans	-69.9	-34	174.7	-63.8	178.4	0	0	0	113.2	S207 L212 A213	S207-L209 PolarHBondContact O-N 3.24Å; S207-L209 VanDerWaalsContact O-N 3.09Å; L209-L212 PolarHBondContact O-N 2.89Å; L209-A213 WeakPolarHBondContact O-CB 3.29Å; L209-A213 PolarHBondContact O-N 3.03Å
210	E	80.4	Confident	71.3	Confident	93 Å²	93	109.1 Å²	109.1	44%	0.435	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-43.8	175.2	-167	-168.2	161.2	0	0	110.5	K206 S207 L212 A213 E214	K206-E210 WeakPolarHBondContact CA-OE2 3.43Å; K206-E210 WeakPolarHBondContact CE-OE1 3.2Å; S207-E210 PolarHBondContact N-OE2 2.73Å; S207-E210 WeakPolarHBondContact O-CA 3.1Å; S207-E210 WeakPolarHBondContact O-CB 3.24Å; S207-E210 PolarHBondContact O-N 3.38Å; E210-L212 VanDerWaalsContact C-N 3.34Å; E210-L212 PolarHBondContact O-N 3.33Å; E210-A213 WeakPolarHBondContact O-CA 3.35Å; E210-A213 WeakPolarHBondContact O-CB 3.35Å; E210-A213 PolarHBondContact O-N 3.25Å; E210-A213 VanDerWaalsContact O-N 3.08Å; E210-E214 WeakPolarHBondContact O-CB 3.08Å; E210-E214 PolarHBondContact O-N 2.73Å
211	I	77.8	Confident	72.2	Confident	75 Å²	75	112.2 Å²	112.2	39%	0.385	54%	0.537	S	S	.	.	H	α-helix	trans	-58.8	-45.1	172.7	-62	172.2	0	0	0	110.3	K206 S207 A213 E214 V215	K206-I211 HydrophobicContact CB-CD1 4.36Å; K206-I211 HydrophobicContact CB-CG1 3.89Å; K206-I211 WeakPolarHBondContact O-CD1 3.45Å; S207-I211 PolarHBondContact O-N 3.38Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 2.79Å; I211-E214 PolarHBondContact O-N 2.71Å; I211-V215 HydrophobicContact CG2-CG2 4.48Å; I211-V215 WeakPolarHBondContact O-CB 3.48Å; I211-V215 VanDerWaalsContact O-CG2 3.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.47Å; I211-V215 PolarHBondContact O-N 2.82Å
212	L	80.5	Confident	73	Confident	69 Å²	69	117.1 Å²	117.1	36%	0.361	54%	0.541	S	S	.	.	H	α-helix	trans	-67.8	-26.4	175.7	-71.2	176.3	0	0	0	113.4	Y208 L209 E210 R216	Y208-L212 HydrophobicContact CD1-CD1 4.02Å; Y208-L212 HydrophobicContact CE1-CD1 3.56Å; Y208-L212 HydrophobicContact CE1-CG 4.39Å; Y208-L212 WeakPolarHBondContact O-CG 3.34Å; Y208-L212 PolarHBondContact O-N 3.24Å; L209-L212 PolarHBondContact O-N 2.89Å; E210-L212 VanDerWaalsContact C-N 3.34Å; E210-L212 PolarHBondContact O-N 3.33Å; L212-R216 WeakPolarHBondContact O-CB 3.34Å; L212-R216 VanDerWaalsContact O-CG 3.28Å; L212-R216 WeakPolarHBondContact O-CG 3.38Å; L212-R216 PolarHBondContact O-N 3.01Å; L212-R216 PolarHBondContact O-NE 3.44Å
213	A	81.4	Confident	73.3	Confident	40 Å²	40	115.6 Å²	115.6	33%	0.331	54%	0.542	S	S	.	.	H	α-helix	trans	-72.8	-46.4	170.9	0	0	0	0	0	111.3	L209 E210 I211 V215 R216 D217	L209-A213 WeakPolarHBondContact O-CB 3.29Å; L209-A213 PolarHBondContact O-N 3.03Å; E210-A213 WeakPolarHBondContact O-CA 3.35Å; E210-A213 WeakPolarHBondContact O-CB 3.35Å; E210-A213 PolarHBondContact O-N 3.25Å; E210-A213 VanDerWaalsContact O-N 3.08Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 2.79Å; A213-V215 PolarHBondContact O-N 3.14Å; A213-R216 PolarHBondContact O-N 3.47Å; A213-D217 PolarHBondContact O-N 3.12Å
214	E	79.1	Confident	73.7	Confident	102 Å²	102	112.7 Å²	112.7	48%	0.477	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-42.1	177.8	-168.7	166.2	-150.7	0	0	111.3	K206 E210 I211 D217 Y218	K206-E214 IonicContact NZ-OE1 2.65Å; K206-E214 PolarHBondContact NZ-OE1 3.22Å; K206-E214 IonicContact NZ-OE2 3.87Å; K206-E214 PolarHBondContact NZ-OE2 3.11Å; E210-E214 WeakPolarHBondContact O-CB 3.08Å; E210-E214 PolarHBondContact O-N 2.73Å; I211-E214 PolarHBondContact O-N 2.71Å; E214-D217 PolarHBondContact O-N 3.25Å; E214-Y218 WeakPolarHBondContact O-CB 3.43Å; E214-Y218 PolarHBondContact O-N 3.09Å
215	V	77.8	Confident	73.6	Confident	60 Å²	60	115.7 Å²	115.7	36%	0.364	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-39.2	174	170.3	0	0	0	0	112.4	I211 A213 K219	I211-V215 HydrophobicContact CG2-CG2 4.48Å; I211-V215 WeakPolarHBondContact O-CB 3.48Å; I211-V215 VanDerWaalsContact O-CG2 3.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.47Å; I211-V215 PolarHBondContact O-N 2.82Å; A213-V215 PolarHBondContact O-N 3.14Å; V215-K219 HydrophobicContact CG1-CD 4.42Å; V215-K219 WeakPolarHBondContact O-CB 3.26Å; V215-K219 WeakPolarHBondContact O-CG 3.25Å; V215-K219 PolarHBondContact O-N 3.19Å
216	R	82.1	Confident	73.4	Confident	144 Å²	144	113.5 Å²	113.5	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-65.3	-40.2	174.8	-79.8	178.7	-66.9	156	-1.1	111.4	L212 A213 K219 R220	L212-R216 WeakPolarHBondContact O-CB 3.34Å; L212-R216 VanDerWaalsContact O-CG 3.28Å; L212-R216 WeakPolarHBondContact O-CG 3.38Å; L212-R216 PolarHBondContact O-N 3.01Å; L212-R216 PolarHBondContact O-NE 3.44Å; A213-R216 PolarHBondContact O-N 3.47Å; R216-K219 PolarHBondContact O-N 3.26Å; R216-R220 WeakPolarHBondContact O-CG 3.37Å; R216-R220 PolarHBondContact O-N 3.45Å
217	D	75.2	Confident	72.7	Confident	52 Å²	52	112.3 Å²	112.3	28%	0.278	52%	0.52	S	S	.	.	H	α-helix	trans	-70.9	-41.1	177.8	-157.8	59.9	0	0	0	112.4	A213 E214 K219 R220 R221	A213-D217 PolarHBondContact O-N 3.12Å; E214-D217 PolarHBondContact O-N 3.25Å; D217-K219 PolarHBondContact O-N 3.11Å; D217-R220 PolarHBondContact O-N 3.38Å; D217-R220 IonicContact OD1-NE 2.63Å; D217-R220 IonicContact OD1-NH2 3.79Å; D217-R221 WeakPolarHBondContact O-CG 3.35Å; D217-R221 PolarHBondContact O-N 2.65Å; D217-R221 IonicContact OD2-CZ 3.86Å; D217-R221 IonicContact OD2-NE 3.17Å; D217-R221 PolarHBondContact OD2-NE 3Å; D217-R221 IonicContact OD2-NH2 3.88Å; D217-R221 PolarHBondContact OD2-NH2 3.42Å
218	Y	69.8	Low	71.7	Confident	133 Å²	133	116.3 Å²	116.3	52%	0.522	53%	0.529	S	S	.	.	H	α-helix	trans	-60.1	-28.7	171.5	-167.9	-127.7	0	0	0	112.4	E214 R226	E214-Y218 WeakPolarHBondContact O-CB 3.43Å; E214-Y218 PolarHBondContact O-N 3.09Å; Y218-R226 HydrophobicContact CD2-CG 4.48Å; Y218-R226 HydrophobicContact CE2-CG 3.7Å; Y218-R226 VanDerWaalsContact CE2-CZ 3.43Å; Y218-R226 VanDerWaalsContact CG-NH2 3.25Å; Y218-R226 VanDerWaalsContact CZ-NH2 3.28Å; Y218-R226 PolarHBondContact O-NH1 3.41Å; Y218-R226 PolarHBondContact O-NH2 2.91Å; Y218-R226 PolarHBondContact OH-NE 3.06Å; Y218-R226 VanDerWaalsContact OH-NE 3.15Å
219	K	75.4	Confident	70.4	Confident	168 Å²	168	111.7 Å²	111.7	73%	0.73	52%	0.516	S	S	*	.	H	α-helix	trans	-78.4	-29.7	170.3	-75.4	178	179.5	-176.6	0	113.5	V215 R216 D217	V215-K219 HydrophobicContact CG1-CD 4.42Å; V215-K219 WeakPolarHBondContact O-CB 3.26Å; V215-K219 WeakPolarHBondContact O-CG 3.25Å; V215-K219 PolarHBondContact O-N 3.19Å; R216-K219 PolarHBondContact O-N 3.26Å; D217-K219 PolarHBondContact O-N 3.11Å
220	R	72.1	Confident	69.3	Low	177 Å²	177	109.4 Å²	109.4	67%	0.668	51%	0.507	S	S	*	.	H	α-helix	trans	-78.2	-32.7	177.6	-75.2	-172.9	-70.8	-139.7	2	113.9	R216 D217 R222	R216-R220 WeakPolarHBondContact O-CG 3.37Å; R216-R220 PolarHBondContact O-N 3.45Å; D217-R220 PolarHBondContact O-N 3.38Å; D217-R220 IonicContact OD1-NE 2.63Å; D217-R220 IonicContact OD1-NH2 3.79Å; R220-R222 PolarHBondContact O-N 3.11Å
221	R	71.5	Confident	68	Low	151 Å²	151	112.6 Å²	112.6	57%	0.57	52%	0.521	S	S	*	.	S	Bend	trans	-69.7	120.7	178.4	-65.1	-177.9	-160.3	-162.9	7.2	111.6	D217 R226	D217-R221 WeakPolarHBondContact O-CG 3.35Å; D217-R221 PolarHBondContact O-N 2.65Å; D217-R221 IonicContact OD2-CZ 3.86Å; D217-R221 IonicContact OD2-NE 3.17Å; D217-R221 PolarHBondContact OD2-NE 3Å; D217-R221 IonicContact OD2-NH2 3.88Å; D217-R221 PolarHBondContact OD2-NH2 3.42Å; R221-R226 PolarHBondContact O-NH1 3.22Å
222	R	70.5	Confident	66.8	Low	200 Å²	200	114.9 Å²	114.9	76%	0.755	53%	0.533	S	S	*	.			trans	-55.6	140.9	173.7	-68.6	-176.2	176	-161.6	-1.2	110.8	R220 S224 Y225	R220-R222 PolarHBondContact O-N 3.11Å; R222-S224 PolarHBondContact O-N 2.83Å; R222-Y225 HydrophobicContact CB-CD2 4.25Å; R222-Y225 PolarHBondContact O-N 3.32Å
223	Q	60.4	Low	65.7	Low	160 Å²	160	116.4 Å²	116.4	75%	0.748	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.9	-173.8	-72.6	-161.7	-4.7	0	0	114.4	Y225 R226	Q223-Y225 PolarHBondContact O-N 3.08Å; Q223-Y225 VanDerWaalsContact O-N 3.16Å; Q223-R226 WeakPolarHBondContact O-CB 3.11Å; Q223-R226 PolarHBondContact O-N 3.18Å
224	S	61.6	Low	65	Low	69 Å²	69	122.3 Å²	122.3	48%	0.483	56%	0.564	S	S	.	*	H	α-helix	trans	-57.4	-26.5	174.7	54.2	0	0	0	0	114.6	R222 K228	R222-S224 PolarHBondContact O-N 2.83Å; S224-K228 WeakPolarHBondContact O-CD 3.44Å; S224-K228 WeakPolarHBondContact O-CG 3.22Å
225	Y	55.8	Low	64.7	Low	153 Å²	153	123.1 Å²	123.1	60%	0.6	57%	0.566	S	S	*	*	H	α-helix	trans	-95.7	-7.2	176.3	-63.6	-73.2	0	0	0	113.3	R222 Q223	R222-Y225 HydrophobicContact CB-CD2 4.25Å; R222-Y225 PolarHBondContact O-N 3.32Å; Q223-Y225 PolarHBondContact O-N 3.08Å; Q223-Y225 VanDerWaalsContact O-N 3.16Å
226	R	60.9	Low	64.6	Low	79 Å²	79	122.7 Å²	122.7	30%	0.298	57%	0.565	S	S	.	*	H	α-helix	trans	-74.5	-29.7	-174.8	-152.9	-176.1	-150.9	84.9	-2.2	112.7	Y218 R221 Q223	Y218-R226 HydrophobicContact CD2-CG 4.48Å; Y218-R226 HydrophobicContact CE2-CG 3.7Å; Y218-R226 VanDerWaalsContact CE2-CZ 3.43Å; Y218-R226 VanDerWaalsContact CG-NH2 3.25Å; Y218-R226 VanDerWaalsContact CZ-NH2 3.28Å; Y218-R226 PolarHBondContact O-NH1 3.41Å; Y218-R226 PolarHBondContact O-NH2 2.91Å; Y218-R226 PolarHBondContact OH-NE 3.06Å; Y218-R226 VanDerWaalsContact OH-NE 3.15Å; R221-R226 PolarHBondContact O-NH1 3.22Å; Q223-R226 WeakPolarHBondContact O-CB 3.11Å; Q223-R226 PolarHBondContact O-N 3.18Å
227	A	54.7	Low	64.4	Low	70 Å²	70	123 Å²	123	58%	0.579	57%	0.568	S	S	*	*	H	α-helix	trans	-108.4	-27.5	-179.1	0	0	0	0	0	113.9	N229 V230	A227-N229 VanDerWaalsContact C-N 3.28Å; A227-N229 PolarHBondContact O-N 2.88Å; A227-V230 PolarHBondContact O-N 2.92Å
228	K	57.8	Low	64.5	Low	152 Å²	152	124.3 Å²	124.3	66%	0.661	58%	0.577	S	S	*	*	H	α-helix	trans	-69.7	-18.4	-172.5	-74.5	-170	175.6	-166.5	0	115.5	S224	S224-K228 WeakPolarHBondContact O-CD 3.44Å; S224-K228 WeakPolarHBondContact O-CG 3.22Å
229	N	53.3	Low	65	Low	73 Å²	73	121.2 Å²	121.2	39%	0.39	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107	-2.6	-176.4	-67	17.6	0	0	0	113.5	A227 H231 I232 T233	A227-N229 VanDerWaalsContact C-N 3.28Å; A227-N229 PolarHBondContact O-N 2.88Å; N229-H231 VanDerWaalsContact C-N 3.33Å; N229-H231 PolarHBondContact O-N 3.05Å; N229-I232 PolarHBondContact O-N 3.15Å; N229-T233 HydrophobicContact CB-CG2 4.24Å; N229-T233 PolarHBondContact O-N 3.31Å; N229-T233 PolarHBondContact O-OG1 2.63Å; N229-T233 VanDerWaalsContact O-OG1 3.05Å
230	V	56.5	Low	65.4	Low	78 Å²	78	116.4 Å²	116.4	47%	0.473	55%	0.552	S	S	.	*	H	α-helix	trans	-61.3	-42.1	-175.5	179.2	0	0	0	0	111.4	A227 I232 K234	A227-V230 PolarHBondContact O-N 2.92Å; V230-I232 VanDerWaalsContact C-N 3.3Å; V230-I232 PolarHBondContact O-N 2.78Å; V230-K234 PolarHBondContact O-N 3.22Å
231	H	53.1	Low	66	Low	159 Å²	159	111 Å²	111	74%	0.736	54%	0.536	S	S	*	.	H	α-helix	trans	-79.7	-5.4	175.7	-55.8	-70.8	0	0	0	114.3	N229	N229-H231 VanDerWaalsContact C-N 3.33Å; N229-H231 PolarHBondContact O-N 3.05Å
232	I	54	Low	66.8	Low	124 Å²	124	109.7 Å²	109.7	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-104.4	-41.6	-178	-61.7	175.8	0	0	0	110.7	N229 V230	N229-I232 PolarHBondContact O-N 3.15Å; V230-I232 VanDerWaalsContact C-N 3.3Å; V230-I232 PolarHBondContact O-N 2.78Å
233	T	56.8	Low	67.5	Low	101 Å²	101	103.1 Å²	103.1	62%	0.62	51%	0.511	S	S	*	.	H	α-helix	trans	-94	-3.4	-177.4	61.6	0	0	0	0	114	N229	N229-T233 HydrophobicContact CB-CG2 4.24Å; N229-T233 PolarHBondContact O-N 3.31Å; N229-T233 PolarHBondContact O-OG1 2.63Å; N229-T233 VanDerWaalsContact O-OG1 3.05Å
234	K	66.3	Low	69	Low	163 Å²	163	98.9 Å²	98.9	71%	0.709	50%	0.496	S	S	*	.			trans	-139.6	70.4	176.5	-65.2	-171.7	178.6	-173.6	0	110	V230 S236	V230-K234 PolarHBondContact O-N 3.22Å; K234-S236 PolarHBondContact O-N 3.5Å
235	K	72.9	Confident	70.5	Confident	120 Å²	120	99.9 Å²	99.9	52%	0.522	50%	0.495	S	S	.	.			trans	-53.3	126.2	160.3	-66	-174	178.7	-172.8	0	107.4	E239 V240 D243	K235-E239 HydrophobicContact CB-CB 4.18Å; K235-V240 HydrophobicContact CB-CG2 3.71Å; K235-V240 HydrophobicContact CD-CG2 4.5Å; K235-D243 WeakPolarHBondContact CD-OD2 3.5Å; K235-D243 WeakPolarHBondContact CE-OD2 3.4Å; K235-D243 IonicContact NZ-OD2 2.67Å; K235-D243 PolarHBondContact NZ-OD2 3Å
236	S	76.2	Confident	72.1	Confident	51 Å²	51	97.3 Å²	97.3	36%	0.357	49%	0.491	S	S	.	.			trans	-63.8	155.7	172.7	60	0	0	0	0	109.9	K234 T238 E239 V240	K234-S236 PolarHBondContact O-N 3.5Å; S236-T238 PolarHBondContact O-N 3.15Å; S236-T238 VanDerWaalsContact O-N 3.1Å; S236-E239 WeakPolarHBondContact CB-OE2 3.17Å; S236-E239 PolarHBondContact N-OE2 3.23Å; S236-E239 WeakPolarHBondContact O-CA 3.47Å; S236-E239 WeakPolarHBondContact O-CB 3.3Å; S236-E239 PolarHBondContact O-N 3.44Å; S236-E239 VanDerWaalsContact OG-CG 3.25Å; S236-E239 WeakPolarHBondContact OG-CG 3.49Å; S236-E239 PolarHBondContact OG-OE2 2.8Å; S236-V240 PolarHBondContact O-N 3.26Å
237	Y	76.6	Confident	73.7	Confident	150 Å²	150	96.9 Å²	96.9	59%	0.588	50%	0.497	S	S	*	.	H	α-helix	trans	-51.4	-37.5	179.6	176.5	-112.4	0	0	0	112.7	L192 V240 I241	L192-Y237 HydrophobicContact CD2-CE2 4.35Å; Y237-V240 PolarHBondContact O-N 3.5Å; Y237-I241 HydrophobicContact CD1-CD1 3.83Å; Y237-I241 HydrophobicContact CD2-CD1 4.38Å; Y237-I241 HydrophobicContact CE1-CD1 3.39Å; Y237-I241 HydrophobicContact CE2-CD1 4Å; Y237-I241 HydrophobicContact CG-CD1 4.31Å; Y237-I241 VanDerWaalsContact CZ-CD1 3.49Å; Y237-I241 WeakPolarHBondContact O-CG1 3.36Å; Y237-I241 PolarHBondContact O-N 3.48Å
238	T	78.1	Confident	75.3	Confident	79 Å²	79	98.1 Å²	98.1	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-77.2	-21.3	177.6	69.1	0	0	0	0	113.9	S236 R242	S236-T238 PolarHBondContact O-N 3.15Å; S236-T238 VanDerWaalsContact O-N 3.1Å; T238-R242 WeakPolarHBondContact O-CB 3.5Å; T238-R242 WeakPolarHBondContact O-CG 3.46Å; T238-R242 PolarHBondContact O-N 2.93Å; T238-R242 VanDerWaalsContact O-N 3.15Å; T238-R242 PolarHBondContact O-NE 3.25Å; T238-R242 PolarHBondContact OG1-NH2 2.78Å
239	E	81.3	Confident	76.9	Confident	68 Å²	68	96.5 Å²	96.5	32%	0.318	49%	0.487	S	S	.	.	H	α-helix	trans	-75.8	-42	169.4	-72.7	162.8	151.8	0	0	110.4	K235 S236 I241 R242 D243	K235-E239 HydrophobicContact CB-CB 4.18Å; S236-E239 WeakPolarHBondContact CB-OE2 3.17Å; S236-E239 PolarHBondContact N-OE2 3.23Å; S236-E239 WeakPolarHBondContact O-CA 3.47Å; S236-E239 WeakPolarHBondContact O-CB 3.3Å; S236-E239 PolarHBondContact O-N 3.44Å; S236-E239 VanDerWaalsContact OG-CG 3.25Å; S236-E239 WeakPolarHBondContact OG-CG 3.49Å; S236-E239 PolarHBondContact OG-OE2 2.8Å; E239-I241 VanDerWaalsContact C-N 3.34Å; E239-I241 PolarHBondContact O-N 3.41Å; E239-R242 PolarHBondContact O-N 2.73Å; E239-D243 VanDerWaalsContact O-CG 3.24Å; E239-D243 PolarHBondContact O-N 3.5Å
240	V	82.9	Confident	78.7	Confident	67 Å²	67	98.8 Å²	98.8	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-45.2	173.8	179.4	0	0	0	0	110.9	K235 S236 Y237 R242 D243 V244	K235-V240 HydrophobicContact CB-CG2 3.71Å; K235-V240 HydrophobicContact CD-CG2 4.5Å; S236-V240 PolarHBondContact O-N 3.26Å; Y237-V240 PolarHBondContact O-N 3.5Å; V240-R242 PolarHBondContact O-N 3.01Å; V240-D243 PolarHBondContact O-N 3.31Å; V240-V244 WeakPolarHBondContact O-CG2 3.32Å; V240-V244 PolarHBondContact O-N 3.19Å
241	I	84.8	Confident	80.3	Confident	65 Å²	65	99.4 Å²	99.4	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-43.6	174.5	-72.2	166.8	0	0	0	111.7	Y237 E239 D243 V244 I245	Y237-I241 HydrophobicContact CD1-CD1 3.83Å; Y237-I241 HydrophobicContact CD2-CD1 4.38Å; Y237-I241 HydrophobicContact CE1-CD1 3.39Å; Y237-I241 HydrophobicContact CE2-CD1 4Å; Y237-I241 HydrophobicContact CG-CD1 4.31Å; Y237-I241 VanDerWaalsContact CZ-CD1 3.49Å; Y237-I241 WeakPolarHBondContact O-CG1 3.36Å; Y237-I241 PolarHBondContact O-N 3.48Å; E239-I241 VanDerWaalsContact C-N 3.34Å; E239-I241 PolarHBondContact O-N 3.41Å; I241-D243 VanDerWaalsContact C-N 3.34Å; I241-D243 PolarHBondContact O-N 3.38Å; I241-V244 PolarHBondContact O-N 2.97Å; I241-I245 HydrophobicContact CG2-CD1 3.62Å; I241-I245 HydrophobicContact CG2-CG1 4.29Å; I241-I245 WeakPolarHBondContact O-CB 3.38Å; I241-I245 VanDerWaalsContact O-CG1 3.27Å; I241-I245 WeakPolarHBondContact O-CG1 3.2Å; I241-I245 PolarHBondContact O-N 3.49Å
242	R	88.2	Confident	82.1	Confident	123 Å²	123	97.3 Å²	97.3	46%	0.464	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-41.4	177.5	-85.6	174.7	-81.4	140.6	-11	112	T238 E239 V240 I245 N246	T238-R242 WeakPolarHBondContact O-CB 3.5Å; T238-R242 WeakPolarHBondContact O-CG 3.46Å; T238-R242 PolarHBondContact O-N 2.93Å; T238-R242 VanDerWaalsContact O-N 3.15Å; T238-R242 PolarHBondContact O-NE 3.25Å; T238-R242 PolarHBondContact OG1-NH2 2.78Å; E239-R242 PolarHBondContact O-N 2.73Å; V240-R242 PolarHBondContact O-N 3.01Å; R242-I245 PolarHBondContact O-N 3.15Å; R242-N246 WeakPolarHBondContact O-CB 3.45Å; R242-N246 PolarHBondContact O-N 2.76Å; R242-N246 PolarHBondContact O-ND2 3.24Å; R242-N246 PolarHBondContact O-OD1 2.96Å
243	D	85.8	Confident	83.8	Confident	61 Å²	61	93.8 Å²	93.8	33%	0.326	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-42.4	177.2	-66.1	-18.3	0	0	0	111.7	K235 E239 V240 I241 N246 V247	K235-D243 WeakPolarHBondContact CD-OD2 3.5Å; K235-D243 WeakPolarHBondContact CE-OD2 3.4Å; K235-D243 IonicContact NZ-OD2 2.67Å; K235-D243 PolarHBondContact NZ-OD2 3Å; E239-D243 VanDerWaalsContact O-CG 3.24Å; E239-D243 PolarHBondContact O-N 3.5Å; V240-D243 PolarHBondContact O-N 3.31Å; I241-D243 VanDerWaalsContact C-N 3.34Å; I241-D243 PolarHBondContact O-N 3.38Å; D243-N246 PolarHBondContact O-N 3.05Å; D243-V247 WeakPolarHBondContact O-CG2 3.41Å; D243-V247 PolarHBondContact O-N 3.21Å
244	V	92.2	Very high	85.3	Confident	71 Å²	71	92.2 Å²	92.2	43%	0.43	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-43.8	175.7	169.6	0	0	0	0	111.5	V240 I241 N246 V247 H248	V240-V244 WeakPolarHBondContact O-CG2 3.32Å; V240-V244 PolarHBondContact O-N 3.19Å; I241-V244 PolarHBondContact O-N 2.97Å; V244-N246 VanDerWaalsContact C-N 3.33Å; V244-N246 PolarHBondContact O-N 3.33Å; V244-V247 PolarHBondContact O-N 2.67Å; V244-H248 PolarHBondContact O-CD2 3.36Å; V244-H248 VanDerWaalsContact O-CD2 3.26Å; V244-H248 PolarHBondContact O-N 3.25Å
245	I	91.4	Very high	86.2	Confident	90 Å²	90	90 Å²	90	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-44.6	173.8	-69.9	167.6	0	0	0	110.3	I241 R242 V247 H248 M249	I241-I245 HydrophobicContact CG2-CD1 3.62Å; I241-I245 HydrophobicContact CG2-CG1 4.29Å; I241-I245 WeakPolarHBondContact O-CB 3.38Å; I241-I245 VanDerWaalsContact O-CG1 3.27Å; I241-I245 WeakPolarHBondContact O-CG1 3.2Å; I241-I245 PolarHBondContact O-N 3.49Å; R242-I245 PolarHBondContact O-N 3.15Å; I245-V247 PolarHBondContact O-N 3.44Å; I245-H248 PolarHBondContact O-N 2.87Å; I245-M249 HydrophobicContact CG2-CG 4.07Å; I245-M249 WeakPolarHBondContact O-CB 3.4Å; I245-M249 WeakPolarHBondContact O-CG 3.43Å; I245-M249 PolarHBondContact O-N 3.46Å
246	N	90.9	Very high	86.8	Confident	99 Å²	99	92 Å²	92	53%	0.529	46%	0.458	S	S	.	.	H	α-helix	trans	-62.6	-42	179.7	-68.9	-22.1	0	0	0	112.1	R242 D243 V244 M249 E250	R242-N246 WeakPolarHBondContact O-CB 3.45Å; R242-N246 PolarHBondContact O-N 2.76Å; R242-N246 PolarHBondContact O-ND2 3.24Å; R242-N246 PolarHBondContact O-OD1 2.96Å; D243-N246 PolarHBondContact O-N 3.05Å; V244-N246 VanDerWaalsContact C-N 3.33Å; V244-N246 PolarHBondContact O-N 3.33Å; N246-M249 PolarHBondContact O-N 2.8Å; N246-E250 WeakPolarHBondContact O-CB 3.37Å; N246-E250 PolarHBondContact O-N 2.94Å
247	V	94.1	Very high	87.2	Confident	70 Å²	70	94.8 Å²	94.8	42%	0.424	47%	0.465	S	S	.	.	H	α-helix	trans	-61.5	-48.1	175.8	170.4	0	0	0	0	111.1	D243 V244 I245 M249 E250 E251	D243-V247 WeakPolarHBondContact O-CG2 3.41Å; D243-V247 PolarHBondContact O-N 3.21Å; V244-V247 PolarHBondContact O-N 2.67Å; I245-V247 PolarHBondContact O-N 3.44Å; V247-M249 VanDerWaalsContact C-N 3.35Å; V247-M249 PolarHBondContact O-N 3.24Å; V247-E250 WeakPolarHBondContact O-CB 3.43Å; V247-E250 PolarHBondContact O-N 2.93Å; V247-E250 VanDerWaalsContact O-N 3.16Å; V247-E251 HydrophobicContact CG1-CG 4.44Å; V247-E251 WeakPolarHBondContact O-CG 3.38Å; V247-E251 PolarHBondContact O-N 3.43Å
248	H	89.1	Confident	87.4	Confident	97 Å²	97	91.9 Å²	91.9	45%	0.449	46%	0.457	S	S	.	.	H	α-helix	trans	-67.7	-32.8	178.1	-66.3	-42	0	0	0	113.3	V244 I245 E250 E251 L252	V244-H248 PolarHBondContact O-CD2 3.36Å; V244-H248 VanDerWaalsContact O-CD2 3.26Å; V244-H248 PolarHBondContact O-N 3.25Å; I245-H248 PolarHBondContact O-N 2.87Å; H248-E250 VanDerWaalsContact C-N 3.32Å; H248-E251 IonicContact CE1-OE2 3.96Å; H248-E251 IonicContact CG-OE2 2.63Å; H248-E251 IonicContact ND1-OE2 2.65Å; H248-E251 PolarHBondContact ND1-OE2 3.13Å; H248-L252 WeakPolarHBondContact O-CB 3.12Å; H248-L252 VanDerWaalsContact O-CG 3.22Å; H248-L252 WeakPolarHBondContact O-CG 3.4Å; H248-L252 PolarHBondContact O-N 3.35Å
249	M	90.5	Very high	87.5	Confident	117 Å²	117	94 Å²	94	58%	0.576	46%	0.461	S	S	*	.	H	α-helix	trans	-66.2	-36	172.3	-73.2	-63.9	-53.3	0	0	111.7	I245 N246 V247 S253	I245-M249 HydrophobicContact CG2-CG 4.07Å; I245-M249 WeakPolarHBondContact O-CB 3.4Å; I245-M249 WeakPolarHBondContact O-CG 3.43Å; I245-M249 PolarHBondContact O-N 3.46Å; N246-M249 PolarHBondContact O-N 2.8Å; V247-M249 VanDerWaalsContact C-N 3.35Å; V247-M249 PolarHBondContact O-N 3.24Å; M249-S253 VanDerWaalsContact O-CB 3.31Å; M249-S253 WeakPolarHBondContact O-CB 3.25Å; M249-S253 PolarHBondContact O-N 3.05Å; M249-S253 PolarHBondContact O-OG 3.19Å
250	E	91.7	Very high	87.1	Confident	121 Å²	121	95.1 Å²	95.1	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-68.3	-49.1	174.5	-171	170.9	-175	0	0	110.8	N246 V247 H248 L252 S253 N254	N246-E250 WeakPolarHBondContact O-CB 3.37Å; N246-E250 PolarHBondContact O-N 2.94Å; V247-E250 WeakPolarHBondContact O-CB 3.43Å; V247-E250 PolarHBondContact O-N 2.93Å; V247-E250 VanDerWaalsContact O-N 3.16Å; H248-E250 VanDerWaalsContact C-N 3.32Å; E250-L252 PolarHBondContact O-N 3.05Å; E250-S253 WeakPolarHBondContact CA-OG 3.44Å; E250-S253 PolarHBondContact O-N 2.95Å; E250-S253 VanDerWaalsContact O-N 3.11Å; E250-S253 PolarHBondContact O-OG 3.41Å; E250-N254 PolarHBondContact O-N 3.44Å; E250-N254 PolarHBondContact O-ND2 2.84Å; E250-N254 PolarHBondContact O-OD1 3.03Å
251	E	90.4	Very high	86.6	Confident	92 Å²	92	98 Å²	98	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-55	-49.2	174.3	-71.7	168.1	164.5	0	0	112.4	V247 H248 S253 N254 H255	V247-E251 HydrophobicContact CG1-CG 4.44Å; V247-E251 WeakPolarHBondContact O-CG 3.38Å; V247-E251 PolarHBondContact O-N 3.43Å; H248-E251 IonicContact CE1-OE2 3.96Å; H248-E251 IonicContact CG-OE2 2.63Å; H248-E251 IonicContact ND1-OE2 2.65Å; H248-E251 PolarHBondContact ND1-OE2 3.13Å; E251-S253 VanDerWaalsContact C-N 3.33Å; E251-S253 PolarHBondContact O-N 3.18Å; E251-N254 PolarHBondContact O-N 3.47Å; E251-H255 PolarHBondContact O-CD2 3.31Å; E251-H255 VanDerWaalsContact O-CD2 3.3Å; E251-H255 PolarHBondContact O-N 2.93Å
252	L	90.3	Very high	85.9	Confident	114 Å²	114	100.3 Å²	100.3	60%	0.597	48%	0.483	S	S	*	.	H	α-helix	trans	-63.6	-37	176.2	-72.2	170.2	0	0	0	112.3	H248 E250 W256	H248-L252 WeakPolarHBondContact O-CB 3.12Å; H248-L252 VanDerWaalsContact O-CG 3.22Å; H248-L252 WeakPolarHBondContact O-CG 3.4Å; H248-L252 PolarHBondContact O-N 3.35Å; E250-L252 PolarHBondContact O-N 3.05Å; L252-W256 WeakPolarHBondContact O-CB 3.38Å; L252-W256 PolarHBondContact O-N 2.86Å
253	S	89.4	Confident	84.9	Confident	51 Å²	51	97.5 Å²	97.5	36%	0.357	49%	0.486	S	S	.	.	H	α-helix	trans	-69	-35	176.7	72.3	0	0	0	0	112.6	M249 E250 E251 Q257	M249-S253 VanDerWaalsContact O-CB 3.31Å; M249-S253 WeakPolarHBondContact O-CB 3.25Å; M249-S253 PolarHBondContact O-N 3.05Å; M249-S253 PolarHBondContact O-OG 3.19Å; E250-S253 WeakPolarHBondContact CA-OG 3.44Å; E250-S253 PolarHBondContact O-N 2.95Å; E250-S253 VanDerWaalsContact O-N 3.11Å; E250-S253 PolarHBondContact O-OG 3.41Å; E251-S253 VanDerWaalsContact C-N 3.33Å; E251-S253 PolarHBondContact O-N 3.18Å; S253-Q257 WeakPolarHBondContact O-CG 3.28Å; S253-Q257 PolarHBondContact O-N 3.38Å
254	N	87.9	Confident	84	Confident	68 Å²	68	100.9 Å²	100.9	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-69.2	-46.1	175	-65.1	-20.2	0	0	0	110.5	E250 E251 W256 Q257 E258	E250-N254 PolarHBondContact O-N 3.44Å; E250-N254 PolarHBondContact O-ND2 2.84Å; E250-N254 PolarHBondContact O-OD1 3.03Å; E251-N254 PolarHBondContact O-N 3.47Å; N254-W256 VanDerWaalsContact C-N 3.31Å; N254-W256 PolarHBondContact O-N 3.01Å; N254-Q257 PolarHBondContact O-N 3.44Å; N254-Q257 VanDerWaalsContact O-N 3.13Å; N254-E258 WeakPolarHBondContact O-CB 3.48Å; N254-E258 WeakPolarHBondContact O-CG 3.46Å; N254-E258 PolarHBondContact O-N 3.17Å
255	H	86.1	Confident	82.5	Confident	117 Å²	117	101.7 Å²	101.7	54%	0.542	50%	0.502	S	S	.	.	H	α-helix	trans	-58.1	-43	174.5	-79.2	-145.9	0	0	0	111.8	E251 Q257 E258 E259	E251-H255 PolarHBondContact O-CD2 3.31Å; E251-H255 VanDerWaalsContact O-CD2 3.3Å; E251-H255 PolarHBondContact O-N 2.93Å; H255-Q257 VanDerWaalsContact C-N 3.33Å; H255-Q257 PolarHBondContact O-N 3.38Å; H255-E258 PolarHBondContact O-N 3.3Å; H255-E259 WeakPolarHBondContact O-CB 3.47Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 3.4Å
256	W	85.5	Confident	80.9	Confident	162 Å²	162	102.3 Å²	102.3	61%	0.614	51%	0.506	S	S	*	.	H	α-helix	trans	-67.7	-29.4	176.9	-177.2	-93	0	0	0	113.6	L252 N254 Q260	L252-W256 WeakPolarHBondContact O-CB 3.38Å; L252-W256 PolarHBondContact O-N 2.86Å; N254-W256 VanDerWaalsContact C-N 3.31Å; N254-W256 PolarHBondContact O-N 3.01Å; W256-Q260 VanDerWaalsContact CD1-NE2 3.26Å; W256-Q260 PolarHBondContact O-N 2.88Å; W256-Q260 PolarHBondContact O-NE2 3.36Å
257	Q	84.2	Confident	79.5	Confident	108 Å²	108	100.1 Å²	100.1	51%	0.505	50%	0.502	S	S	.	.	H	α-helix	trans	-73.8	-46.8	171.4	-77.2	176.4	-9.2	0	0	111	S253 N254 H255 E259 Q260 E261	S253-Q257 WeakPolarHBondContact O-CG 3.28Å; S253-Q257 PolarHBondContact O-N 3.38Å; N254-Q257 PolarHBondContact O-N 3.44Å; N254-Q257 VanDerWaalsContact O-N 3.13Å; H255-Q257 VanDerWaalsContact C-N 3.33Å; H255-Q257 PolarHBondContact O-N 3.38Å; Q257-E259 VanDerWaalsContact C-N 3.31Å; Q257-E259 PolarHBondContact O-N 2.76Å; Q257-Q260 PolarHBondContact O-N 2.68Å; Q257-Q260 VanDerWaalsContact O-N 3.14Å; Q257-E261 WeakPolarHBondContact O-CG 3.45Å; Q257-E261 PolarHBondContact O-N 2.93Å
258	E	81.1	Confident	77.8	Confident	90 Å²	90	103.7 Å²	103.7	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-35.9	176.3	-76	-172.9	-147.2	0	0	113.3	N254 H255 K262	N254-E258 WeakPolarHBondContact O-CB 3.48Å; N254-E258 WeakPolarHBondContact O-CG 3.46Å; N254-E258 PolarHBondContact O-N 3.17Å; H255-E258 PolarHBondContact O-N 3.3Å; E258-K262 VanDerWaalsContact O-CB 3.29Å; E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 VanDerWaalsContact O-CD 3.24Å; E258-K262 WeakPolarHBondContact O-CD 3.33Å; E258-K262 WeakPolarHBondContact O-CG 3.46Å; E258-K262 PolarHBondContact O-N 3.42Å; E258-K262 IonicContact OE2-NZ 2.62Å; E258-K262 PolarHBondContact OE2-NZ 2.95Å
259	E	79.2	Confident	76.3	Confident	122 Å²	122	103.8 Å²	103.8	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-68.2	-37.7	174.6	-78.4	-177.7	169.8	0	0	112.2	H255 Q257 A263	H255-E259 WeakPolarHBondContact O-CB 3.47Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 3.4Å; Q257-E259 VanDerWaalsContact C-N 3.31Å; Q257-E259 PolarHBondContact O-N 2.76Å; E259-A263 WeakPolarHBondContact O-CB 3.43Å; E259-A263 PolarHBondContact O-N 2.97Å
260	Q	74.1	Confident	74.7	Confident	92 Å²	92	102.2 Å²	102.2	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-46.5	173.2	-78.2	176.8	108.6	0	0	111.7	W256 Q257 K262 A263 E264	W256-Q260 VanDerWaalsContact CD1-NE2 3.26Å; W256-Q260 PolarHBondContact O-N 2.88Å; W256-Q260 PolarHBondContact O-NE2 3.36Å; Q257-Q260 PolarHBondContact O-N 2.68Å; Q257-Q260 VanDerWaalsContact O-N 3.14Å; Q260-K262 VanDerWaalsContact C-N 3.34Å; Q260-K262 PolarHBondContact O-N 3.24Å; Q260-A263 PolarHBondContact O-N 3.44Å; Q260-A263 VanDerWaalsContact O-N 3.12Å; Q260-E264 WeakPolarHBondContact O-CG 3.48Å; Q260-E264 PolarHBondContact O-N 2.92Å
261	E	72.3	Confident	72.9	Confident	127 Å²	127	102.9 Å²	102.9	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-59.1	-45.2	177.2	-73	-178.8	175.8	0	0	110.6	Q257 A263 E264 D265	Q257-E261 WeakPolarHBondContact O-CG 3.45Å; Q257-E261 PolarHBondContact O-N 2.93Å; E261-A263 VanDerWaalsContact C-N 3.34Å; E261-A263 PolarHBondContact O-N 2.92Å; E261-E264 PolarHBondContact O-N 3.27Å; E261-D265 VanDerWaalsContact O-CB 3.32Å; E261-D265 WeakPolarHBondContact O-CB 3.15Å; E261-D265 PolarHBondContact O-N 3.37Å
262	K	69.3	Low	70.8	Confident	114 Å²	114	106.4 Å²	106.4	50%	0.496	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-38.2	174.6	-72.2	161.5	-163.4	156.9	0	112.7	E258 Q260 D266	E258-K262 VanDerWaalsContact O-CB 3.29Å; E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 VanDerWaalsContact O-CD 3.24Å; E258-K262 WeakPolarHBondContact O-CD 3.33Å; E258-K262 WeakPolarHBondContact O-CG 3.46Å; E258-K262 PolarHBondContact O-N 3.42Å; E258-K262 IonicContact OE2-NZ 2.62Å; E258-K262 PolarHBondContact OE2-NZ 2.95Å; Q260-K262 VanDerWaalsContact C-N 3.34Å; Q260-K262 PolarHBondContact O-N 3.24Å; K262-D266 WeakPolarHBondContact O-CB 3.25Å; K262-D266 PolarHBondContact O-N 2.93Å
263	A	68.6	Low	68.8	Low	64 Å²	64	111.6 Å²	111.6	53%	0.529	54%	0.538	S	S	.	.	H	α-helix	trans	-69.5	-35.1	177.4	0	0	0	0	0	113	E259 Q260 E261 A267	E259-A263 WeakPolarHBondContact O-CB 3.43Å; E259-A263 PolarHBondContact O-N 2.97Å; Q260-A263 PolarHBondContact O-N 3.44Å; Q260-A263 VanDerWaalsContact O-N 3.12Å; E261-A263 VanDerWaalsContact C-N 3.34Å; E261-A263 PolarHBondContact O-N 2.92Å; A263-A267 WeakPolarHBondContact O-CB 3.39Å; A263-A267 PolarHBondContact O-N 3.48Å; A263-A267 VanDerWaalsContact O-N 3.12Å
264	E	65.3	Low	66.9	Low	133 Å²	133	117.3 Å²	117.3	62%	0.621	55%	0.552	S	S	*	*	H	α-helix	trans	-69.9	-45.1	173	-70.2	-179.8	175.6	0	0	110.9	Q260 E261 D266 A267 E268	Q260-E264 WeakPolarHBondContact O-CG 3.48Å; Q260-E264 PolarHBondContact O-N 2.92Å; E261-E264 PolarHBondContact O-N 3.27Å; E264-D266 VanDerWaalsContact C-N 3.32Å; E264-D266 PolarHBondContact O-N 3.11Å; E264-A267 WeakPolarHBondContact O-CB 3.36Å; E264-A267 PolarHBondContact O-N 2.91Å; E264-A267 VanDerWaalsContact O-N 3.08Å; E264-E268 PolarHBondContact O-N 2.7Å
265	D	61.1	Low	64.7	Low	87 Å²	87	119.2 Å²	119.2	47%	0.465	57%	0.571	S	S	.	*	H	α-helix	trans	-59	-39.8	176.4	-129.4	45.4	0	0	0	112.5	E261 K269	E261-D265 VanDerWaalsContact O-CB 3.32Å; E261-D265 WeakPolarHBondContact O-CB 3.15Å; E261-D265 PolarHBondContact O-N 3.37Å; D265-K269 VanDerWaalsContact O-CD 3.23Å; D265-K269 WeakPolarHBondContact O-CD 3.46Å; D265-K269 VanDerWaalsContact O-CE 3.22Å; D265-K269 WeakPolarHBondContact O-CE 3.35Å; D265-K269 WeakPolarHBondContact O-CG 3.4Å; D265-K269 PolarHBondContact O-N 2.89Å; D265-K269 PolarHBondContact O-NZ 2.74Å; D265-K269 WeakPolarHBondContact OD2-CE 3.44Å; D265-K269 IonicContact OD2-NZ 2.72Å; D265-K269 PolarHBondContact OD2-NZ 3.38Å
266	D	58.1	Low	62.4	Low	103 Å²	103	118.4 Å²	118.4	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-78.2	-22.4	176.9	-76.4	-12.2	0	0	0	112.8	K262 E264 K269 N270	K262-D266 WeakPolarHBondContact O-CB 3.25Å; K262-D266 PolarHBondContact O-N 2.93Å; E264-D266 VanDerWaalsContact C-N 3.32Å; E264-D266 PolarHBondContact O-N 3.11Å; D266-K269 IonicContact OD1-NZ 2.76Å; D266-K269 PolarHBondContact OD1-NZ 3.2Å; D266-N270 WeakPolarHBondContact O-CB 3.41Å; D266-N270 PolarHBondContact O-N 2.92Å
267	A	62	Low	60	Low	53 Å²	53	116.5 Å²	116.5	44%	0.438	60%	0.596	S	S	.	*	H	α-helix	trans	-72.4	-46.1	169	0	0	0	0	0	111.4	A263 E264 K269 N270 E271	A263-A267 WeakPolarHBondContact O-CB 3.39Å; A263-A267 PolarHBondContact O-N 3.48Å; A263-A267 VanDerWaalsContact O-N 3.12Å; E264-A267 WeakPolarHBondContact O-CB 3.36Å; E264-A267 PolarHBondContact O-N 2.91Å; E264-A267 VanDerWaalsContact O-N 3.08Å; A267-K269 PolarHBondContact O-N 2.83Å; A267-N270 WeakPolarHBondContact O-CB 3.46Å; A267-N270 PolarHBondContact O-N 2.82Å; A267-E271 PolarHBondContact O-N 3.29Å
268	E	58.5	Low	58	Low	146 Å²	146	117.8 Å²	117.8	68%	0.682	61%	0.61	S	S	*	*	H	α-helix	trans	-60.5	-43	177.8	-69.9	-161	158	0	0	112	E264 N270 E271 E272	E264-E268 PolarHBondContact O-N 2.7Å; E268-N270 PolarHBondContact O-N 3.17Å; E268-E271 PolarHBondContact O-N 3.05Å; E268-E272 PolarHBondContact O-N 3.43Å
269	K	57.5	Low	55.8	Low	99 Å²	99	119.1 Å²	119.1	43%	0.43	62%	0.62	S	S	.	*	H	α-helix	trans	-63.1	-20.9	174.9	-67.9	161.6	-155.4	146.3	0	113.7	D265 D266 A267 R273	D265-K269 VanDerWaalsContact O-CD 3.23Å; D265-K269 WeakPolarHBondContact O-CD 3.46Å; D265-K269 VanDerWaalsContact O-CE 3.22Å; D265-K269 WeakPolarHBondContact O-CE 3.35Å; D265-K269 WeakPolarHBondContact O-CG 3.4Å; D265-K269 PolarHBondContact O-N 2.89Å; D265-K269 PolarHBondContact O-NZ 2.74Å; D265-K269 WeakPolarHBondContact OD2-CE 3.44Å; D265-K269 IonicContact OD2-NZ 2.72Å; D265-K269 PolarHBondContact OD2-NZ 3.38Å; D266-K269 IonicContact OD1-NZ 2.76Å; D266-K269 PolarHBondContact OD1-NZ 3.2Å; A267-K269 PolarHBondContact O-N 2.83Å; K269-R273 WeakPolarHBondContact O-CG 3.45Å
270	N	55.6	Low	53.8	Low	84 Å²	84	119.2 Å²	119.2	45%	0.449	64%	0.635	S	S	.	*	H	α-helix	trans	-91.3	-28.7	-179.8	-157.6	-0.7	0	0	0	112	D266 A267 E268 R274	D266-N270 WeakPolarHBondContact O-CB 3.41Å; D266-N270 PolarHBondContact O-N 2.92Å; A267-N270 WeakPolarHBondContact O-CB 3.46Å; A267-N270 PolarHBondContact O-N 2.82Å; E268-N270 PolarHBondContact O-N 3.17Å; N270-R274 PolarHBondContact O-NH1 3.48Å; N270-R274 PolarHBondContact OD1-NH1 2.92Å
271	E	54.3	Low	52.3	Low	135 Å²	135	123.9 Å²	123.9	63%	0.631	65%	0.649	S	S	*	*	H	α-helix	trans	-72.8	-44.1	169.2	-75.2	-65.8	140.4	0	0	111.7	A267 E268 R273 R274	A267-E271 PolarHBondContact O-N 3.29Å; E268-E271 PolarHBondContact O-N 3.05Å; E271-R273 PolarHBondContact O-N 3.46Å; E271-R273 VanDerWaalsContact O-N 3.15Å; E271-R274 PolarHBondContact O-N 3.14Å
272	E	46	Very low	50.7	Low	166 Å²	166	126.3 Å²	126.3	78%	0.776	66%	0.66	S	S	*	*	H	α-helix	trans	-60.8	-28.9	178.3	-168.2	172.9	-150.5	0	0	112.1	E268 R274	E268-E272 PolarHBondContact O-N 3.43Å; E272-R274 VanDerWaalsContact C-N 3.35Å; E272-R274 PolarHBondContact O-N 2.96Å
273	R	49.8	Very low	49.2	Very low	223 Å²	223	126.8 Å²	126.8	84%	0.842	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-6.5	173.9	-74.7	-177.8	169.9	-156.7	-1.9	115.2	K269 E271	K269-R273 WeakPolarHBondContact O-CG 3.45Å; E271-R273 PolarHBondContact O-N 3.46Å; E271-R273 VanDerWaalsContact O-N 3.15Å
274	R	48.6	Very low	47.3	Very low	170 Å²	170	126.9 Å²	126.9	64%	0.642	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	11.1	-177.9	-86.6	-168	177.7	74.5	2.8	115.6	N270 E271 E272 A276	N270-R274 PolarHBondContact O-NH1 3.48Å; N270-R274 PolarHBondContact OD1-NH1 2.92Å; E271-R274 PolarHBondContact O-N 3.14Å; E272-R274 VanDerWaalsContact C-N 3.35Å; E272-R274 PolarHBondContact O-N 2.96Å; R274-A276 PolarHBondContact O-N 2.73Å
275	S	41.3	Very low	45.6	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	70%	0.698	S	S	*	*			trans	-98.1	64.6	-177.4	-69	0	0	0	0	114.7
276	A	38	Very low	44.1	Very low	99 Å²	99	126.6 Å²	126.6	82%	0.818	72%	0.718	S	S	*	*			trans	-159.7	69.7	166.9	0	0	0	0	0	114.9	R274	R274-A276 PolarHBondContact O-N 2.73Å
277	S	35.4	Very low	42.9	Very low	123 Å²	123	130.2 Å²	130.2	86%	0.86	73%	0.725	S	S	*	*			trans	-164.8	130.5	144.4	-168.8	0	0	0	0	110.3
278	V	42.2	Very low	41.8	Very low	134 Å²	134	135.4 Å²	135.4	81%	0.812	75%	0.745	S	S	*	*			trans	-113	142.2	-179.3	-154.7	0	0	0	0	109.4
279	D	34.5	Very low	40.6	Very low	118 Å²	118	134 Å²	134	63%	0.631	74%	0.742	S	S	*	*			trans	74.8	108.9	155.1	-134.2	1.2	0	0	0	119.2	R281	D279-R281 WeakPolarHBondContact OD1-CD 3.39Å; D279-R281 WeakPolarHBondContact OD1-CG 3.49Å; D279-R281 IonicContact OD1-NE 2.81Å
280	S	37.2	Very low	39.5	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	76%	0.759	S	S	*	*				-148.4	141.3	119.5	60.1	0	0	0	0	110
281	R	42.9	Very low	38.4	Very low	190 Å²	190	138.8 Å²	138.8	72%	0.717	78%	0.78	S	S	*	*			trans	-114.2	149.6	-164.1	-83.3	162.7	159.5	-159.7	-3.2	112.6	D279	D279-R281 WeakPolarHBondContact OD1-CD 3.39Å; D279-R281 WeakPolarHBondContact OD1-CG 3.49Å; D279-R281 IonicContact OD1-NE 2.81Å
282	Q	37.6	Very low	37.3	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	79%	0.794	S	S	*	*			trans	66.8	155.4	156.7	-62	158.9	17.6	0	0	114.7
283	S	38.5	Very low	36.8	Very low	125 Å²	125	136.6 Å²	136.6	87%	0.874	80%	0.796	S	S	*	*			cis	-151.4	167.3	3.3	-164.2	0	0	0	0	106.1
284	G	29.6	Very low	36.4	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	80%	0.796	S	S	*	*			cis	-179.5	160.8	14.4	0	0	0	0	0	109
285	G	29	Very low	35.6	Very low	87 Å²	87	135.7 Å²	135.7	90%	0.897	80%	0.798	S	S	*	*			trans	-80.1	-179.8	-156.5	0	0	0	0	0	119.2
286	S	29.1	Very low	35.6	Very low	127 Å²	127	142 Å²	142	89%	0.888	81%	0.805	S	S	*	*			trans	-141	144.2	143.1	67.7	0	0	0	0	110.5
287	Y	33.4	Very low	35.6	Very low	180 Å²	180	146.7 Å²	146.7	71%	0.706	80%	0.802	S	S	*	*			trans	-85.7	143.5	-176.2	166	-102.7	0	0	0	110.7	D289	Y287-D289 WeakPolarHBondContact CE2-OD2 3.41Å; Y287-D289 PolarHBondContact OH-OD2 2.95Å
288	L	38.3	Very low	35.5	Very low	162 Å²	162	148 Å²	148	85%	0.848	80%	0.8	S	S	*	*			trans	-166.5	137.9	132.4	-101.7	176	0	0	0	111.7
289	D	33.8	Very low	35	Very low	116 Å²	116	153.7 Å²	153.7	62%	0.62	81%	0.806	S	S	*	*			trans	-76.4	146.5	-177.3	-86.6	-60.9	0	0	0	114.3	Y287	Y287-D289 WeakPolarHBondContact CE2-OD2 3.41Å; Y287-D289 PolarHBondContact OH-OD2 2.95Å
290	A	33.5	Very low	35.1	Very low	97 Å²	97	153.6 Å²	153.6	80%	0.802	82%	0.815	S	S	*	*			trans	-158.9	71.5	152.1	0	0	0	0	0	111.9
291	E	32.6	Very low	35	Very low	187 Å²	187	159 Å²	159	87%	0.874	82%	0.816	S	S	*	*			trans	32.2	104.5	151.8	-60.1	-170.1	136.6	0	0	120.6	S293	E291-S293 PolarHBondContact O-N 3.13Å
292	C	32.3	Very low	34.6	Very low	137 Å²	137	155.8 Å²	155.8	93%	0.926	82%	0.823	S	S	*	*			trans	-73.5	119.9	153.2	-77.5	0	0	0	0	111.6
293	S	36.2	Very low	35	Very low	118 Å²	118	152.9 Å²	152.9	83%	0.825	82%	0.819	S	S	*	*			trans	-113.3	111.2	158.6	-167.9	0	0	0	0	111.9	E291	E291-S293 PolarHBondContact O-N 3.13Å
294	R	39.5	Very low	34.7	Very low	225 Å²	225	154.4 Å²	154.4	85%	0.849	81%	0.812	S	S	*	*			trans	-59.4	142.4	173.2	-57.4	161.3	174.2	144	-2.7	110
295	H	33.7	Very low	35.1	Very low	148 Å²	148	159.1 Å²	159.1	69%	0.685	82%	0.815	S	S	*	*			trans	-159.7	114.8	137.6	-112.3	62.8	0	0	0	112.9
296	R	41.1	Very low	35.4	Very low	241 Å²	241	165.7 Å²	165.7	91%	0.909	81%	0.812	S	S	*	*			trans	-76.1	137.5	154.3	-72.9	-177.6	173.5	-173.9	-1.5	108.3
297	R	37.9	Very low	35.8	Very low	198 Å²	198	169 Å²	169	75%	0.747	81%	0.81	S	S	*	*			trans	-164.9	108.5	154.1	-101.9	164.5	-158.4	176.8	8.6	106.7
298	D	32.7	Very low	35.7	Very low	151 Å²	151	170.3 Å²	170.3	81%	0.807	81%	0.814	S	S	*	*				84.6	114.3	83.2	-87.6	-52.1	0	0	0	113.5	S300	D298-S300 PolarHBondContact O-N 2.83Å; D298-S300 VanDerWaalsContact O-N 3.08Å
299	R	32.4	Very low	35.5	Very low	253 Å²	253	169.9 Å²	169.9	96%	0.955	81%	0.813	S	S	*	*			trans	-67.8	100.1	168	-82.3	177.7	166.1	169.3	-4	109.2	R301	R299-R301 PolarHBondContact O-N 2.99Å
300	S	36.5	Very low	35.7	Very low	117 Å²	117	171.1 Å²	171.1	82%	0.818	81%	0.813	S	S	*	*			trans	-67.4	104.3	172.2	44.9	0	0	0	0	111.4	D298	D298-S300 PolarHBondContact O-N 2.83Å; D298-S300 VanDerWaalsContact O-N 3.08Å
301	R	34.3	Very low	36	Very low	238 Å²	238	172.1 Å²	172.1	90%	0.898	81%	0.805	S	S	*	*			trans	-53.4	143.6	153.2	-87.5	173.9	162.7	165.3	-4.6	109.5	R299	R299-R301 PolarHBondContact O-N 2.99Å
302	S	35.8	Very low	36.4	Very low	123 Å²	123	169.7 Å²	169.7	86%	0.86	79%	0.791	S	S	*	*			trans	-146.3	134.4	144.1	-88.6	0	0	0	0	111.5
303	P	45.8	Very low	36.6	Very low	115 Å²	115	171.1 Å²	171.1	75%	0.747	79%	0.789	S	S	*	*			trans	-120.4	147.1	-174.2	38.7	-27.4	0	0	0	113.9
304	H	32.3	Very low	36.8	Very low	157 Å²	157	174.4 Å²	174.4	73%	0.727	79%	0.789	S	S	*	*			trans	-156	156.1	141.7	-135.4	-101.1	0	0	0	118.3
305	K	37.2	Very low	36.5	Very low	165 Å²	165	170.3 Å²	170.3	72%	0.717	78%	0.784	S	S	*	*			trans	-90	170.4	-159.8	-51.5	159.7	178.3	165.6	0	115.9
306	R	35.4	Very low	36.3	Very low	225 Å²	225	168.1 Å²	168.1	85%	0.849	78%	0.784	S	S	*	*			trans	114.7	139.9	154.4	-69.1	162.2	175.5	174.7	-0.5	113.4
307	K	38.1	Very low	35.8	Very low	195 Å²	195	164.3 Å²	164.3	85%	0.848	78%	0.777	S	S	*	*			cis	-140.2	132.4	-11.2	-93.5	171.4	176.2	176.2	0	106.5
308	R	31.3	Very low	35.6	Very low	208 Å²	208	159.1 Å²	159.1	79%	0.785	77%	0.771	S	S	*	*				55.2	104.5	83.4	-165.1	-174.4	-164.5	-178.1	8.2	116.8
309	N	34.2	Very low	35.8	Very low	153 Å²	153	162.8 Å²	162.8	82%	0.818	77%	0.773	S	S	*	*			trans	-156.6	124.6	130.9	-82.9	-28.8	0	0	0	105.1
310	K	37.3	Very low	36	Very low	143 Å²	143	162.7 Å²	162.7	62%	0.622	77%	0.773	S	S	*	*				65.7	109.7	50.3	-160.7	-171.8	174.6	-168.8	0	108.9
311	D	38.5	Very low	36.1	Very low	118 Å²	118	169 Å²	169	63%	0.631	78%	0.779	S	S	*	*				-145.8	173.3	51.9	-84.1	-72.1	0	0	0	111.6
312	K	41	Very low	36.2	Very low	136 Å²	136	167.3 Å²	167.3	59%	0.591	78%	0.778	S	S	*	*			cis	-178.1	105.6	-26.3	172.9	-166.1	-91	113.6	0	107.7	K314	K312-K314 HydrophobicContact CD-CG 4.32Å
313	D	38	Very low	36.1	Very low	166 Å²	166	170.2 Å²	170.2	89%	0.888	78%	0.778	S	S	*	*			trans	-66.7	145.3	163.9	-72.3	-58	0	0	0	110.9
314	K	39.4	Very low	35.7	Very low	188 Å²	188	176.2 Å²	176.2	82%	0.817	79%	0.786	S	S	*	*			trans	-124.5	118.6	168.7	-91.7	-169	171.8	-174.1	0	111	K312	K312-K314 HydrophobicContact CD-CG 4.32Å
315	N	33	Very low	36	Very low	138 Å²	138	176.2 Å²	176.2	74%	0.738	79%	0.791	S	S	*	*			trans	-58.9	151.5	-176.6	-169.3	26	0	0	0	113.7
316	C	30.8	Very low	35.9	Very low	103 Å²	103	172.2 Å²	172.2	70%	0.696	80%	0.797	S	S	*	*			trans	-62.8	130.1	155.9	174.9	0	0	0	0	109.3
317	E	30.9	Very low	36	Very low	160 Å²	160	168.4 Å²	168.4	75%	0.748	79%	0.788	S	S	*	*			trans	-173.3	119.1	131	-107.1	174	135.5	0	0	115.6
318	S	32.6	Very low	36.1	Very low	90 Å²	90	168 Å²	168	63%	0.629	78%	0.782	S	S	*	*				84.4	145.9	129	91.5	0	0	0	0	121.6
319	R	36.2	Very low	36.3	Very low	228 Å²	228	165.5 Å²	165.5	86%	0.86	78%	0.779	S	S	*	*			trans	69.2	91.6	151.4	-63.2	163.4	-167.4	-160.4	3.8	118.6
320	R	37.1	Very low	36.7	Very low	251 Å²	251	166.5 Å²	166.5	95%	0.947	78%	0.778	S	S	*	*				-173.3	95.2	120	-99.8	163.9	-169.7	-165.5	4.1	111.7
321	R	38.3	Very low	36.8	Very low	250 Å²	250	163.6 Å²	163.6	94%	0.943	78%	0.776	S	S	*	*			trans	-153.4	90.7	155.7	-114.9	179.1	-170.1	-162.9	2	112.1
322	K	37.2	Very low	37.1	Very low	202 Å²	202	166.6 Å²	166.6	88%	0.878	79%	0.785	S	S	*	*			trans	32.6	118.3	135.8	-157.6	167.7	-174.3	174.2	0	118.3
323	E	34	Very low	37.3	Very low	183 Å²	183	170.3 Å²	170.3	86%	0.855	80%	0.802	S	S	*	*			trans	-55.2	144.8	166.8	-56.6	158.6	142.3	0	0	112.6
324	R	36.6	Very low	37.8	Very low	241 Å²	241	173.8 Å²	173.8	91%	0.909	80%	0.802	S	S	*	*				-167	152.1	126.3	-111.2	179.3	-170.1	-154.8	-0.7	113.1
325	D	39.3	Very low	38.2	Very low	158 Å²	158	174.9 Å²	174.9	85%	0.845	80%	0.801	S	S	*	*			trans	-45.1	156.3	-173.4	-56	-78.9	0	0	0	118.5
326	G	35.8	Very low	38.8	Very low	81 Å²	81	178 Å²	178	84%	0.835	81%	0.809	S	S	*	*			trans	-175.5	67.5	173.9	0	0	0	0	0	112.5
327	E	37.5	Very low	39.5	Very low	144 Å²	144	180.2 Å²	180.2	67%	0.673	81%	0.808	S	S	*	*			trans	-67.9	145.5	-179.5	-94.5	-159	127.7	0	0	115
328	R	38.9	Very low	40.1	Very low	186 Å²	186	181.5 Å²	181.5	70%	0.702	81%	0.812	S	S	*	*			trans	68.1	128.8	144.6	-64	174.4	-162.7	-158.2	10.2	122
329	H	36.8	Very low	40.5	Very low	156 Å²	156	188.5 Å²	188.5	72%	0.722	84%	0.839	S	S	*	*			trans	21.7	134.5	135	-48	-72.1	0	0	0	119.6
330	H	40.8	Very low	40.7	Very low	175 Å²	175	186.5 Å²	186.5	81%	0.81	84%	0.838	S	S	*	*				-165.9	158.8	72.4	-103	-73.4	0	0	0	117.4
331	S	40.3	Very low	40.9	Very low	82 Å²	82	183.1 Å²	183.1	57%	0.573	83%	0.833	S	S	*	*			trans	-38.6	143.4	169.4	48.3	0	0	0	0	121
332	H	44.5	Very low	41.1	Very low	180 Å²	180	179.4 Å²	179.4	83%	0.833	83%	0.827	S	S	*	*			trans	38.5	130.3	136.7	-62.6	-70.7	0	0	0	122.2
333	K	46.5	Very low	41.3	Very low	215 Å²	215	178.1 Å²	178.1	94%	0.935	82%	0.823	S	S	*	*				-151.4	138.5	122	-115.5	166.3	-173.7	173.7	0	112.8
334	R	47.3	Very low	41.7	Very low	238 Å²	238	177.8 Å²	177.8	90%	0.898	82%	0.821	S	S	*	*			trans	-95	134.7	176.6	-94.5	179.2	163.3	-175.3	-3.7	110.8
335	R	49.2	Very low	42.1	Very low	211 Å²	211	173.5 Å²	173.5	80%	0.796	82%	0.816	S	S	*	*				51.8	119.8	129.8	-159.3	-172.7	-158.4	-167.4	7.4	120.8
336	K	45.1	Very low	42.3	Very low	205 Å²	205	174.6 Å²	174.6	89%	0.891	81%	0.814	S	S	*	*			trans	-149.7	110.9	131.2	-90.4	-174.3	176.2	-177.6	0	106
337	Q	45.3	Very low	42.8	Very low	148 Å²	148	181.8 Å²	181.8	69%	0.692	81%	0.812	S	S	*	*				52.7	111.6	86.1	-102.7	-171.8	-4.1	0	0	116
338	K	43.3	Very low	43.2	Very low	187 Å²	187	185 Å²	185	81%	0.813	82%	0.823	S	S	*	*			trans	40.2	125.3	147	-64.9	-171.4	173.3	-169.2	0	119.7
339	I	40.9	Very low	43.6	Very low	237 Å²	237	184.9 Å²	184.9	100%	1.215	84%	0.835	S	S	*	*				-113.1	0	91.6	-77.2	168.9	0	0	0	106.6

Retrieved 339 of 339 residues in 233.3 ms (Link to these results)

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