G4VHF0_SCHMA Loading...

Putative gtp-binding protein (I) alpha-2 subunit, gnai2 AlphaSync

AlphaFold DB , UniProt , Accession G4VHF0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 353 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	71.2	Confident	240 Å²	240	126.9 Å²	126.9	100%	1.182	68%	0.682	S	S	*	*				0	104.7	0	-73.2	-147.6	-106	0	0	108.5	C3	M1-C3 PolarHBondContact O-N 2.88Å
2	G	52.8	Low	72.4	Confident	68 Å²	68	120.3 Å²	120.3	70%	0.701	66%	0.658	S	S	*	*			trans	-75.3	105.1	175.3	0	0	0	0	0	109	F4	G2-F4 VanDerWaalsContact C-N 3.33Å; G2-F4 PolarHBondContact O-N 3.24Å
3	C	55.5	Low	73.6	Confident	123 Å²	123	117.7 Å²	117.7	83%	0.831	64%	0.641	S	S	*	*			trans	-63.6	96.9	171.1	-90.8	0	0	0	0	108.5	M1 V5	M1-C3 PolarHBondContact O-N 2.88Å; C3-V5 PolarHBondContact O-N 3.05Å
4	F	62.9	Low	74.7	Confident	207 Å²	207	112.8 Å²	112.8	91%	0.908	62%	0.624	S	S	*	*			trans	-60.7	104.8	168.2	-84.6	-90.9	0	0	0	108	G2 S6	G2-F4 VanDerWaalsContact C-N 3.33Å; G2-F4 PolarHBondContact O-N 3.24Å; F4-S6 PolarHBondContact O-N 2.95Å
5	V	69.1	Low	75.7	Confident	73 Å²	73	116 Å²	116	44%	0.442	62%	0.623	S	S	.	*			trans	-66.6	118.8	169.4	-174	0	0	0	0	106.4	C3 K9 L10	C3-V5 PolarHBondContact O-N 3.05Å; V5-K9 HydrophobicContact CG1-CB 3.51Å; V5-K9 HydrophobicContact CG1-CD 4.42Å; V5-L10 HydrophobicContact CB-CD2 4.4Å; V5-L10 HydrophobicContact CB-CG 4.28Å; V5-L10 HydrophobicContact CG1-CD2 3.97Å; V5-L10 HydrophobicContact CG1-CG 3.8Å
6	S	79.5	Confident	76.6	Confident	50 Å²	50	112.5 Å²	112.5	35%	0.35	61%	0.61	S	S	.	*			trans	-60.2	149.6	178.3	64.3	0	0	0	0	110.5	F4 E8 K9 L10	F4-S6 PolarHBondContact O-N 2.95Å; S6-E8 PolarHBondContact O-N 3.14Å; S6-E8 VanDerWaalsContact O-N 3.14Å; S6-K9 WeakPolarHBondContact O-CB 3.5Å; S6-K9 PolarHBondContact O-N 3.25Å; S6-K9 WeakPolarHBondContact OG-CG 3.48Å; S6-K9 PolarHBondContact OG-N 3.3Å; S6-L10 PolarHBondContact O-N 2.97Å
7	K	83.3	Confident	77.4	Confident	191 Å²	191	114.1 Å²	114.1	83%	0.83	61%	0.61	S	S	*	*	H	α-helix	trans	-52.3	-36.2	175.8	-73.1	-175.1	177.1	-179.2	0	111.9	L10 A11	K7-L10 PolarHBondContact O-N 2.98Å; K7-A11 WeakPolarHBondContact O-CB 3.4Å; K7-A11 PolarHBondContact O-N 3.06Å
8	E	83.3	Confident	78.1	Confident	159 Å²	159	112.9 Å²	112.9	74%	0.743	60%	0.604	S	S	*	*	H	α-helix	trans	-64	-42.7	175.1	-67.8	177.4	168.5	0	0	113	S6 A11 A12	S6-E8 PolarHBondContact O-N 3.14Å; S6-E8 VanDerWaalsContact O-N 3.14Å; E8-A11 PolarHBondContact O-N 3.36Å; E8-A12 WeakPolarHBondContact O-CB 3.47Å; E8-A12 PolarHBondContact O-N 3.34Å
9	K	84.1	Confident	78.6	Confident	138 Å²	138	112.1 Å²	112.1	60%	0.6	60%	0.598	S	S	*	*	H	α-helix	trans	-64.7	-40.6	175.2	-81.5	-176.5	177.7	-177	0	111.7	V5 S6 A12 I13	V5-K9 HydrophobicContact CG1-CB 3.51Å; V5-K9 HydrophobicContact CG1-CD 4.42Å; S6-K9 WeakPolarHBondContact O-CB 3.5Å; S6-K9 PolarHBondContact O-N 3.25Å; S6-K9 WeakPolarHBondContact OG-CG 3.48Å; S6-K9 PolarHBondContact OG-N 3.3Å; K9-A12 PolarHBondContact O-N 3.41Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.27Å; K9-I13 PolarHBondContact O-N 2.86Å
10	L	85.3	Confident	79	Confident	101 Å²	101	111.1 Å²	111.1	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-62.1	-43.9	174.4	-72.3	171.1	0	0	0	111.6	V5 S6 K7 A12 I13 A14	V5-L10 HydrophobicContact CB-CD2 4.4Å; V5-L10 HydrophobicContact CB-CG 4.28Å; V5-L10 HydrophobicContact CG1-CD2 3.97Å; V5-L10 HydrophobicContact CG1-CG 3.8Å; S6-L10 PolarHBondContact O-N 2.97Å; K7-L10 PolarHBondContact O-N 2.98Å; L10-A12 VanDerWaalsContact C-N 3.34Å; L10-A12 PolarHBondContact O-N 2.94Å; L10-I13 PolarHBondContact O-N 3.3Å; L10-A14 WeakPolarHBondContact O-CB 3.46Å; L10-A14 PolarHBondContact O-N 3.01Å
11	A	86.9	Confident	79.3	Confident	46 Å²	46	115.2 Å²	115.2	38%	0.38	60%	0.6	S	S	.	*	H	α-helix	trans	-66.2	-33.8	176	0	0	0	0	0	112.9	K7 E8 R15	K7-A11 WeakPolarHBondContact O-CB 3.4Å; K7-A11 PolarHBondContact O-N 3.06Å; E8-A11 PolarHBondContact O-N 3.36Å; A11-R15 WeakPolarHBondContact O-CB 3.49Å; A11-R15 WeakPolarHBondContact O-CG 3.46Å; A11-R15 PolarHBondContact O-N 2.89Å; A11-R15 PolarHBondContact O-NE 2.99Å
12	A	86.6	Confident	81.4	Confident	48 Å²	48	110.6 Å²	110.6	40%	0.397	57%	0.574	S	S	.	*	H	α-helix	trans	-68.3	-43.2	174	0	0	0	0	0	112.1	E8 K9 L10 R15 S16	E8-A12 WeakPolarHBondContact O-CB 3.47Å; E8-A12 PolarHBondContact O-N 3.34Å; K9-A12 PolarHBondContact O-N 3.41Å; L10-A12 VanDerWaalsContact C-N 3.34Å; L10-A12 PolarHBondContact O-N 2.94Å; A12-R15 PolarHBondContact O-N 2.97Å; A12-S16 PolarHBondContact O-N 3.37Å
13	I	87.8	Confident	82.7	Confident	86 Å²	86	112.6 Å²	112.6	44%	0.441	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-42.5	176	-67.5	163.4	0	0	0	110.8	K9 L10 S16 K17	K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.27Å; K9-I13 PolarHBondContact O-N 2.86Å; L10-I13 PolarHBondContact O-N 3.3Å; I13-S16 PolarHBondContact O-N 3.49Å; I13-K17 HydrophobicContact CG2-CD 4.44Å; I13-K17 WeakPolarHBondContact O-CG 3.37Å; I13-K17 PolarHBondContact O-N 3.38Å
14	A	88.2	Confident	83.7	Confident	49 Å²	49	113.3 Å²	113.3	41%	0.405	56%	0.557	S	S	.	*	H	α-helix	trans	-61.4	-47.6	176.1	0	0	0	0	0	111.5	L10 S16 K17 D18	L10-A14 WeakPolarHBondContact O-CB 3.46Å; L10-A14 PolarHBondContact O-N 3.01Å; A14-S16 PolarHBondContact O-N 3.38Å; A14-K17 PolarHBondContact O-N 3.43Å; A14-D18 PolarHBondContact O-N 3.17Å
15	R	90.1	Very high	84.3	Confident	161 Å²	161	105.8 Å²	105.8	61%	0.608	53%	0.532	S	S	*	.	H	α-helix	trans	-60	-42.2	175.2	-77.4	-176	-70.9	-174.6	0.3	112.8	A11 A12 D18 I19	A11-R15 WeakPolarHBondContact O-CB 3.49Å; A11-R15 WeakPolarHBondContact O-CG 3.46Å; A11-R15 PolarHBondContact O-N 2.89Å; A11-R15 PolarHBondContact O-NE 2.99Å; A12-R15 PolarHBondContact O-N 2.97Å; R15-D18 PolarHBondContact O-N 2.91Å; R15-I19 WeakPolarHBondContact O-CD1 3.45Å; R15-I19 VanDerWaalsContact O-CG1 3.23Å; R15-I19 WeakPolarHBondContact O-CG1 3.35Å; R15-I19 PolarHBondContact O-N 3.38Å
16	S	90.2	Very high	84.5	Confident	60 Å²	60	107.1 Å²	107.1	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-48	176.8	-167.7	0	0	0	0	111.3	A12 I13 A14 D18 I19 D20	A12-S16 PolarHBondContact O-N 3.37Å; I13-S16 PolarHBondContact O-N 3.49Å; A14-S16 PolarHBondContact O-N 3.38Å; S16-D18 VanDerWaalsContact C-N 3.31Å; S16-D18 PolarHBondContact O-N 2.95Å; S16-I19 WeakPolarHBondContact O-CB 3.49Å; S16-I19 PolarHBondContact O-N 3.34Å; S16-D20 PolarHBondContact O-N 3.3Å
17	K	90	Very high	84	Confident	139 Å²	139	105.9 Å²	105.9	60%	0.604	53%	0.532	S	S	*	.	H	α-helix	trans	-62.4	-37.3	177.6	-73.3	-177.1	178.1	-174.3	0	112.7	I13 A14 D20 R21	I13-K17 HydrophobicContact CG2-CD 4.44Å; I13-K17 WeakPolarHBondContact O-CG 3.37Å; I13-K17 PolarHBondContact O-N 3.38Å; A14-K17 PolarHBondContact O-N 3.43Å; K17-D20 PolarHBondContact O-N 2.84Å; K17-R21 VanDerWaalsContact O-CB 3.29Å; K17-R21 WeakPolarHBondContact O-CB 3.31Å; K17-R21 PolarHBondContact O-N 2.91Å
18	D	90.5	Very high	83.2	Confident	94 Å²	94	101.7 Å²	101.7	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-68.3	-37.8	175.7	-74.4	-18.2	0	0	0	111.8	A14 R15 S16 K22	A14-D18 PolarHBondContact O-N 3.17Å; R15-D18 PolarHBondContact O-N 2.91Å; S16-D18 VanDerWaalsContact C-N 3.31Å; S16-D18 PolarHBondContact O-N 2.95Å; D18-K22 WeakPolarHBondContact O-CB 3.46Å; D18-K22 WeakPolarHBondContact O-CG 3.3Å; D18-K22 PolarHBondContact O-N 3.49Å
19	I	87.8	Confident	82.5	Confident	97 Å²	97	97 Å²	97	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-49.2	172.5	-69.3	163.6	0	0	0	109.9	R15 S16 R21 K22 L23	R15-I19 WeakPolarHBondContact O-CD1 3.45Å; R15-I19 VanDerWaalsContact O-CG1 3.23Å; R15-I19 WeakPolarHBondContact O-CG1 3.35Å; R15-I19 PolarHBondContact O-N 3.38Å; S16-I19 WeakPolarHBondContact O-CB 3.49Å; S16-I19 PolarHBondContact O-N 3.34Å; I19-R21 VanDerWaalsContact C-N 3.28Å; I19-R21 PolarHBondContact O-N 3.33Å; I19-K22 PolarHBondContact O-N 2.8Å; I19-K22 VanDerWaalsContact O-N 3.13Å; I19-L23 HydrophobicContact CG2-CD1 3.74Å; I19-L23 HydrophobicContact CG2-CG 4.15Å; I19-L23 WeakPolarHBondContact O-CB 3.23Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.49Å; I19-L23 PolarHBondContact O-N 3.13Å
20	D	87.1	Confident	81.6	Confident	92 Å²	92	93.8 Å²	93.8	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-60	-39.9	179	-63.4	-30.2	0	0	0	111.5	S16 K17 K24	S16-D20 PolarHBondContact O-N 3.3Å; K17-D20 PolarHBondContact O-N 2.84Å; D20-K24 WeakPolarHBondContact O-CB 3.29Å; D20-K24 PolarHBondContact O-N 3.31Å
21	R	85	Confident	80.6	Confident	198 Å²	198	95.1 Å²	95.1	75%	0.747	50%	0.501	S	S	*	.	H	α-helix	trans	-66.9	-40.5	176	-171.9	179.2	-179.8	-174.6	0.4	112.1	K17 I19 A25	K17-R21 VanDerWaalsContact O-CB 3.29Å; K17-R21 WeakPolarHBondContact O-CB 3.31Å; K17-R21 PolarHBondContact O-N 2.91Å; I19-R21 VanDerWaalsContact C-N 3.28Å; I19-R21 PolarHBondContact O-N 3.33Å; R21-A25 WeakPolarHBondContact O-CB 3.35Å; R21-A25 PolarHBondContact O-N 2.87Å
22	K	84	Confident	80.2	Confident	142 Å²	142	99.5 Å²	99.5	62%	0.617	51%	0.511	S	S	*	.	H	α-helix	trans	-66.2	-47.2	174.7	-77.9	179.8	-179.8	-176.2	0	111.3	D18 I19 K24 A25 D26	D18-K22 WeakPolarHBondContact O-CB 3.46Å; D18-K22 WeakPolarHBondContact O-CG 3.3Å; D18-K22 PolarHBondContact O-N 3.49Å; I19-K22 PolarHBondContact O-N 2.8Å; I19-K22 VanDerWaalsContact O-N 3.13Å; K22-K24 VanDerWaalsContact C-N 3.27Å; K22-K24 PolarHBondContact O-N 2.93Å; K22-A25 CarbonylContact O-C 3.57Å; K22-A25 PolarHBondContact O-N 2.82Å; K22-A25 VanDerWaalsContact O-N 3.09Å; K22-D26 VanDerWaalsContact O-CB 3.3Å; K22-D26 WeakPolarHBondContact O-CB 3.36Å; K22-D26 PolarHBondContact O-N 3.09Å
23	L	80.1	Confident	80.3	Confident	110 Å²	110	100.1 Å²	100.1	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-58.3	-40.4	176.2	-70.9	173.1	0	0	0	111.9	I19 G27	I19-L23 HydrophobicContact CG2-CD1 3.74Å; I19-L23 HydrophobicContact CG2-CG 4.15Å; I19-L23 WeakPolarHBondContact O-CB 3.23Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.49Å; I19-L23 PolarHBondContact O-N 3.13Å; L23-G27 PolarHBondContact O-N 2.96Å
24	K	76.3	Confident	80.4	Confident	139 Å²	139	96 Å²	96	60%	0.604	49%	0.485	S	S	*	.	H	α-helix	trans	-66	-44.7	174.4	-173.4	175.4	177.2	179.3	0	112	D20 K22 G27 E28	D20-K24 WeakPolarHBondContact O-CB 3.29Å; D20-K24 PolarHBondContact O-N 3.31Å; K22-K24 VanDerWaalsContact C-N 3.27Å; K22-K24 PolarHBondContact O-N 2.93Å; K24-G27 PolarHBondContact O-N 2.73Å; K24-E28 WeakPolarHBondContact CE-OE1 3.42Å; K24-E28 WeakPolarHBondContact O-CB 3.28Å; K24-E28 WeakPolarHBondContact O-CG 3.35Å; K24-E28 PolarHBondContact O-N 3.45Å
25	A	74.9	Confident	80.6	Confident	48 Å²	48	95 Å²	95	40%	0.397	47%	0.471	S	S	.	.	H	α-helix	trans	-66.4	-39.1	177.9	0	0	0	0	0	112.5	R21 K22 E28 A29	R21-A25 WeakPolarHBondContact O-CB 3.35Å; R21-A25 PolarHBondContact O-N 2.87Å; K22-A25 CarbonylContact O-C 3.57Å; K22-A25 PolarHBondContact O-N 2.82Å; K22-A25 VanDerWaalsContact O-N 3.09Å; A25-E28 PolarHBondContact O-N 3.38Å; A25-A29 VanDerWaalsContact O-CB 3.28Å; A25-A29 WeakPolarHBondContact O-CB 3.21Å; A25-A29 PolarHBondContact O-N 2.87Å
26	D	73.9	Confident	80.9	Confident	102 Å²	102	87.3 Å²	87.3	55%	0.545	44%	0.442	S	S	.	.	H	α-helix	trans	-67.9	-39.8	176.3	-67.4	-16.9	0	0	0	110.3	K22 A29 S30	K22-D26 VanDerWaalsContact O-CB 3.3Å; K22-D26 WeakPolarHBondContact O-CB 3.36Å; K22-D26 PolarHBondContact O-N 3.09Å; D26-A29 PolarHBondContact O-N 3.42Å; D26-S30 WeakPolarHBondContact O-CB 3.11Å; D26-S30 PolarHBondContact O-N 3.36Å
27	G	68.4	Low	81.2	Confident	23 Å²	23	84.5 Å²	84.5	24%	0.237	42%	0.422	C	S	.	.	H	α-helix	trans	-59.9	-51.4	169.8	0	0	0	0	0	111.6	L23 K24 A29 S30 F31	L23-G27 PolarHBondContact O-N 2.96Å; K24-G27 PolarHBondContact O-N 2.73Å; G27-A29 VanDerWaalsContact C-N 3.31Å; G27-A29 PolarHBondContact O-N 2.81Å; G27-S30 PolarHBondContact O-N 2.86Å; G27-F31 VanDerWaalsContact C-CE2 3.42Å; G27-F31 WeakPolarHBondContact O-CD2 2.96Å; G27-F31 WeakPolarHBondContact O-CE2 3.23Å; G27-F31 VanDerWaalsContact O-CG 3.23Å; G27-F31 WeakPolarHBondContact O-CG 3.19Å; G27-F31 PolarHBondContact O-N 2.71Å
28	E	67.7	Low	81.5	Confident	103 Å²	103	77.9 Å²	77.9	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-58.2	-39.2	176.6	-76.4	176.3	-168	0	0	113.4	K24 A25	K24-E28 WeakPolarHBondContact CE-OE1 3.42Å; K24-E28 WeakPolarHBondContact O-CB 3.28Å; K24-E28 WeakPolarHBondContact O-CG 3.35Å; K24-E28 PolarHBondContact O-N 3.45Å; A25-E28 PolarHBondContact O-N 3.38Å
29	A	66.7	Low	81.9	Confident	61 Å²	61	73.4 Å²	73.4	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-71.5	-41.3	175.8	0	0	0	0	0	111.9	A25 D26 G27 F31 K32	A25-A29 VanDerWaalsContact O-CB 3.28Å; A25-A29 WeakPolarHBondContact O-CB 3.21Å; A25-A29 PolarHBondContact O-N 2.87Å; D26-A29 PolarHBondContact O-N 3.42Å; G27-A29 VanDerWaalsContact C-N 3.31Å; G27-A29 PolarHBondContact O-N 2.81Å; A29-F31 VanDerWaalsContact C-N 3.26Å; A29-F31 PolarHBondContact O-N 3.06Å; A29-K32 PolarHBondContact O-N 3.36Å
30	S	65.2	Low	82.3	Confident	71 Å²	71	68.8 Å²	68.8	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-32	176.3	-174.2	0	0	0	0	112	D26 G27 K32 E33	D26-S30 WeakPolarHBondContact O-CB 3.11Å; D26-S30 PolarHBondContact O-N 3.36Å; G27-S30 PolarHBondContact O-N 2.86Å; S30-K32 PolarHBondContact O-N 3.38Å; S30-E33 PolarHBondContact O-N 3.01Å
31	F	65.6	Low	82.8	Confident	128 Å²	128	64.7 Å²	64.7	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-66.9	-25	175.1	-60	-48.6	0	0	0	113.2	G27 A29	G27-F31 VanDerWaalsContact C-CE2 3.42Å; G27-F31 WeakPolarHBondContact O-CD2 2.96Å; G27-F31 WeakPolarHBondContact O-CE2 3.23Å; G27-F31 VanDerWaalsContact O-CG 3.23Å; G27-F31 WeakPolarHBondContact O-CG 3.19Å; G27-F31 PolarHBondContact O-N 2.71Å; A29-F31 VanDerWaalsContact C-N 3.26Å; A29-F31 PolarHBondContact O-N 3.06Å
32	K	79.1	Confident	83.2	Confident	138 Å²	138	55.9 Å²	55.9	60%	0.6	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	5.9	173.6	-64.1	-175.2	-178.4	179.1	0	111.8	A29 S30 L193 S194	A29-K32 PolarHBondContact O-N 3.36Å; S30-K32 PolarHBondContact O-N 3.38Å; K32-L193 CarbonylContact O-C 3.52Å; K32-L193 WeakPolarHBondContact O-CA 3.07Å; K32-L193 WeakPolarHBondContact O-CD1 3.46Å; K32-S194 WeakPolarHBondContact O-CB 3.48Å; K32-S194 PolarHBondContact O-N 2.73Å
33	E	87.5	Confident	83.7	Confident	61 Å²	61	52.1 Å²	52.1	29%	0.285	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.7	178.9	-163.1	176.9	-140.3	0	0	111.6	S30 S194 R196	S30-E33 PolarHBondContact O-N 3.01Å; E33-S194 CarbonylContact C-O 3.54Å; E33-S194 VanDerWaalsContact CA-O 3.24Å; E33-S194 WeakPolarHBondContact CA-O 3.46Å; E33-R196 VanDerWaalsContact CD-CZ 3.48Å; E33-R196 VanDerWaalsContact CD-NH2 3.34Å; E33-R196 HydrophobicContact CG-CG 4.34Å; E33-R196 WeakPolarHBondContact OE1-CD 3.49Å; E33-R196 WeakPolarHBondContact OE1-CG 3.41Å; E33-R196 IonicContact OE1-CZ 3.34Å; E33-R196 IonicContact OE1-NE 3.75Å; E33-R196 PolarHBondContact OE1-NE 3.19Å; E33-R196 IonicContact OE1-NH2 2.73Å; E33-R196 IonicContact OE2-CZ 2.66Å; E33-R196 VanDerWaalsContact OE2-CZ 3.25Å; E33-R196 IonicContact OE2-NE 2.7Å; E33-R196 PolarHBondContact OE2-NE 2.69Å; E33-R196 IonicContact OE2-NH2 3.54Å; E33-R196 PolarHBondContact OE2-NH2 3.01Å
34	A	90.5	Very high	84.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.5	173.7	0	0	0	0	0	110.7	L193 S194 I195 R196 T218	A34-L193 HydrophobicContact CB-CD1 4.31Å; A34-L193 HydrophobicContact CB-CD2 3.61Å; A34-L193 HydrophobicContact CB-CG 4.05Å; A34-S194 PolarHBondContact N-O 3.15Å; A34-I195 WeakPolarHBondContact O-CA 3.32Å; A34-R196 PolarHBondContact O-N 3.34Å; A34-T218 WeakPolarHBondContact CA-OG1 3.39Å; A34-T218 HydrophobicContact CB-CG2 4.13Å
35	K	93.2	Very high	85.5	Confident	27 Å²	27	40.9 Å²	40.9	12%	0.117	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	112	174	178.1	170.4	177.9	-175.8	0	109.5	R196 F198 C213 E215 G216 V217 T218 A219	K35-R196 CarbonylContact C-O 3.53Å; K35-R196 WeakPolarHBondContact CA-O 3.46Å; K35-F198 HydrophobicContact CD-CD2 4.22Å; K35-F198 HydrophobicContact CD-CE2 3.82Å; K35-F198 HydrophobicContact CD-CZ 4.49Å; K35-F198 HydrophobicContact CG-CD2 3.79Å; K35-F198 HydrophobicContact CG-CE2 3.66Å; K35-C213 WeakPolarHBondContact CE-O 3.24Å; K35-C213 PolarHBondContact NZ-O 3.43Å; K35-E215 PolarHBondContact NZ-O 3.24Å; K35-G216 WeakPolarHBondContact CB-O 3.39Å; K35-V217 HydrophobicContact CD-CG2 4.32Å; K35-T218 PolarHBondContact N-OG1 3.35Å; K35-T218 WeakPolarHBondContact O-CB 3.35Å; K35-T218 PolarHBondContact O-N 3.39Å; K35-A219 PolarHBondContact O-N 3.4Å
36	L	95	Very high	86.5	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.5	175.6	-55.9	-174.6	0	0	0	110	I195 R196 M197 F198 A219 I221 F335 I342	L36-I195 HydrophobicContact CD1-CG2 3.56Å; L36-I195 HydrophobicContact CG-CG2 3.81Å; L36-R196 PolarHBondContact N-O 3.26Å; L36-M197 HydrophobicContact CD1-CE 4.05Å; L36-M197 CarbonylContact O-C 3.59Å; L36-M197 WeakPolarHBondContact O-CA 3.44Å; L36-F198 PolarHBondContact O-N 2.9Å; L36-A219 WeakPolarHBondContact CA-O 3.48Å; L36-A219 HydrophobicContact CD2-CB 3.94Å; L36-I221 HydrophobicContact CD1-CD1 4.27Å; L36-F335 HydrophobicContact CD1-CE2 3.86Å; L36-F335 HydrophobicContact CD1-CZ 3.64Å; L36-I342 HydrophobicContact CD2-CD1 3.72Å
37	L	96.7	Very high	87.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.4	177.9	-175.9	60.1	0	0	0	110.2	L39 F198 V200 C213 F214 V217 A219 I220 I221 F258	L37-L39 HydrophobicContact CD1-CD2 4.29Å; L37-L39 HydrophobicContact CD2-CD1 3.97Å; L37-L39 HydrophobicContact CD2-CD2 4.06Å; L37-L39 HydrophobicContact CD2-CG 4.1Å; L37-L39 HydrophobicContact CG-CD1 4.29Å; L37-L39 HydrophobicContact CG-CD2 3.91Å; L37-L39 HydrophobicContact CG-CG 3.89Å; L37-F198 HydrophobicContact CD1-CB 3.75Å; L37-V200 HydrophobicContact CD1-CG1 4.32Å; L37-C213 HydrophobicContact CD1-CB 3.64Å; L37-C213 HydrophobicContact CD2-CB 4.4Å; L37-F214 HydrophobicContact CD2-CD1 3.8Å; L37-F214 HydrophobicContact CD2-CE1 3.93Å; L37-V217 HydrophobicContact CB-CG1 3.84Å; L37-V217 HydrophobicContact CB-CG2 4.12Å; L37-V217 HydrophobicContact CD2-CG2 3.98Å; L37-A219 PolarHBondContact N-O 2.98Å; L37-A219 VanDerWaalsContact N-O 3.08Å; L37-I220 WeakPolarHBondContact O-CA 3.25Å; L37-I221 PolarHBondContact O-N 2.7Å; L37-F258 HydrophobicContact CD2-CE1 4.43Å; L37-F258 HydrophobicContact CD2-CZ 3.97Å
38	L	97.5	Very high	89	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	115.5	174.7	-59.4	-171.3	0	0	0	110.1	K46 I49 V50 M197 F198 D199 V200 I221	L38-K46 HydrophobicContact CB-CB 4.24Å; L38-K46 HydrophobicContact CB-CD 4.11Å; L38-K46 HydrophobicContact CB-CG 4.16Å; L38-K46 HydrophobicContact CD1-CB 4.22Å; L38-K46 WeakPolarHBondContact CD1-O 3.5Å; L38-K46 WeakPolarHBondContact O-CD 3.37Å; L38-I49 HydrophobicContact CD1-CB 4.45Å; L38-I49 HydrophobicContact CD1-CG2 4.46Å; L38-V50 HydrophobicContact CD1-CG2 3.49Å; L38-V50 VanDerWaalsContact CD1-CG2 3.49Å; L38-M197 HydrophobicContact CD1-CG 4.08Å; L38-M197 HydrophobicContact CD1-SD 3.79Å; L38-M197 HydrophobicContact CD2-CE 4.32Å; L38-M197 HydrophobicContact CD2-CG 4.35Å; L38-M197 HydrophobicContact CD2-SD 4.17Å; L38-M197 HydrophobicContact CG-CG 3.93Å; L38-M197 HydrophobicContact CG-SD 4.09Å; L38-F198 PolarHBondContact N-O 3.25Å; L38-D199 HydrophobicContact CD1-CB 4.28Å; L38-V200 WeakPolarHBondContact O-CG2 3.2Å; L38-I221 WeakPolarHBondContact CA-O 3.27Å; L38-I221 HydrophobicContact CD2-CB 3.61Å; L38-I221 HydrophobicContact CD2-CD1 3.85Å; L38-I221 HydrophobicContact CD2-CG1 4.23Å; L38-I221 HydrophobicContact CD2-CG2 4.01Å
39	L	97.6	Very high	90.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	161.9	177.8	-62.3	-179.7	0	0	0	111.5	L37 V200 W210 I220 I221 F222 V223 I252 F258	L37-L39 HydrophobicContact CD1-CD2 4.29Å; L37-L39 HydrophobicContact CD2-CD1 3.97Å; L37-L39 HydrophobicContact CD2-CD2 4.06Å; L37-L39 HydrophobicContact CD2-CG 4.1Å; L37-L39 HydrophobicContact CG-CD1 4.29Å; L37-L39 HydrophobicContact CG-CD2 3.91Å; L37-L39 HydrophobicContact CG-CG 3.89Å; L39-V200 HydrophobicContact CD2-CG2 3.67Å; L39-W210 HydrophobicContact CB-CH2 4.47Å; L39-W210 HydrophobicContact CB-CZ3 4.41Å; L39-W210 HydrophobicContact CD2-CD2 3.81Å; L39-W210 HydrophobicContact CD2-CE3 3.74Å; L39-W210 HydrophobicContact CD2-CG 4.3Å; L39-W210 HydrophobicContact CD2-CH2 4.29Å; L39-W210 HydrophobicContact CD2-CZ2 4.4Å; L39-W210 HydrophobicContact CD2-CZ3 3.97Å; L39-I220 HydrophobicContact CB-CG2 4.27Å; L39-I220 HydrophobicContact CD1-CD1 4.41Å; L39-I220 HydrophobicContact CD1-CG2 3.93Å; L39-I220 HydrophobicContact CG-CG2 4.18Å; L39-I221 PolarHBondContact N-O 2.87Å; L39-F222 HydrophobicContact CB-CD2 3.76Å; L39-F222 HydrophobicContact CB-CE2 4.21Å; L39-F222 CarbonylContact O-C 3.59Å; L39-F222 WeakPolarHBondContact O-CA 3.22Å; L39-V223 PolarHBondContact O-N 3.15Å; L39-I252 HydrophobicContact CD1-CD1 3.81Å; L39-I252 HydrophobicContact CD1-CG1 4.02Å; L39-I252 HydrophobicContact CD1-CG2 3.76Å; L39-F258 HydrophobicContact CD1-CE2 4.35Å
40	G	97.3	Very high	91.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.			trans	141	165.5	-179.2	0	0	0	0	0	112.4	K46 G202	G40-K46 PolarHBondContact O-NZ 2.95Å; G40-G202 WeakPolarHBondContact O-CA 3.31Å
41	A	96.2	Very high	93.4	Very high	6 Å²	6	26 Å²	26	5%	0.05	13%	0.131	C	C	.	.	S	Bend	trans	-59.5	167.3	-179.3	0	0	0	0	0	112.9	S44 K46	A41-S44 PolarHBondContact O-N 2.98Å; A41-S44 PolarHBondContact O-OG 3.03Å; A41-K46 PolarHBondContact O-NZ 2.72Å
42	G	93.9	Very high	94.9	Very high	14 Å²	14	20 Å²	20	14%	0.144	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	146.3	168.6	0	0	0	0	0	110.1	S44 G202	G42-S44 PolarHBondContact O-N 3.1Å; G42-G202 VanDerWaalsContact N-C 3.32Å; G42-G202 PolarHBondContact N-O 2.81Å
43	E	94.1	Very high	95.7	Very high	62 Å²	62	13.4 Å²	13.4	29%	0.29	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	68	0.1	173.9	-52	-171.7	156.5	0	0	116.2	G45 R177 R241 K269	E43-G45 PolarHBondContact O-N 3.43Å; E43-G45 VanDerWaalsContact O-N 3.08Å; E43-R177 VanDerWaalsContact CG-NH2 3.34Å; E43-R177 IonicContact OE1-NE 3.16Å; E43-R177 IonicContact OE1-NH2 3.83Å; E43-R241 IonicContact OE2-CZ 3.67Å; E43-R241 IonicContact OE2-NH1 3.46Å; E43-R241 PolarHBondContact OE2-NH1 3.48Å; E43-R241 IonicContact OE2-NH2 3.76Å; E43-R241 PolarHBondContact OE2-NH2 3.25Å; E43-K269 WeakPolarHBondContact O-CE 3.39Å; E43-K269 PolarHBondContact O-NZ 3.24Å
44	S	97.3	Very high	96.1	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.007	7%	0.07	C	C	.	.	S	Bend	trans	-63.9	-19	-178.5	69	0	0	0	0	115.7	A41 G42 K46 V223 N268	A41-S44 PolarHBondContact O-N 2.98Å; A41-S44 PolarHBondContact O-OG 3.03Å; G42-S44 PolarHBondContact O-N 3.1Å; S44-K46 PolarHBondContact OG-NZ 2.86Å; S44-V223 WeakPolarHBondContact CB-O 3.36Å; S44-V223 VanDerWaalsContact O-CG1 3.23Å; S44-V223 WeakPolarHBondContact O-CG1 3.16Å; S44-V223 PolarHBondContact OG-O 3.45Å; S44-V223 VanDerWaalsContact OG-O 3.08Å; S44-N268 PolarHBondContact O-ND2 3.35Å
45	G	96.9	Very high	96.4	Very high	12 Å²	12	13.6 Å²	13.6	12%	0.124	8%	0.076	C	C	.	.	S	Bend	trans	110.3	9	178.4	0	0	0	0	0	115.8	E43 S47 T48 I49	E43-G45 PolarHBondContact O-N 3.43Å; E43-G45 VanDerWaalsContact O-N 3.08Å; G45-S47 PolarHBondContact O-N 3.27Å; G45-T48 WeakPolarHBondContact O-CB 3.26Å; G45-T48 PolarHBondContact O-N 3.48Å; G45-T48 VanDerWaalsContact O-N 3.11Å; G45-I49 PolarHBondContact O-N 2.9Å
46	K	97.3	Very high	96.5	Very high	9 Å²	9	13.9 Å²	13.9	4%	0.039	8%	0.079	C	C	.	.	H	α-helix	trans	-51.1	-56	177.3	-65.4	-178.6	-65.1	-64.3	0	113.7	L38 G40 A41 S44 T48 I49 V50 D199 V200 V223	L38-K46 HydrophobicContact CB-CB 4.24Å; L38-K46 HydrophobicContact CB-CD 4.11Å; L38-K46 HydrophobicContact CB-CG 4.16Å; L38-K46 HydrophobicContact CD1-CB 4.22Å; L38-K46 WeakPolarHBondContact CD1-O 3.5Å; L38-K46 WeakPolarHBondContact O-CD 3.37Å; G40-K46 PolarHBondContact O-NZ 2.95Å; A41-K46 PolarHBondContact O-NZ 2.72Å; S44-K46 PolarHBondContact OG-NZ 2.86Å; K46-T48 PolarHBondContact O-N 3.17Å; K46-I49 WeakPolarHBondContact O-CA 3.29Å; K46-I49 WeakPolarHBondContact O-CB 3.47Å; K46-I49 PolarHBondContact O-N 3.08Å; K46-V50 PolarHBondContact O-N 3.16Å; K46-V50 VanDerWaalsContact O-N 3.1Å; K46-D199 VanDerWaalsContact CB-OD1 3.24Å; K46-D199 WeakPolarHBondContact CB-OD1 3.33Å; K46-V200 WeakPolarHBondContact CE-O 3.33Å; K46-V223 HydrophobicContact CG-CB 4.05Å; K46-V223 HydrophobicContact CG-CG2 3.82Å
47	S	97.2	Very high	96.4	Very high	25 Å²	25	16 Å²	16	18%	0.175	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-27.6	-179.5	-47.9	0	0	0	0	112.4	G45 V50 K51 T180 D199	G45-S47 PolarHBondContact O-N 3.27Å; S47-V50 PolarHBondContact O-N 3.26Å; S47-K51 VanDerWaalsContact O-CG 3.27Å; S47-K51 WeakPolarHBondContact O-CG 3.44Å; S47-K51 PolarHBondContact O-N 3.36Å; S47-T180 PolarHBondContact OG-OG1 2.88Å; S47-D199 VanDerWaalsContact CA-OD2 3.31Å; S47-D199 WeakPolarHBondContact CA-OD2 3.48Å; S47-D199 VanDerWaalsContact CB-OD2 3.3Å; S47-D199 WeakPolarHBondContact CB-OD2 3.42Å; S47-D199 PolarHBondContact OG-OD2 2.83Å
48	T	97.5	Very high	96.2	Very high	24 Å²	24	19.7 Å²	19.7	15%	0.147	11%	0.107	C	C	.	.	H	α-helix	trans	-67.6	-38.5	172.7	-51.2	0	0	0	0	111.2	G45 K46 V50 K51 Q52 L174 A325 T326	G45-T48 WeakPolarHBondContact O-CB 3.26Å; G45-T48 PolarHBondContact O-N 3.48Å; G45-T48 VanDerWaalsContact O-N 3.11Å; K46-T48 PolarHBondContact O-N 3.17Å; T48-V50 VanDerWaalsContact C-N 3.35Å; T48-V50 PolarHBondContact O-N 3.31Å; T48-K51 WeakPolarHBondContact O-CB 3.29Å; T48-K51 PolarHBondContact O-N 3.09Å; T48-Q52 WeakPolarHBondContact O-CG 3.47Å; T48-Q52 PolarHBondContact O-N 2.85Å; T48-L174 HydrophobicContact CG2-CB 4.35Å; T48-L174 HydrophobicContact CG2-CD2 3.88Å; T48-A325 HydrophobicContact CG2-CB 3.7Å; T48-A325 WeakPolarHBondContact CG2-O 3.47Å; T48-T326 HydrophobicContact CG2-CG2 4.07Å
49	I	97.5	Very high	96	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-41.7	172.9	-64.9	155.8	0	0	0	110.9	L38 G45 K46 K51 Q52 M53 V223 F266 A325 I331	L38-I49 HydrophobicContact CD1-CB 4.45Å; L38-I49 HydrophobicContact CD1-CG2 4.46Å; G45-I49 PolarHBondContact O-N 2.9Å; K46-I49 WeakPolarHBondContact O-CA 3.29Å; K46-I49 WeakPolarHBondContact O-CB 3.47Å; K46-I49 PolarHBondContact O-N 3.08Å; I49-K51 PolarHBondContact O-N 2.82Å; I49-Q52 WeakPolarHBondContact O-CB 3.26Å; I49-Q52 PolarHBondContact O-N 3.03Å; I49-Q52 VanDerWaalsContact O-N 3.13Å; I49-M53 WeakPolarHBondContact O-CG 3.42Å; I49-M53 PolarHBondContact O-N 3.47Å; I49-V223 HydrophobicContact CD1-CB 4.4Å; I49-V223 HydrophobicContact CD1-CG1 3.98Å; I49-V223 HydrophobicContact CD1-CG2 3.47Å; I49-V223 VanDerWaalsContact CD1-CG2 3.47Å; I49-F266 HydrophobicContact CD1-CD2 3.6Å; I49-F266 HydrophobicContact CD1-CE2 4.06Å; I49-F266 HydrophobicContact CG1-CD2 4.37Å; I49-F266 HydrophobicContact CG1-CE2 4.47Å; I49-F266 HydrophobicContact CG2-CE2 4.5Å; I49-A325 HydrophobicContact CG1-CB 4.14Å; I49-I331 HydrophobicContact CG1-CD1 4.46Å
50	V	96.8	Very high	95.9	Very high	16 Å²	16	26 Å²	26	10%	0.097	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-45.4	174.1	-177.4	0	0	0	0	111.6	L38 K46 S47 T48 Q52 M53 K54 T186 M197 D199	L38-V50 HydrophobicContact CD1-CG2 3.49Å; L38-V50 VanDerWaalsContact CD1-CG2 3.49Å; K46-V50 PolarHBondContact O-N 3.16Å; K46-V50 VanDerWaalsContact O-N 3.1Å; S47-V50 PolarHBondContact O-N 3.26Å; T48-V50 VanDerWaalsContact C-N 3.35Å; T48-V50 PolarHBondContact O-N 3.31Å; V50-Q52 PolarHBondContact O-N 2.88Å; V50-M53 WeakPolarHBondContact O-CB 3.19Å; V50-M53 PolarHBondContact O-N 3.4Å; V50-M53 VanDerWaalsContact O-N 3.08Å; V50-K54 PolarHBondContact O-N 3.41Å; V50-K54 VanDerWaalsContact O-N 3.17Å; V50-T186 HydrophobicContact CG1-CG2 4.22Å; V50-T186 WeakPolarHBondContact CG1-OG1 3.44Å; V50-M197 HydrophobicContact CG2-SD 4.05Å; V50-D199 HydrophobicContact CG2-CB 3.59Å
51	K	97.1	Very high	95.9	Very high	23 Å²	23	27 Å²	27	10%	0.1	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-38.9	175.2	-66.9	172	177.9	-179.8	0	111.1	S47 T48 I49 K54 I55 Y61 V173 L174 T176	S47-K51 VanDerWaalsContact O-CG 3.27Å; S47-K51 WeakPolarHBondContact O-CG 3.44Å; S47-K51 PolarHBondContact O-N 3.36Å; T48-K51 WeakPolarHBondContact O-CB 3.29Å; T48-K51 PolarHBondContact O-N 3.09Å; I49-K51 PolarHBondContact O-N 2.82Å; K51-K54 WeakPolarHBondContact O-CB 3.34Å; K51-K54 PolarHBondContact O-N 2.95Å; K51-I55 WeakPolarHBondContact O-CG1 3.49Å; K51-I55 PolarHBondContact O-N 2.85Å; K51-I55 VanDerWaalsContact O-N 3.1Å; K51-Y61 WeakPolarHBondContact CA-OH 3.48Å; K51-Y61 HydrophobicContact CB-CE2 4.38Å; K51-Y61 WeakPolarHBondContact CB-OH 3.49Å; K51-Y61 VanDerWaalsContact CG-OH 3.27Å; K51-Y61 WeakPolarHBondContact CG-OH 3.35Å; K51-V173 HydrophobicContact CD-CG1 4.33Å; K51-V173 PolarHBondContact NZ-O 2.95Å; K51-L174 HydrophobicContact CB-CD2 3.7Å; K51-T176 PolarHBondContact NZ-O 2.88Å; K51-T176 PolarHBondContact NZ-OG1 3.1Å
52	Q	97.3	Very high	95.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65	-38.3	174	-69.7	-73.4	19.7	0	0	112.5	T48 I49 V50 K54 I55 I56 L174 A325 T328 I331	T48-Q52 WeakPolarHBondContact O-CG 3.47Å; T48-Q52 PolarHBondContact O-N 2.85Å; I49-Q52 WeakPolarHBondContact O-CB 3.26Å; I49-Q52 PolarHBondContact O-N 3.03Å; I49-Q52 VanDerWaalsContact O-N 3.13Å; V50-Q52 PolarHBondContact O-N 2.88Å; Q52-K54 PolarHBondContact O-N 2.87Å; Q52-I55 WeakPolarHBondContact O-CA 3.46Å; Q52-I55 PolarHBondContact O-N 2.94Å; Q52-I56 HydrophobicContact CB-CD1 4.17Å; Q52-I56 WeakPolarHBondContact O-CB 3.45Å; Q52-I56 VanDerWaalsContact O-CG1 3.26Å; Q52-I56 WeakPolarHBondContact O-CG1 3.43Å; Q52-I56 PolarHBondContact O-N 3.07Å; Q52-L174 HydrophobicContact CG-CD2 3.8Å; Q52-A325 WeakPolarHBondContact CG-O 3.45Å; Q52-A325 PolarHBondContact NE2-O 3.26Å; Q52-T328 PolarHBondContact NE2-OG1 2.8Å; Q52-T328 PolarHBondContact OE1-OG1 3.37Å; Q52-I331 HydrophobicContact CB-CB 4.43Å; Q52-I331 HydrophobicContact CB-CG2 3.81Å; Q52-I331 HydrophobicContact CG-CB 4.36Å; Q52-I331 HydrophobicContact CG-CG1 4.26Å; Q52-I331 HydrophobicContact CG-CG2 4.22Å
53	M	95.8	Very high	96.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.4	-36.4	175	-63.5	-57.3	94.7	0	0	111.4	I49 V50 I56 H57 F188 M197 I331 F335	I49-M53 WeakPolarHBondContact O-CG 3.42Å; I49-M53 PolarHBondContact O-N 3.47Å; V50-M53 WeakPolarHBondContact O-CB 3.19Å; V50-M53 PolarHBondContact O-N 3.4Å; V50-M53 VanDerWaalsContact O-N 3.08Å; M53-I56 HydrophobicContact CE-CD1 4.07Å; M53-H57 WeakPolarHBondContact O-CA 3.4Å; M53-H57 WeakPolarHBondContact O-CB 3.43Å; M53-H57 PolarHBondContact O-N 3.31Å; M53-F188 HydrophobicContact CB-CD1 4.11Å; M53-F188 HydrophobicContact CB-CE1 3.8Å; M53-F188 HydrophobicContact CB-CZ 4.05Å; M53-F188 HydrophobicContact CG-CE1 3.75Å; M53-F188 HydrophobicContact CG-CE2 4.44Å; M53-F188 HydrophobicContact CG-CZ 3.69Å; M53-F188 HydrophobicContact SD-CE1 4.25Å; M53-F188 HydrophobicContact SD-CE2 3.92Å; M53-F188 HydrophobicContact SD-CZ 3.54Å; M53-F188 VanDerWaalsContact SD-CZ 3.54Å; M53-M197 HydrophobicContact CG-CE 3.67Å; M53-M197 HydrophobicContact CG-SD 3.73Å; M53-M197 HydrophobicContact SD-CE 4.07Å; M53-I331 HydrophobicContact CE-CG2 3.68Å; M53-F335 HydrophobicContact CE-CB 4.34Å; M53-F335 HydrophobicContact CE-CD1 4.39Å; M53-F335 HydrophobicContact CE-CD2 4.08Å; M53-F335 HydrophobicContact CE-CG 4Å; M53-F335 HydrophobicContact SD-CD1 3.94Å; M53-F335 HydrophobicContact SD-CD2 3.89Å; M53-F335 HydrophobicContact SD-CE1 3.84Å; M53-F335 HydrophobicContact SD-CE2 3.78Å; M53-F335 HydrophobicContact SD-CG 3.97Å; M53-F335 HydrophobicContact SD-CZ 3.76Å
54	K	96	Very high	96.2	Very high	39 Å²	39	37.1 Å²	37.1	17%	0.17	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-44.3	172.2	-172	174.5	173.2	-176.6	0	112	V50 K51 Q52 M58 G60 Y61 E65	V50-K54 PolarHBondContact O-N 3.41Å; V50-K54 VanDerWaalsContact O-N 3.17Å; K51-K54 WeakPolarHBondContact O-CB 3.34Å; K51-K54 PolarHBondContact O-N 2.95Å; Q52-K54 PolarHBondContact O-N 2.87Å; K54-M58 HydrophobicContact CB-SD 4.15Å; K54-M58 HydrophobicContact CG-CB 4.01Å; K54-M58 HydrophobicContact CG-SD 4.18Å; K54-M58 CarbonylContact O-C 3.57Å; K54-M58 VanDerWaalsContact O-C 3.28Å; K54-M58 VanDerWaalsContact O-CA 3.29Å; K54-M58 WeakPolarHBondContact O-CA 3.39Å; K54-M58 WeakPolarHBondContact O-CB 3.43Å; K54-M58 PolarHBondContact O-N 2.95Å; K54-G60 VanDerWaalsContact CE-O 3.3Å; K54-G60 WeakPolarHBondContact CE-O 3.4Å; K54-G60 WeakPolarHBondContact O-CA 3.45Å; K54-G60 PolarHBondContact O-N 3.09Å; K54-Y61 HydrophobicContact CB-CE2 4.33Å; K54-Y61 HydrophobicContact CD-CD1 4.13Å; K54-Y61 HydrophobicContact CD-CE1 3.67Å; K54-Y61 HydrophobicContact CD-CE2 4.12Å; K54-Y61 HydrophobicContact CG-CE2 4.4Å; K54-E65 WeakPolarHBondContact CE-OE2 3.38Å; K54-E65 IonicContact NZ-OE1 2.77Å; K54-E65 PolarHBondContact NZ-OE1 3.49Å; K54-E65 IonicContact NZ-OE2 3.37Å; K54-E65 PolarHBondContact NZ-OE2 3.07Å
55	I	96.2	Very high	96.2	Very high	27 Å²	27	40.3 Å²	40.3	14%	0.138	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-48.9	176.5	-65.4	172.2	0	0	0	112.1	K51 Q52 Y61 Q170 L174 T328	K51-I55 WeakPolarHBondContact O-CG1 3.49Å; K51-I55 PolarHBondContact O-N 2.85Å; K51-I55 VanDerWaalsContact O-N 3.1Å; Q52-I55 WeakPolarHBondContact O-CA 3.46Å; Q52-I55 PolarHBondContact O-N 2.94Å; I55-Y61 HydrophobicContact CD1-CD2 4.28Å; I55-Y61 HydrophobicContact CD1-CE2 4.17Å; I55-Y61 HydrophobicContact CG1-CD2 3.84Å; I55-Y61 HydrophobicContact CG1-CE2 3.83Å; I55-Q170 HydrophobicContact CD1-CB 4.17Å; I55-L174 HydrophobicContact CD1-CD1 3.76Å; I55-L174 HydrophobicContact CD1-CD2 3.92Å; I55-L174 HydrophobicContact CD1-CG 3.86Å; I55-T328 HydrophobicContact CG2-CG2 3.97Å
56	I	95	Very high	96.2	Very high	33 Å²	33	40 Å²	40	17%	0.169	21%	0.214	C	C	.	.	H	α-helix	trans	-80.7	-36.7	-170.6	-60	163.6	0	0	0	111.4	Q52 M53 T328 I331 Q332	Q52-I56 HydrophobicContact CB-CD1 4.17Å; Q52-I56 WeakPolarHBondContact O-CB 3.45Å; Q52-I56 VanDerWaalsContact O-CG1 3.26Å; Q52-I56 WeakPolarHBondContact O-CG1 3.43Å; Q52-I56 PolarHBondContact O-N 3.07Å; M53-I56 HydrophobicContact CE-CD1 4.07Å; I56-T328 HydrophobicContact CD1-CG2 4.19Å; I56-T328 HydrophobicContact CG1-CG2 3.73Å; I56-I331 HydrophobicContact CD1-CB 4.39Å; I56-I331 HydrophobicContact CD1-CG2 3.93Å; I56-Q332 HydrophobicContact CD1-CB 3.92Å; I56-Q332 HydrophobicContact CG1-CB 4.43Å; I56-Q332 HydrophobicContact CG2-CB 4.3Å; I56-Q332 HydrophobicContact CG2-CG 3.89Å
57	H	93.4	Very high	96.2	Very high	44 Å²	44	43.9 Å²	43.9	20%	0.204	23%	0.23	C	C	.	.	H	α-helix	trans	-120.8	-6.2	-169	-57.1	-56.6	0	0	0	115.1	M53 F188 F190 F335	M53-H57 WeakPolarHBondContact O-CA 3.4Å; M53-H57 WeakPolarHBondContact O-CB 3.43Å; M53-H57 PolarHBondContact O-N 3.31Å; H57-F188 HydrophobicContact CB-CB 4.14Å; H57-F188 HydrophobicContact CB-CD2 3.86Å; H57-F188 HydrophobicContact CB-CG 4.29Å; H57-F188 AromaticContact CD2-CD2 3.71Å; H57-F188 AromaticContact CD2-CE2 3.67Å; H57-F188 AromaticContact CG-CD2 3.94Å; H57-F190 AromaticContact CE1-CD2 3.15Å; H57-F190 WeakPolarHBondContact CE1-CD2 3.45Å; H57-F190 AromaticContact CE1-CE2 3.38Å; H57-F190 WeakPolarHBondContact CE1-CE2 3.5Å; H57-F190 AromaticContact CE1-CG 3.68Å; H57-F190 AromaticContact ND1-CD2 3.57Å; H57-F190 AromaticContact NE2-CD2 3.95Å; H57-F335 AromaticContact NE2-CD1 3.93Å
58	M	93.4	Very high	96.1	Very high	78 Å²	78	47.3 Å²	47.3	38%	0.384	25%	0.251	S	S	.	.	S	Bend	trans	-129.4	31	-176.4	-49.8	171.4	67.2	0	0	113.1	K54 G60 T186 F188	K54-M58 HydrophobicContact CB-SD 4.15Å; K54-M58 HydrophobicContact CG-CB 4.01Å; K54-M58 HydrophobicContact CG-SD 4.18Å; K54-M58 CarbonylContact O-C 3.57Å; K54-M58 VanDerWaalsContact O-C 3.28Å; K54-M58 VanDerWaalsContact O-CA 3.29Å; K54-M58 WeakPolarHBondContact O-CA 3.39Å; K54-M58 WeakPolarHBondContact O-CB 3.43Å; K54-M58 PolarHBondContact O-N 2.95Å; M58-G60 PolarHBondContact O-N 2.88Å; M58-G60 VanDerWaalsContact O-N 3.17Å; M58-T186 HydrophobicContact SD-CG2 3.94Å; M58-F188 HydrophobicContact CG-CB 3.95Å; M58-F188 HydrophobicContact SD-CB 4.24Å
59	S	93.3	Very high	96	Very high	127 Å²	127	48.6 Å²	48.6	89%	0.888	25%	0.253	S	S	*	.			trans	65.3	8.7	-179.2	-44.8	0	0	0	0	115.5
60	G	95.1	Very high	95.9	Very high	5 Å²	5	51 Å²	51	5%	0.052	26%	0.264	C	S	.	.			trans	69.8	-155.1	-179.5	0	0	0	0	0	115	K54 M58	K54-G60 VanDerWaalsContact CE-O 3.3Å; K54-G60 WeakPolarHBondContact CE-O 3.4Å; K54-G60 WeakPolarHBondContact O-CA 3.45Å; K54-G60 PolarHBondContact O-N 3.09Å; M58-G60 PolarHBondContact O-N 2.88Å; M58-G60 VanDerWaalsContact O-N 3.17Å
61	Y	96.9	Very high	95.7	Very high	22 Å²	22	52.2 Å²	52.2	9%	0.086	27%	0.272	C	S	.	.			trans	-101.2	129.1	-176.9	-65.7	-94.3	0	0	0	109.6	K51 K54 I55 E65 Y69 Q170 V173	K51-Y61 WeakPolarHBondContact CA-OH 3.48Å; K51-Y61 HydrophobicContact CB-CE2 4.38Å; K51-Y61 WeakPolarHBondContact CB-OH 3.49Å; K51-Y61 VanDerWaalsContact CG-OH 3.27Å; K51-Y61 WeakPolarHBondContact CG-OH 3.35Å; K54-Y61 HydrophobicContact CB-CE2 4.33Å; K54-Y61 HydrophobicContact CD-CD1 4.13Å; K54-Y61 HydrophobicContact CD-CE1 3.67Å; K54-Y61 HydrophobicContact CD-CE2 4.12Å; K54-Y61 HydrophobicContact CG-CE2 4.4Å; I55-Y61 HydrophobicContact CD1-CD2 4.28Å; I55-Y61 HydrophobicContact CD1-CE2 4.17Å; I55-Y61 HydrophobicContact CG1-CD2 3.84Å; I55-Y61 HydrophobicContact CG1-CE2 3.83Å; Y61-E65 WeakPolarHBondContact CA-OE2 3.15Å; Y61-E65 HydrophobicContact CD1-CB 4.25Å; Y61-Y69 HydrophobicContact CD1-CE2 4.24Å; Y61-Y69 HydrophobicContact CE1-CE2 4.02Å; Y61-Q170 HydrophobicContact CD2-CG 4.47Å; Y61-Q170 PolarHBondContact O-NE2 2.86Å; Y61-V173 HydrophobicContact CD1-CG1 4.23Å; Y61-V173 HydrophobicContact CD2-CG1 4.22Å; Y61-V173 HydrophobicContact CE1-CG1 3.91Å; Y61-V173 HydrophobicContact CE2-CG1 3.91Å; Y61-V173 HydrophobicContact CG-CG1 4.38Å
62	T	97	Very high	95.6	Very high	72 Å²	72	52.9 Å²	52.9	44%	0.442	28%	0.278	S	S	.	.			trans	-70.9	166.4	171.4	78.6	0	0	0	0	110.6	E64 E65 C66	T62-E64 VanDerWaalsContact C-N 3.28Å; T62-E64 PolarHBondContact O-N 2.84Å; T62-E64 PolarHBondContact OG1-N 3.48Å; T62-E64 PolarHBondContact OG1-OE2 3.27Å; T62-E65 PolarHBondContact N-OE2 2.84Å; T62-E65 VanDerWaalsContact N-OE2 3.15Å; T62-E65 PolarHBondContact O-N 2.83Å; T62-E65 PolarHBondContact OG1-N 2.9Å; T62-C66 WeakPolarHBondContact O-CB 3.25Å; T62-C66 PolarHBondContact O-N 3.08Å; T62-C66 PolarHBondContact O-SG 3.39Å
63	E	96.7	Very high	95.5	Very high	101 Å²	101	52.9 Å²	52.9	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-40.6	176.6	-166.9	-171.7	127.8	0	0	111.8	C66 K67 I167	E63-C66 WeakPolarHBondContact O-CB 3.36Å; E63-C66 PolarHBondContact O-N 3.2Å; E63-K67 WeakPolarHBondContact O-CG 3.42Å; E63-K67 PolarHBondContact O-N 2.81Å; E63-K67 WeakPolarHBondContact OE1-CE 3.36Å; E63-K67 IonicContact OE1-NZ 3.24Å; E63-K67 PolarHBondContact OE1-NZ 2.74Å; E63-I167 HydrophobicContact CG-CD1 3.88Å; E63-I167 HydrophobicContact CG-CG2 3.97Å; E63-I167 WeakPolarHBondContact OE1-CD1 3Å
64	E	96.7	Very high	95.5	Very high	122 Å²	122	53 Å²	53	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-62.5	-43.8	176.6	-66	70.3	-155.3	0	0	111.7	T62 K67 T68	T62-E64 VanDerWaalsContact C-N 3.28Å; T62-E64 PolarHBondContact O-N 2.84Å; T62-E64 PolarHBondContact OG1-N 3.48Å; T62-E64 PolarHBondContact OG1-OE2 3.27Å; E64-K67 WeakPolarHBondContact O-CB 3.28Å; E64-K67 PolarHBondContact O-N 2.82Å; E64-T68 PolarHBondContact O-N 3.19Å
65	E	97	Very high	95.4	Very high	67 Å²	67	53.3 Å²	53.3	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-65.7	-43.6	176.3	-66.7	-177	129.9	0	0	111	K54 Y61 T62 K67 T68 Y69	K54-E65 WeakPolarHBondContact CE-OE2 3.38Å; K54-E65 IonicContact NZ-OE1 2.77Å; K54-E65 PolarHBondContact NZ-OE1 3.49Å; K54-E65 IonicContact NZ-OE2 3.37Å; K54-E65 PolarHBondContact NZ-OE2 3.07Å; Y61-E65 WeakPolarHBondContact CA-OE2 3.15Å; Y61-E65 HydrophobicContact CD1-CB 4.25Å; T62-E65 PolarHBondContact N-OE2 2.84Å; T62-E65 VanDerWaalsContact N-OE2 3.15Å; T62-E65 PolarHBondContact O-N 2.83Å; T62-E65 PolarHBondContact OG1-N 2.9Å; E65-K67 VanDerWaalsContact C-N 3.29Å; E65-K67 PolarHBondContact O-N 2.81Å; E65-T68 WeakPolarHBondContact O-CB 3.29Å; E65-T68 PolarHBondContact O-N 3.17Å; E65-T68 VanDerWaalsContact O-N 3.09Å; E65-T68 PolarHBondContact O-OG1 3.1Å; E65-Y69 WeakPolarHBondContact O-CD2 3.49Å
66	C	97.6	Very high	95.3	Very high	6 Å²	6	52.5 Å²	52.5	4%	0.041	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-39.9	174.6	-79.5	0	0	0	0	112.4	T62 E63 T68 Y69 I167 P168	T62-C66 WeakPolarHBondContact O-CB 3.25Å; T62-C66 PolarHBondContact O-N 3.08Å; T62-C66 PolarHBondContact O-SG 3.39Å; E63-C66 WeakPolarHBondContact O-CB 3.36Å; E63-C66 PolarHBondContact O-N 3.2Å; C66-T68 PolarHBondContact O-N 3.29Å; C66-Y69 WeakPolarHBondContact O-CB 3.46Å; C66-Y69 PolarHBondContact O-N 3.04Å; C66-I167 HydrophobicContact CB-CG2 4.16Å; C66-P168 WeakPolarHBondContact CB-O 2.86Å; C66-P168 WeakPolarHBondContact O-CD 3.47Å; C66-P168 VanDerWaalsContact O-CG 3.27Å; C66-P168 WeakPolarHBondContact O-CG 3.35Å
67	K	95.8	Very high	95.3	Very high	90 Å²	90	51 Å²	51	39%	0.391	27%	0.273	S	S	.	.	H	α-helix	trans	-56.9	-34.8	175.6	-76.3	168.3	-174.9	159.7	0	112.3	E63 E64 E65 Y69 K70 I167	E63-K67 WeakPolarHBondContact O-CG 3.42Å; E63-K67 PolarHBondContact O-N 2.81Å; E63-K67 WeakPolarHBondContact OE1-CE 3.36Å; E63-K67 IonicContact OE1-NZ 3.24Å; E63-K67 PolarHBondContact OE1-NZ 2.74Å; E64-K67 WeakPolarHBondContact O-CB 3.28Å; E64-K67 PolarHBondContact O-N 2.82Å; E65-K67 VanDerWaalsContact C-N 3.29Å; E65-K67 PolarHBondContact O-N 2.81Å; K67-Y69 PolarHBondContact O-N 3.36Å; K67-K70 VanDerWaalsContact O-CB 3.3Å; K67-K70 WeakPolarHBondContact O-CB 3.3Å; K67-K70 PolarHBondContact O-N 3.47Å; K67-K70 VanDerWaalsContact O-N 3.12Å; K67-I167 HydrophobicContact CG-CG1 4.12Å; K67-I167 HydrophobicContact CG-CG2 3.98Å
68	T	95.1	Very high	95.4	Very high	98 Å²	98	49.2 Å²	49.2	60%	0.601	27%	0.265	S	S	*	.	H	α-helix	trans	-65.4	-20.8	178.2	73.7	0	0	0	0	113.6	E64 E65 C66	E64-T68 PolarHBondContact O-N 3.19Å; E65-T68 WeakPolarHBondContact O-CB 3.29Å; E65-T68 PolarHBondContact O-N 3.17Å; E65-T68 VanDerWaalsContact O-N 3.09Å; E65-T68 PolarHBondContact O-OG1 3.1Å; C66-T68 PolarHBondContact O-N 3.29Å
69	Y	95.7	Very high	95.5	Very high	50 Å²	50	50.9 Å²	50.9	20%	0.196	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-8	176.8	-75.4	-90	0	0	0	113.5	Y61 E65 C66 K67 V72 V73 V173 T176	Y61-Y69 HydrophobicContact CD1-CE2 4.24Å; Y61-Y69 HydrophobicContact CE1-CE2 4.02Å; E65-Y69 WeakPolarHBondContact O-CD2 3.49Å; C66-Y69 WeakPolarHBondContact O-CB 3.46Å; C66-Y69 PolarHBondContact O-N 3.04Å; K67-Y69 PolarHBondContact O-N 3.36Å; Y69-V72 WeakPolarHBondContact O-CB 3.4Å; Y69-V72 PolarHBondContact O-N 3.23Å; Y69-V73 WeakPolarHBondContact O-CG2 3.37Å; Y69-V73 PolarHBondContact O-N 3Å; Y69-V173 HydrophobicContact CD1-CG1 4.18Å; Y69-V173 HydrophobicContact CD1-CG2 4.48Å; Y69-V173 HydrophobicContact CD2-CB 4.47Å; Y69-V173 HydrophobicContact CD2-CG1 4.03Å; Y69-V173 HydrophobicContact CD2-CG2 3.7Å; Y69-V173 HydrophobicContact CE1-CG1 3.94Å; Y69-V173 HydrophobicContact CE2-CG1 3.77Å; Y69-V173 HydrophobicContact CE2-CG2 4.23Å; Y69-V173 HydrophobicContact CG-CB 4.47Å; Y69-V173 HydrophobicContact CG-CG1 4.23Å; Y69-V173 HydrophobicContact CG-CG2 3.84Å; Y69-T176 HydrophobicContact CD1-CG2 4.18Å
70	K	95.1	Very high	95.6	Very high	51 Å²	51	45.1 Å²	45.1	22%	0.222	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-47.5	-176.1	-178.8	173.9	-177.2	163.6	0	113.1	K67 V72 V73 F74 Y166 P168	K67-K70 VanDerWaalsContact O-CB 3.3Å; K67-K70 WeakPolarHBondContact O-CB 3.3Å; K67-K70 PolarHBondContact O-N 3.47Å; K67-K70 VanDerWaalsContact O-N 3.12Å; K70-V72 VanDerWaalsContact C-N 3.26Å; K70-V72 PolarHBondContact O-N 3.18Å; K70-V73 PolarHBondContact O-N 3.19Å; K70-F74 HydrophobicContact CD-CE2 4.27Å; K70-F74 HydrophobicContact CD-CZ 4.32Å; K70-F74 VanDerWaalsContact CE-CZ 3.47Å; K70-F74 HydrophobicContact CG-CD2 4.27Å; K70-F74 HydrophobicContact CG-CE1 4.44Å; K70-F74 HydrophobicContact CG-CE2 3.78Å; K70-F74 HydrophobicContact CG-CZ 3.89Å; K70-F74 WeakPolarHBondContact O-CG 3.39Å; K70-F74 PolarHBondContact O-N 3.45Å; K70-F74 VanDerWaalsContact O-N 3.1Å; K70-Y166 HydrophobicContact CD-CD1 4.47Å; K70-Y166 HydrophobicContact CG-CD1 4.38Å; K70-Y166 HydrophobicContact CG-CE1 4.45Å; K70-Y166 PolarHBondContact NZ-O 3.38Å; K70-P168 HydrophobicContact CB-CG 3.89Å
71	P	93.8	Very high	95.8	Very high	42 Å²	42	44.9 Å²	44.9	27%	0.273	23%	0.23	S	C	.	.	H	α-helix	trans	-61.4	-34.7	175.1	-23.3	35.3	0	0	0	112.6	F74 S75	P71-F74 PolarHBondContact O-N 3.28Å; P71-S75 VanDerWaalsContact O-CB 3.28Å; P71-S75 WeakPolarHBondContact O-CB 3.37Å; P71-S75 PolarHBondContact O-N 2.63Å
72	V	94.6	Very high	95.7	Very high	36 Å²	36	44.1 Å²	44.1	22%	0.218	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-43.8	178.4	-174.2	0	0	0	0	111.1	Y69 K70 F74 S75 N76 T176 V178	Y69-V72 WeakPolarHBondContact O-CB 3.4Å; Y69-V72 PolarHBondContact O-N 3.23Å; K70-V72 VanDerWaalsContact C-N 3.26Å; K70-V72 PolarHBondContact O-N 3.18Å; V72-F74 VanDerWaalsContact C-N 3.33Å; V72-F74 PolarHBondContact O-N 2.97Å; V72-S75 PolarHBondContact O-N 3.33Å; V72-N76 WeakPolarHBondContact O-CB 3.45Å; V72-N76 PolarHBondContact O-N 3.15Å; V72-N76 PolarHBondContact O-OD1 3.17Å; V72-T176 HydrophobicContact CB-CG2 4.28Å; V72-T176 HydrophobicContact CG1-CG2 3.98Å; V72-V178 HydrophobicContact CG1-CG2 3.65Å; V72-V178 HydrophobicContact CG2-CG2 4.49Å
73	V	95.8	Very high	95.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-48.9	174.6	170.3	0	0	0	0	110.3	Y69 K70 N76 T77 F154 L161 Y166 P168 D172 T176	Y69-V73 WeakPolarHBondContact O-CG2 3.37Å; Y69-V73 PolarHBondContact O-N 3Å; K70-V73 PolarHBondContact O-N 3.19Å; V73-N76 PolarHBondContact O-N 2.94Å; V73-T77 WeakPolarHBondContact O-CB 3.49Å; V73-T77 PolarHBondContact O-N 3.26Å; V73-T77 PolarHBondContact O-OG1 2.78Å; V73-F154 HydrophobicContact CB-CE1 4.33Å; V73-F154 HydrophobicContact CG1-CD1 3.72Å; V73-F154 HydrophobicContact CG1-CE1 3.61Å; V73-F154 HydrophobicContact CG1-CG 4.49Å; V73-F154 HydrophobicContact CG1-CZ 4.3Å; V73-F154 HydrophobicContact CG2-CE1 4.01Å; V73-F154 HydrophobicContact CG2-CZ 4.19Å; V73-L161 HydrophobicContact CG1-CD1 4.21Å; V73-L161 HydrophobicContact CG1-CD2 3.88Å; V73-Y166 HydrophobicContact CG1-CE1 4.34Å; V73-P168 HydrophobicContact CG2-CB 4.48Å; V73-P168 HydrophobicContact CG2-CG 4.35Å; V73-D172 HydrophobicContact CG2-CB 4.13Å; V73-T176 HydrophobicContact CG2-CG2 3.55Å
74	F	95.1	Very high	95.8	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-47.8	179.2	-68.3	-11.4	0	0	0	112.1	K70 P71 V72 N76 T77 I78 L118 F123 L161 Y166	K70-F74 HydrophobicContact CD-CE2 4.27Å; K70-F74 HydrophobicContact CD-CZ 4.32Å; K70-F74 VanDerWaalsContact CE-CZ 3.47Å; K70-F74 HydrophobicContact CG-CD2 4.27Å; K70-F74 HydrophobicContact CG-CE1 4.44Å; K70-F74 HydrophobicContact CG-CE2 3.78Å; K70-F74 HydrophobicContact CG-CZ 3.89Å; K70-F74 WeakPolarHBondContact O-CG 3.39Å; K70-F74 PolarHBondContact O-N 3.45Å; K70-F74 VanDerWaalsContact O-N 3.1Å; P71-F74 PolarHBondContact O-N 3.28Å; V72-F74 VanDerWaalsContact C-N 3.33Å; V72-F74 PolarHBondContact O-N 2.97Å; F74-N76 VanDerWaalsContact C-N 3.35Å; F74-N76 PolarHBondContact O-N 2.9Å; F74-T77 WeakPolarHBondContact O-CB 3.27Å; F74-T77 PolarHBondContact O-N 2.66Å; F74-T77 VanDerWaalsContact O-N 3.17Å; F74-I78 VanDerWaalsContact O-CG1 3.28Å; F74-I78 WeakPolarHBondContact O-CG1 3.45Å; F74-I78 PolarHBondContact O-N 3.16Å; F74-L118 HydrophobicContact CB-CD1 3.77Å; F74-L118 HydrophobicContact CB-CG 3.91Å; F74-L118 HydrophobicContact CD1-CD1 3.76Å; F74-L118 HydrophobicContact CD1-CG 4.35Å; F74-L118 HydrophobicContact CD2-CB 4.28Å; F74-L118 HydrophobicContact CD2-CD1 4.29Å; F74-L118 HydrophobicContact CD2-CG 3.98Å; F74-L118 HydrophobicContact CE1-CD1 4.39Å; F74-L118 HydrophobicContact CE2-CB 4.41Å; F74-L118 HydrophobicContact CG-CD1 3.68Å; F74-L118 HydrophobicContact CG-CG 3.84Å; F74-F123 HydrophobicContact CD1-CZ 4.35Å; F74-F123 AromaticContact CE1-CZ 3.78Å; F74-F123 HydrophobicContact CE1-CZ 3.78Å; F74-F123 AromaticContact CZ-CZ 3.99Å; F74-F123 HydrophobicContact CZ-CZ 3.99Å; F74-L161 HydrophobicContact CE1-CB 4.31Å; F74-Y166 AromaticContact CE1-CD1 3.89Å; F74-Y166 HydrophobicContact CE1-CD1 3.89Å; F74-Y166 AromaticContact CE1-CE1 3.97Å; F74-Y166 HydrophobicContact CE1-CE1 3.97Å; F74-Y166 HydrophobicContact CZ-CD1 4.02Å; F74-Y166 HydrophobicContact CZ-CE1 4.46Å
75	S	93.4	Very high	95.8	Very high	44 Å²	44	32.1 Å²	32.1	31%	0.308	17%	0.171	S	C	.	.	H	α-helix	trans	-56.3	-47.6	175.4	179.4	0	0	0	0	111.7	P71 V72 T77 I78 Q79	P71-S75 VanDerWaalsContact O-CB 3.28Å; P71-S75 WeakPolarHBondContact O-CB 3.37Å; P71-S75 PolarHBondContact O-N 2.63Å; V72-S75 PolarHBondContact O-N 3.33Å; S75-T77 VanDerWaalsContact C-N 3.33Å; S75-T77 PolarHBondContact O-N 3.17Å; S75-I78 PolarHBondContact O-N 3.47Å; S75-Q79 VanDerWaalsContact O-CB 3.25Å; S75-Q79 WeakPolarHBondContact O-CB 3.47Å; S75-Q79 WeakPolarHBondContact O-CG 3.46Å; S75-Q79 PolarHBondContact O-N 3.22Å; S75-Q79 PolarHBondContact OG-NE2 3.46Å
76	N	94.9	Very high	95.8	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.053	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-39.1	178.6	-69.1	166.4	0	0	0	111.9	V72 V73 F74 S80 T176 R177	V72-N76 WeakPolarHBondContact O-CB 3.45Å; V72-N76 PolarHBondContact O-N 3.15Å; V72-N76 PolarHBondContact O-OD1 3.17Å; V73-N76 PolarHBondContact O-N 2.94Å; F74-N76 VanDerWaalsContact C-N 3.35Å; F74-N76 PolarHBondContact O-N 2.9Å; N76-S80 WeakPolarHBondContact O-CB 3.31Å; N76-S80 PolarHBondContact O-N 2.91Å; N76-S80 PolarHBondContact O-OG 2.83Å; N76-T176 WeakPolarHBondContact OD1-CA 3.32Å; N76-R177 PolarHBondContact ND2-O 2.66Å; N76-R177 PolarHBondContact OD1-N 3.48Å; N76-R177 PolarHBondContact OD1-O 3.31Å
77	T	95.9	Very high	95.7	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-49.6	178.1	-54.1	0	0	0	0	111.2	V73 F74 S75 S80 M81 L126 F154 L155 L158 L161	V73-T77 WeakPolarHBondContact O-CB 3.49Å; V73-T77 PolarHBondContact O-N 3.26Å; V73-T77 PolarHBondContact O-OG1 2.78Å; F74-T77 WeakPolarHBondContact O-CB 3.27Å; F74-T77 PolarHBondContact O-N 2.66Å; F74-T77 VanDerWaalsContact O-N 3.17Å; S75-T77 VanDerWaalsContact C-N 3.33Å; S75-T77 PolarHBondContact O-N 3.17Å; T77-S80 PolarHBondContact O-N 3.35Å; T77-M81 PolarHBondContact O-N 3.36Å; T77-M81 VanDerWaalsContact O-N 3.15Å; T77-L126 HydrophobicContact CG2-CD1 4.36Å; T77-F154 HydrophobicContact CG2-CB 4.3Å; T77-F154 WeakPolarHBondContact OG1-CB 3.31Å; T77-L155 HydrophobicContact CG2-CD2 3.75Å; T77-L155 HydrophobicContact CG2-CG 4.39Å; T77-L158 HydrophobicContact CG2-CD2 4.02Å; T77-L161 HydrophobicContact CG2-CD1 4.49Å
78	I	95	Very high	95.8	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-48.8	178.6	-60.1	159.8	0	0	0	110.1	F74 S75 S80 M81 V82 V107 L110 L118	F74-I78 VanDerWaalsContact O-CG1 3.28Å; F74-I78 WeakPolarHBondContact O-CG1 3.45Å; F74-I78 PolarHBondContact O-N 3.16Å; S75-I78 PolarHBondContact O-N 3.47Å; I78-S80 VanDerWaalsContact C-N 3.29Å; I78-S80 PolarHBondContact O-N 3.23Å; I78-M81 PolarHBondContact O-N 3.13Å; I78-M81 VanDerWaalsContact O-N 3.12Å; I78-V82 HydrophobicContact CG2-CG2 4.17Å; I78-V82 WeakPolarHBondContact O-CG2 3.3Å; I78-V82 PolarHBondContact O-N 3.43Å; I78-V107 HydrophobicContact CG2-CG1 4.47Å; I78-L110 HydrophobicContact CD1-CD2 3.99Å; I78-L118 HydrophobicContact CD1-CD1 4.45Å; I78-L118 HydrophobicContact CD1-CD2 3.37Å; I78-L118 HydrophobicContact CD1-CG 4.25Å; I78-L118 HydrophobicContact CG1-CD1 4.36Å; I78-L118 HydrophobicContact CG1-CD2 3.81Å
79	Q	94.7	Very high	95.8	Very high	113 Å²	113	34.7 Å²	34.7	53%	0.528	17%	0.171	S	C	.	.	H	α-helix	trans	-61.2	-38.4	-178.3	-74.6	170.5	-8.1	0	0	112	S75 V82 A83	S75-Q79 VanDerWaalsContact O-CB 3.25Å; S75-Q79 WeakPolarHBondContact O-CB 3.47Å; S75-Q79 WeakPolarHBondContact O-CG 3.46Å; S75-Q79 PolarHBondContact O-N 3.22Å; S75-Q79 PolarHBondContact OG-NE2 3.46Å; Q79-V82 PolarHBondContact O-N 3.4Å; Q79-A83 WeakPolarHBondContact O-CB 3.37Å; Q79-A83 PolarHBondContact O-N 3.27Å
80	S	96.9	Very high	95.8	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-45.9	173.2	-75.7	0	0	0	0	111.9	N76 T77 I78 A83 I84 A151	N76-S80 WeakPolarHBondContact O-CB 3.31Å; N76-S80 PolarHBondContact O-N 2.91Å; N76-S80 PolarHBondContact O-OG 2.83Å; T77-S80 PolarHBondContact O-N 3.35Å; I78-S80 VanDerWaalsContact C-N 3.29Å; I78-S80 PolarHBondContact O-N 3.23Å; S80-A83 PolarHBondContact O-N 2.98Å; S80-I84 WeakPolarHBondContact O-CD1 3.23Å; S80-I84 VanDerWaalsContact O-CG1 3.31Å; S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 2.83Å; S80-I84 VanDerWaalsContact O-N 3.09Å; S80-A151 WeakPolarHBondContact OG-CB 3.29Å
81	M	97.6	Very high	95.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-45.3	175.5	-177.2	60.1	70.7	0	0	111.6	T77 I78 A83 I84 L85 V107 L126 L129 W130 V135 L155	T77-M81 PolarHBondContact O-N 3.36Å; T77-M81 VanDerWaalsContact O-N 3.15Å; I78-M81 PolarHBondContact O-N 3.13Å; I78-M81 VanDerWaalsContact O-N 3.12Å; M81-A83 VanDerWaalsContact C-N 3.3Å; M81-A83 PolarHBondContact O-N 2.8Å; M81-I84 PolarHBondContact O-N 3.22Å; M81-I84 VanDerWaalsContact O-N 3.12Å; M81-L85 HydrophobicContact CG-CD1 3.99Å; M81-L85 HydrophobicContact CG-CG 4.19Å; M81-L85 WeakPolarHBondContact O-CG 3.11Å; M81-L85 PolarHBondContact O-N 3Å; M81-L85 HydrophobicContact SD-CD1 4.47Å; M81-L85 HydrophobicContact SD-CD2 4.35Å; M81-L85 HydrophobicContact SD-CG 4.15Å; M81-V107 HydrophobicContact CB-CG1 4.3Å; M81-V107 HydrophobicContact CG-CG1 3.95Å; M81-L126 HydrophobicContact CB-CD2 3.66Å; M81-L126 HydrophobicContact CE-CD2 4.36Å; M81-L126 HydrophobicContact CG-CD2 3.71Å; M81-L129 HydrophobicContact CE-CB 3.95Å; M81-L129 HydrophobicContact SD-CB 4.02Å; M81-W130 HydrophobicContact CE-CB 3.96Å; M81-W130 HydrophobicContact CE-CE3 4.25Å; M81-V135 HydrophobicContact SD-CG1 4.4Å; M81-L155 HydrophobicContact CB-CD2 4.49Å; M81-L155 HydrophobicContact CE-CD1 4.32Å; M81-L155 HydrophobicContact CE-CD2 3.86Å
82	V	96.2	Very high	96	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.036	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-39.9	177.8	171.8	0	0	0	0	111.9	I78 Q79 I84 L85 R86 V107 L108	I78-V82 HydrophobicContact CG2-CG2 4.17Å; I78-V82 WeakPolarHBondContact O-CG2 3.3Å; I78-V82 PolarHBondContact O-N 3.43Å; Q79-V82 PolarHBondContact O-N 3.4Å; V82-I84 VanDerWaalsContact C-N 3.34Å; V82-L85 PolarHBondContact O-N 2.58Å; V82-R86 HydrophobicContact CG1-CG 4.47Å; V82-R86 WeakPolarHBondContact O-CB 3.24Å; V82-R86 WeakPolarHBondContact O-CG 3.48Å; V82-R86 PolarHBondContact O-N 2.92Å; V82-V107 HydrophobicContact CG2-CG1 4Å; V82-L108 HydrophobicContact CG1-CD2 3.97Å; V82-L108 HydrophobicContact CG2-CD2 4.18Å
83	A	96.9	Very high	96.1	Very high	27 Å²	27	44.3 Å²	44.3	22%	0.223	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-44.6	175	0	0	0	0	0	111.2	Q79 S80 M81 A87 L147	Q79-A83 WeakPolarHBondContact O-CB 3.37Å; Q79-A83 PolarHBondContact O-N 3.27Å; S80-A83 PolarHBondContact O-N 2.98Å; M81-A83 VanDerWaalsContact C-N 3.3Å; M81-A83 PolarHBondContact O-N 2.8Å; A83-A87 WeakPolarHBondContact O-CB 3.4Å; A83-A87 PolarHBondContact O-N 3.16Å; A83-L147 HydrophobicContact CB-CD1 4.38Å
84	I	98.2	Very high	96.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-48	176.9	-62.6	159.1	0	0	0	111	S80 M81 V82 R86 A87 M88 W130 V135 A138 V139 F145 L147 L155	S80-I84 WeakPolarHBondContact O-CD1 3.23Å; S80-I84 VanDerWaalsContact O-CG1 3.31Å; S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 2.83Å; S80-I84 VanDerWaalsContact O-N 3.09Å; M81-I84 PolarHBondContact O-N 3.22Å; M81-I84 VanDerWaalsContact O-N 3.12Å; V82-I84 VanDerWaalsContact C-N 3.34Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 2.88Å; I84-A87 CarbonylContact O-C 3.53Å; I84-A87 WeakPolarHBondContact O-CB 3.39Å; I84-A87 PolarHBondContact O-N 2.93Å; I84-A87 VanDerWaalsContact O-N 3.13Å; I84-M88 HydrophobicContact CG2-CG 4.46Å; I84-M88 HydrophobicContact CG2-SD 4.39Å; I84-M88 WeakPolarHBondContact O-CG 3.43Å; I84-M88 PolarHBondContact O-N 3.47Å; I84-W130 HydrophobicContact CD1-CZ3 3.9Å; I84-V135 HydrophobicContact CG2-CG1 3.93Å; I84-A138 HydrophobicContact CG2-CB 3.88Å; I84-V139 HydrophobicContact CD1-CG2 3.72Å; I84-V139 HydrophobicContact CG1-CG2 4.15Å; I84-V139 HydrophobicContact CG2-CG2 4.28Å; I84-F145 HydrophobicContact CG1-CE2 4.22Å; I84-F145 HydrophobicContact CG1-CZ 4.33Å; I84-L147 HydrophobicContact CD1-CD1 4.1Å; I84-L147 HydrophobicContact CD1-CD2 4.36Å; I84-L147 HydrophobicContact CG1-CD1 3.78Å; I84-L147 HydrophobicContact CG1-CD2 4.13Å; I84-L155 HydrophobicContact CD1-CD1 4.07Å
85	L	97	Very high	96	Very high	16 Å²	16	50.9 Å²	50.9	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-38.9	-178.9	-66.7	176.7	0	0	0	112.7	M81 V82 M88 E89 I104 V107 L129 V135	M81-L85 HydrophobicContact CG-CD1 3.99Å; M81-L85 HydrophobicContact CG-CG 4.19Å; M81-L85 WeakPolarHBondContact O-CG 3.11Å; M81-L85 PolarHBondContact O-N 3Å; M81-L85 HydrophobicContact SD-CD1 4.47Å; M81-L85 HydrophobicContact SD-CD2 4.35Å; M81-L85 HydrophobicContact SD-CG 4.15Å; V82-L85 PolarHBondContact O-N 2.58Å; L85-M88 HydrophobicContact CD2-SD 4.05Å; L85-M88 WeakPolarHBondContact O-CB 3.42Å; L85-M88 PolarHBondContact O-N 3.13Å; L85-E89 PolarHBondContact O-N 3.49Å; L85-I104 HydrophobicContact CD1-CG1 4.14Å; L85-I104 HydrophobicContact CD1-CG2 4.36Å; L85-I104 HydrophobicContact CD2-CD1 4.33Å; L85-I104 HydrophobicContact CD2-CG1 3.86Å; L85-V107 HydrophobicContact CD1-CB 4.49Å; L85-V107 HydrophobicContact CD1-CG1 4.3Å; L85-L129 HydrophobicContact CD1-CD1 4.2Å; L85-L129 HydrophobicContact CD2-CD2 4.41Å; L85-V135 HydrophobicContact CD2-CG2 4.31Å
86	R	96	Very high	96	Very high	143 Å²	143	51.9 Å²	51.9	54%	0.54	27%	0.27	S	S	.	.	H	α-helix	trans	-68	-38.9	173.9	-72.5	176	-179.7	165.2	3.6	111.9	V82 I84 M88 E89 Q90	V82-R86 HydrophobicContact CG1-CG 4.47Å; V82-R86 WeakPolarHBondContact O-CB 3.24Å; V82-R86 WeakPolarHBondContact O-CG 3.48Å; V82-R86 PolarHBondContact O-N 2.92Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 2.88Å; R86-M88 VanDerWaalsContact C-N 3.31Å; R86-E89 PolarHBondContact O-N 3.04Å; R86-Q90 WeakPolarHBondContact O-CG 3.36Å; R86-Q90 PolarHBondContact O-N 2.97Å
87	A	97.2	Very high	95.8	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-65.1	-36.8	175	0	0	0	0	0	111.6	A83 I84 E89 Q90 L91 F145	A83-A87 WeakPolarHBondContact O-CB 3.4Å; A83-A87 PolarHBondContact O-N 3.16Å; I84-A87 CarbonylContact O-C 3.53Å; I84-A87 WeakPolarHBondContact O-CB 3.39Å; I84-A87 PolarHBondContact O-N 2.93Å; I84-A87 VanDerWaalsContact O-N 3.13Å; A87-E89 VanDerWaalsContact C-N 3.3Å; A87-E89 PolarHBondContact O-N 3.16Å; A87-Q90 PolarHBondContact O-N 2.72Å; A87-L91 VanDerWaalsContact O-CB 3.25Å; A87-L91 WeakPolarHBondContact O-CB 3.41Å; A87-L91 WeakPolarHBondContact O-CG 3.35Å; A87-L91 PolarHBondContact O-N 2.84Å; A87-F145 HydrophobicContact CB-CB 3.94Å; A87-F145 HydrophobicContact CB-CD1 3.37Å; A87-F145 HydrophobicContact CB-CD2 3.56Å; A87-F145 HydrophobicContact CB-CE1 3.57Å; A87-F145 HydrophobicContact CB-CE2 3.77Å; A87-F145 HydrophobicContact CB-CG 3.35Å; A87-F145 HydrophobicContact CB-CZ 3.78Å
88	M	97.4	Very high	95	Very high	7 Å²	7	62.9 Å²	62.9	3%	0.034	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-43.3	174.2	-74	176.2	73.9	0	0	112.2	I84 L85 R86 L91 Q92 I93 C95 V135 A138	I84-M88 HydrophobicContact CG2-CG 4.46Å; I84-M88 HydrophobicContact CG2-SD 4.39Å; I84-M88 WeakPolarHBondContact O-CG 3.43Å; I84-M88 PolarHBondContact O-N 3.47Å; L85-M88 HydrophobicContact CD2-SD 4.05Å; L85-M88 WeakPolarHBondContact O-CB 3.42Å; L85-M88 PolarHBondContact O-N 3.13Å; R86-M88 VanDerWaalsContact C-N 3.31Å; M88-L91 PolarHBondContact O-N 3.27Å; M88-Q92 PolarHBondContact O-N 2.86Å; M88-I93 HydrophobicContact CB-CB 4.32Å; M88-I93 HydrophobicContact CE-CG2 4.13Å; M88-I93 WeakPolarHBondContact CE-O 3.4Å; M88-I93 HydrophobicContact CG-CB 4.29Å; M88-I93 PolarHBondContact O-N 3.33Å; M88-C95 VanDerWaalsContact CE-SG 3.51Å; M88-V135 HydrophobicContact CE-CG2 4.09Å; M88-V135 HydrophobicContact SD-CB 4.25Å; M88-V135 HydrophobicContact SD-CG2 3.51Å; M88-V135 VanDerWaalsContact SD-CG2 3.51Å; M88-A138 HydrophobicContact CG-CB 3.47Å; M88-A138 VanDerWaalsContact CG-CB 3.47Å; M88-A138 HydrophobicContact SD-CB 4.44Å
89	E	95.1	Very high	94.4	Very high	163 Å²	163	67.8 Å²	67.8	76%	0.762	35%	0.353	S	S	*	.	H	α-helix	trans	-61.3	-47.2	175.2	-175	177.5	-162.5	0	0	111.5	L85 R86 A87 L91 Q92	L85-E89 PolarHBondContact O-N 3.49Å; R86-E89 PolarHBondContact O-N 3.04Å; A87-E89 VanDerWaalsContact C-N 3.3Å; A87-E89 PolarHBondContact O-N 3.16Å; E89-L91 PolarHBondContact O-N 3.42Å; E89-Q92 PolarHBondContact O-N 3.37Å
90	Q	95.3	Very high	94.2	Very high	146 Å²	146	62.6 Å²	62.6	68%	0.682	33%	0.33	S	S	*	.	H	α-helix	trans	-64.7	-38.9	179.4	-68.2	175.9	-8.2	0	0	113	R86 A87 Q92	R86-Q90 WeakPolarHBondContact O-CG 3.36Å; R86-Q90 PolarHBondContact O-N 2.97Å; A87-Q90 PolarHBondContact O-N 2.72Å; Q90-Q92 VanDerWaalsContact C-N 3.3Å
91	L	97	Very high	93.9	Very high	30 Å²	30	69.2 Å²	69.2	16%	0.157	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	2.3	-177.5	-60.7	-178.8	0	0	0	113.1	A87 M88 E89 I93 R141 E144 F145	A87-L91 VanDerWaalsContact O-CB 3.25Å; A87-L91 WeakPolarHBondContact O-CB 3.41Å; A87-L91 WeakPolarHBondContact O-CG 3.35Å; A87-L91 PolarHBondContact O-N 2.84Å; M88-L91 PolarHBondContact O-N 3.27Å; E89-L91 PolarHBondContact O-N 3.42Å; L91-I93 VanDerWaalsContact C-N 3.31Å; L91-I93 HydrophobicContact CB-CD1 3.77Å; L91-I93 HydrophobicContact CB-CG1 3.91Å; L91-I93 HydrophobicContact CD1-CD1 4.1Å; L91-I93 PolarHBondContact O-N 2.87Å; L91-R141 HydrophobicContact CD1-CB 4.07Å; L91-E144 HydrophobicContact CD1-CB 4.47Å; L91-E144 HydrophobicContact CD2-CB 4.22Å; L91-E144 WeakPolarHBondContact CD2-OE2 3.4Å; L91-F145 HydrophobicContact CD1-CD1 4.27Å; L91-F145 HydrophobicContact CD1-CE1 4.38Å
92	Q	96.7	Very high	93.7	Very high	179 Å²	179	72.5 Å²	72.5	84%	0.836	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	42.2	-178.5	-56.5	-176.6	-38.6	0	0	113.2	M88 E89 Q90	M88-Q92 PolarHBondContact O-N 2.86Å; E89-Q92 PolarHBondContact O-N 3.37Å; Q90-Q92 VanDerWaalsContact C-N 3.3Å
93	I	96.4	Very high	93.7	Very high	26 Å²	26	72.7 Å²	72.7	13%	0.133	39%	0.385	C	S	.	.			trans	-100.8	115.5	178.1	-55.4	170.7	0	0	0	108.6	M88 L91 G134 T137 A138	M88-I93 HydrophobicContact CB-CB 4.32Å; M88-I93 HydrophobicContact CE-CG2 4.13Å; M88-I93 WeakPolarHBondContact CE-O 3.4Å; M88-I93 HydrophobicContact CG-CB 4.29Å; M88-I93 PolarHBondContact O-N 3.33Å; L91-I93 VanDerWaalsContact C-N 3.31Å; L91-I93 HydrophobicContact CB-CD1 3.77Å; L91-I93 HydrophobicContact CB-CG1 3.91Å; L91-I93 HydrophobicContact CD1-CD1 4.1Å; L91-I93 PolarHBondContact O-N 2.87Å; I93-G134 WeakPolarHBondContact CG2-O 3.34Å; I93-T137 HydrophobicContact CD1-CG2 4.2Å; I93-T137 HydrophobicContact CG2-CG2 4.44Å; I93-A138 HydrophobicContact CD1-CB 3.88Å
94	C	94.4	Very high	93.6	Very high	109 Å²	109	73 Å²	73	74%	0.736	38%	0.383	S	S	*	.			trans	-81.5	148	174.8	-63.1	0	0	0	0	111.2
95	C	94	Very high	93.3	Very high	33 Å²	33	75 Å²	75	22%	0.223	40%	0.4	C	S	.	.			trans	-65.7	145.4	164.5	-66.6	0	0	0	0	110	M88 A100 D132	M88-C95 VanDerWaalsContact CE-SG 3.51Å; C95-A100 HydrophobicContact CB-CB 3.25Å; C95-D132 WeakPolarHBondContact CA-OD1 3.46Å
96	A	92.7	Very high	93.1	Very high	64 Å²	64	75.9 Å²	75.9	53%	0.529	41%	0.406	S	S	.	.	S	Bend	trans	-82	-32.2	178.4	0	0	0	0	0	112	D132 P133	A96-D132 PolarHBondContact N-OD1 3.4Å; A96-D132 VanDerWaalsContact N-OD1 3.1Å; A96-D132 PolarHBondContact N-OD2 2.81Å; A96-P133 HydrophobicContact CB-CB 4.2Å; A96-P133 HydrophobicContact CB-CG 4.02Å
97	Y	90.4	Very high	93	Very high	123 Å²	123	69.1 Å²	69.1	48%	0.482	38%	0.38	S	S	.	.	S	Bend	trans	-87.3	138.9	-175.6	-61.7	-51.5	0	0	0	113.3	N99 A100 D132	Y97-N99 VanDerWaalsContact C-N 3.31Å; Y97-N99 PolarHBondContact O-N 3.22Å; Y97-A100 WeakPolarHBondContact O-CB 3.42Å; Y97-A100 PolarHBondContact O-N 2.69Å; Y97-A100 VanDerWaalsContact O-N 3.16Å; Y97-D132 HydrophobicContact CD2-CB 3.93Å; Y97-D132 WeakPolarHBondContact CD2-OD2 3.21Å; Y97-D132 HydrophobicContact CE2-CB 4.23Å; Y97-D132 PolarHBondContact N-OD2 2.67Å
98	P	80.2	Confident	92.7	Very high	120 Å²	120	71.4 Å²	71.4	78%	0.779	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-28.7	-174.4	23.9	-33.3	0	0	0	114	A100	P98-A100 VanDerWaalsContact C-N 3.26Å; P98-A100 PolarHBondContact O-N 2.91Å
99	N	83.3	Confident	92.3	Very high	110 Å²	110	75.8 Å²	75.8	59%	0.588	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	4.1	179.5	-64.2	-16.3	0	0	0	113.2	Y97 M101 S102 D103	Y97-N99 VanDerWaalsContact C-N 3.31Å; Y97-N99 PolarHBondContact O-N 3.22Å; N99-M101 VanDerWaalsContact C-N 3.25Å; N99-M101 PolarHBondContact O-N 3.16Å; N99-S102 PolarHBondContact O-N 3.06Å; N99-S102 PolarHBondContact O-OG 3.32Å; N99-D103 PolarHBondContact O-N 3.36Å
100	A	89.1	Confident	91.9	Very high	5 Å²	5	69.4 Å²	69.4	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-62	-32.8	-176	0	0	0	0	0	112.8	C95 Y97 P98 S102 D103 I104 L129	C95-A100 HydrophobicContact CB-CB 3.25Å; Y97-A100 WeakPolarHBondContact O-CB 3.42Å; Y97-A100 PolarHBondContact O-N 2.69Å; Y97-A100 VanDerWaalsContact O-N 3.16Å; P98-A100 VanDerWaalsContact C-N 3.26Å; P98-A100 PolarHBondContact O-N 2.91Å; A100-S102 PolarHBondContact O-N 3.25Å; A100-D103 PolarHBondContact O-N 2.92Å; A100-I104 WeakPolarHBondContact O-CB 3.2Å; A100-I104 WeakPolarHBondContact O-CG1 3.18Å; A100-I104 PolarHBondContact O-N 3.36Å; A100-L129 HydrophobicContact CB-CD2 4.28Å
101	M	90.8	Very high	91.2	Very high	145 Å²	145	64.4 Å²	64.4	71%	0.714	37%	0.368	S	S	*	.	H	α-helix	trans	-63.3	-39.1	-178.7	-69.1	-59.5	-66	0	0	113.2	N99 I104 A105	N99-M101 VanDerWaalsContact C-N 3.25Å; N99-M101 PolarHBondContact O-N 3.16Å; M101-I104 HydrophobicContact SD-CD1 4.37Å; M101-A105 PolarHBondContact O-N 3.09Å; M101-A105 VanDerWaalsContact O-N 3.13Å
102	S	93.4	Very high	90.2	Very high	68 Å²	68	72.6 Å²	72.6	48%	0.476	40%	0.397	S	S	.	.	H	α-helix	trans	-68.5	-41.6	175.2	52.2	0	0	0	0	111.2	N99 A100 A105 V106	N99-S102 PolarHBondContact O-N 3.06Å; N99-S102 PolarHBondContact O-OG 3.32Å; A100-S102 PolarHBondContact O-N 3.25Å; S102-A105 PolarHBondContact O-N 3.44Å; S102-V106 WeakPolarHBondContact O-CG2 3.43Å; S102-V106 PolarHBondContact O-N 2.63Å
103	D	95.5	Very high	89.1	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.053	38%	0.38	C	S	.	.	H	α-helix	trans	-65.1	-41	178.9	-69.5	-24.1	0	0	0	111.7	N99 A100 A105 V106 V107 A125 R128 L129	N99-D103 PolarHBondContact O-N 3.36Å; A100-D103 PolarHBondContact O-N 2.92Å; D103-A105 VanDerWaalsContact C-N 3.35Å; D103-A105 PolarHBondContact O-N 3.02Å; D103-V106 PolarHBondContact O-N 3.24Å; D103-V107 WeakPolarHBondContact O-CG2 3.37Å; D103-V107 PolarHBondContact O-N 3.1Å; D103-V107 VanDerWaalsContact O-N 3.07Å; D103-A125 HydrophobicContact CB-CB 3.87Å; D103-R128 IonicContact OD1-CZ 3.38Å; D103-R128 IonicContact OD1-NE 3.15Å; D103-R128 PolarHBondContact OD1-NE 2.81Å; D103-R128 IonicContact OD1-NH2 3.81Å; D103-R128 PolarHBondContact OD1-NH2 3.2Å; D103-R128 WeakPolarHBondContact OD2-CB 3.3Å; D103-R128 IonicContact OD2-CZ 2.71Å; D103-R128 IonicContact OD2-NE 2.73Å; D103-R128 PolarHBondContact OD2-NE 3.18Å; D103-R128 IonicContact OD2-NH2 3.69Å; D103-L129 HydrophobicContact CB-CD1 3.91Å; D103-L129 HydrophobicContact CB-CD2 3.99Å; D103-L129 HydrophobicContact CB-CG 3.77Å
104	I	94.6	Very high	87.8	Confident	33 Å²	33	74.9 Å²	74.9	17%	0.169	42%	0.417	C	S	.	.	H	α-helix	trans	-58.3	-47.5	173.8	-72.4	166.8	0	0	0	110.3	L85 A100 M101 V106 V107 L108 L129	L85-I104 HydrophobicContact CD1-CG1 4.14Å; L85-I104 HydrophobicContact CD1-CG2 4.36Å; L85-I104 HydrophobicContact CD2-CD1 4.33Å; L85-I104 HydrophobicContact CD2-CG1 3.86Å; A100-I104 WeakPolarHBondContact O-CB 3.2Å; A100-I104 WeakPolarHBondContact O-CG1 3.18Å; A100-I104 PolarHBondContact O-N 3.36Å; M101-I104 HydrophobicContact SD-CD1 4.37Å; I104-V106 VanDerWaalsContact C-N 3.35Å; I104-V106 PolarHBondContact O-N 2.81Å; I104-V107 PolarHBondContact O-N 2.94Å; I104-L108 HydrophobicContact CG2-CD1 3.57Å; I104-L108 HydrophobicContact CG2-CG 4.13Å; I104-L108 WeakPolarHBondContact O-CB 3.35Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.45Å; I104-L108 PolarHBondContact O-N 3.08Å; I104-L129 HydrophobicContact CG1-CD1 4.48Å; I104-L129 HydrophobicContact CG1-CD2 3.87Å
105	A	93.2	Very high	86.4	Confident	44 Å²	44	70.9 Å²	70.9	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-42.3	-179.8	0	0	0	0	0	112	M101 S102 D103 N109	M101-A105 PolarHBondContact O-N 3.09Å; M101-A105 VanDerWaalsContact O-N 3.13Å; S102-A105 PolarHBondContact O-N 3.44Å; D103-A105 VanDerWaalsContact C-N 3.35Å; D103-A105 PolarHBondContact O-N 3.02Å; A105-N109 VanDerWaalsContact O-CB 3.3Å; A105-N109 WeakPolarHBondContact O-CB 3.27Å; A105-N109 PolarHBondContact O-N 3.46Å; A105-N109 PolarHBondContact O-ND2 3.49Å; A105-N109 VanDerWaalsContact O-ND2 3.14Å
106	V	92.7	Very high	85.5	Confident	34 Å²	34	75 Å²	75	21%	0.206	41%	0.409	C	S	.	.	H	α-helix	trans	-58.9	-50.6	176.1	169.2	0	0	0	0	111	S102 D103 I104 L110 V122 A125	S102-V106 WeakPolarHBondContact O-CG2 3.43Å; S102-V106 PolarHBondContact O-N 2.63Å; D103-V106 PolarHBondContact O-N 3.24Å; I104-V106 VanDerWaalsContact C-N 3.35Å; I104-V106 PolarHBondContact O-N 2.81Å; V106-L110 PolarHBondContact O-N 3.05Å; V106-V122 HydrophobicContact CG1-CB 4.42Å; V106-V122 HydrophobicContact CG1-CG2 3.69Å; V106-A125 HydrophobicContact CB-CB 4.38Å; V106-A125 HydrophobicContact CG1-CB 4.17Å
107	V	93.2	Very high	84.9	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-66	-44.5	-178.4	174.3	0	0	0	0	111.9	I78 M81 V82 L85 D103 I104 N109 L110 S111 A125 L126 L129	I78-V107 HydrophobicContact CG2-CG1 4.47Å; M81-V107 HydrophobicContact CB-CG1 4.3Å; M81-V107 HydrophobicContact CG-CG1 3.95Å; V82-V107 HydrophobicContact CG2-CG1 4Å; L85-V107 HydrophobicContact CD1-CB 4.49Å; L85-V107 HydrophobicContact CD1-CG1 4.3Å; D103-V107 WeakPolarHBondContact O-CG2 3.37Å; D103-V107 PolarHBondContact O-N 3.1Å; D103-V107 VanDerWaalsContact O-N 3.07Å; I104-V107 PolarHBondContact O-N 2.94Å; V107-N109 PolarHBondContact O-N 3.46Å; V107-L110 PolarHBondContact O-N 2.87Å; V107-S111 PolarHBondContact O-N 3.21Å; V107-S111 VanDerWaalsContact O-N 3.13Å; V107-A125 HydrophobicContact CG2-CB 4.16Å; V107-L126 HydrophobicContact CG1-CD2 4.08Å; V107-L126 HydrophobicContact CG2-CD2 3.81Å; V107-L126 HydrophobicContact CG2-CG 4.17Å; V107-L129 HydrophobicContact CG2-CD1 3.88Å
108	L	91.6	Very high	84.7	Confident	51 Å²	51	71.3 Å²	71.3	27%	0.267	39%	0.393	S	S	.	.	H	α-helix	trans	-65.6	-38	-179.8	-71.4	178.4	0	0	0	112.5	V82 I104 S111	V82-L108 HydrophobicContact CG1-CD2 3.97Å; V82-L108 HydrophobicContact CG2-CD2 4.18Å; I104-L108 HydrophobicContact CG2-CD1 3.57Å; I104-L108 HydrophobicContact CG2-CG 4.13Å; I104-L108 WeakPolarHBondContact O-CB 3.35Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.45Å; I104-L108 PolarHBondContact O-N 3.08Å; L108-S111 PolarHBondContact O-OG 2.99Å
109	N	89.3	Confident	85.1	Confident	98 Å²	98	68.4 Å²	68.4	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-43.8	177.7	-77.2	-27.2	0	0	0	111.6	A105 V107 S111 R112	A105-N109 VanDerWaalsContact O-CB 3.3Å; A105-N109 WeakPolarHBondContact O-CB 3.27Å; A105-N109 PolarHBondContact O-N 3.46Å; A105-N109 PolarHBondContact O-ND2 3.49Å; A105-N109 VanDerWaalsContact O-ND2 3.14Å; V107-N109 PolarHBondContact O-N 3.46Å; N109-S111 VanDerWaalsContact C-N 3.33Å; N109-S111 PolarHBondContact O-N 3.38Å; N109-R112 PolarHBondContact O-N 3.4Å
110	L	85.9	Confident	85.4	Confident	29 Å²	29	71.5 Å²	71.5	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-67.6	-32.7	179.8	-167.3	75.8	0	0	0	112.8	I78 V106 V107 R112 T113 V115 L118 V122	I78-L110 HydrophobicContact CD1-CD2 3.99Å; V106-L110 PolarHBondContact O-N 3.05Å; V107-L110 PolarHBondContact O-N 2.87Å; L110-R112 PolarHBondContact O-N 3.12Å; L110-T113 PolarHBondContact O-N 3.23Å; L110-T113 PolarHBondContact O-OG1 3.13Å; L110-V115 HydrophobicContact CD1-CG2 3.61Å; L110-V115 HydrophobicContact CD2-CG1 4.45Å; L110-V115 HydrophobicContact CD2-CG2 4.11Å; L110-V115 HydrophobicContact CG-CG2 3.68Å; L110-L118 HydrophobicContact CD2-CD2 3.33Å; L110-V122 HydrophobicContact CD2-CB 4.14Å; L110-V122 HydrophobicContact CD2-CG1 3.65Å; L110-V122 HydrophobicContact CD2-CG2 3.77Å
111	S	80.7	Confident	85.5	Confident	41 Å²	41	77.8 Å²	77.8	29%	0.287	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-11.6	179.4	75.9	0	0	0	0	114.9	V107 L108 N109	V107-S111 PolarHBondContact O-N 3.21Å; V107-S111 VanDerWaalsContact O-N 3.13Å; L108-S111 PolarHBondContact O-OG 2.99Å; N109-S111 VanDerWaalsContact C-N 3.33Å; N109-S111 PolarHBondContact O-N 3.38Å
112	R	75.5	Confident	85.6	Confident	203 Å²	203	71.1 Å²	71.1	77%	0.766	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.7	177.6	-60.8	176	175.6	173.9	-1.7	113.2	N109 L110	N109-R112 PolarHBondContact O-N 3.4Å; L110-R112 PolarHBondContact O-N 3.12Å
113	T	74	Confident	85.7	Confident	79 Å²	79	68.7 Å²	68.7	49%	0.485	36%	0.362	S	S	.	.	S	Bend	trans	-114.6	147.5	-178.9	53.8	0	0	0	0	110.6	L110 V115	L110-T113 PolarHBondContact O-N 3.23Å; L110-T113 PolarHBondContact O-OG1 3.13Å; T113-V115 WeakPolarHBondContact O-CG2 3.49Å; T113-V115 PolarHBondContact O-N 2.91Å; T113-V115 WeakPolarHBondContact OG1-CG2 3.47Å
114	D	68.6	Low	85.7	Confident	173 Å²	173	69.3 Å²	69.3	93%	0.925	37%	0.371	S	S	*	.			trans	-73.1	122.3	165.7	-69.7	-40.9	0	0	0	108.3
115	V	65.9	Low	85.7	Confident	25 Å²	25	67.8 Å²	67.8	15%	0.152	36%	0.362	C	S	.	.			trans	-123.8	106.1	-172.9	-174.5	0	0	0	0	110.4	L110 T113 V117 L118	L110-V115 HydrophobicContact CD1-CG2 3.61Å; L110-V115 HydrophobicContact CD2-CG1 4.45Å; L110-V115 HydrophobicContact CD2-CG2 4.11Å; L110-V115 HydrophobicContact CG-CG2 3.68Å; T113-V115 WeakPolarHBondContact O-CG2 3.49Å; T113-V115 PolarHBondContact O-N 2.91Å; T113-V115 WeakPolarHBondContact OG1-CG2 3.47Å; V115-V117 VanDerWaalsContact C-N 3.3Å; V115-V117 WeakPolarHBondContact CG1-O 3.2Å; V115-L118 HydrophobicContact CG1-CD2 4.28Å
116	D	74.9	Confident	85.9	Confident	119 Å²	119	65.7 Å²	65.7	64%	0.636	35%	0.345	S	S	*	.	S	Bend	trans	-71.8	-29.2	170.3	-66	-39.4	0	0	0	111.8
117	V	81.1	Confident	86.1	Confident	102 Å²	102	67.4 Å²	67.4	62%	0.618	35%	0.35	S	S	*	.	S	Bend	trans	-137.6	119.1	-176.2	-175.8	0	0	0	0	110.9	V115 P119	V115-V117 VanDerWaalsContact C-N 3.3Å; V115-V117 WeakPolarHBondContact CG1-O 3.2Å; V117-P119 WeakPolarHBondContact O-CD 3.44Å
118	L	84.9	Confident	86.2	Confident	8 Å²	8	73.3 Å²	73.3	4%	0.042	37%	0.372	C	S	.	.			trans	-73.3	122.7	173.5	-81.7	177.1	0	0	0	111.2	F74 I78 L110 V115 V122 F123 L126	F74-L118 HydrophobicContact CB-CD1 3.77Å; F74-L118 HydrophobicContact CB-CG 3.91Å; F74-L118 HydrophobicContact CD1-CD1 3.76Å; F74-L118 HydrophobicContact CD1-CG 4.35Å; F74-L118 HydrophobicContact CD2-CB 4.28Å; F74-L118 HydrophobicContact CD2-CD1 4.29Å; F74-L118 HydrophobicContact CD2-CG 3.98Å; F74-L118 HydrophobicContact CE1-CD1 4.39Å; F74-L118 HydrophobicContact CE2-CB 4.41Å; F74-L118 HydrophobicContact CG-CD1 3.68Å; F74-L118 HydrophobicContact CG-CG 3.84Å; I78-L118 HydrophobicContact CD1-CD1 4.45Å; I78-L118 HydrophobicContact CD1-CD2 3.37Å; I78-L118 HydrophobicContact CD1-CG 4.25Å; I78-L118 HydrophobicContact CG1-CD1 4.36Å; I78-L118 HydrophobicContact CG1-CD2 3.81Å; L110-L118 HydrophobicContact CD2-CD2 3.33Å; V115-L118 HydrophobicContact CG1-CD2 4.28Å; L118-V122 HydrophobicContact CD2-CB 4.44Å; L118-V122 HydrophobicContact CD2-CG1 3.83Å; L118-F123 HydrophobicContact CB-CD2 3.81Å; L118-F123 HydrophobicContact CB-CE1 4.33Å; L118-F123 HydrophobicContact CB-CE2 3.23Å; L118-F123 HydrophobicContact CB-CZ 3.54Å; L118-F123 HydrophobicContact CD1-CD1 4.39Å; L118-F123 HydrophobicContact CD1-CE1 3.7Å; L118-F123 HydrophobicContact CD1-CE2 4.16Å; L118-F123 HydrophobicContact CD1-CZ 3.58Å; L118-F123 HydrophobicContact CG-CE2 4.32Å; L118-F123 HydrophobicContact CG-CZ 4.18Å; L118-F123 WeakPolarHBondContact O-CE2 3.45Å; L118-L126 HydrophobicContact CD1-CD1 4.42Å
119	P	88.3	Confident	86.5	Confident	59 Å²	59	70.9 Å²	70.9	38%	0.383	36%	0.36	S	S	.	.			trans	-60.8	149.9	171.7	-22.5	33.1	0	0	0	112.4	V117 E121 V122 F123	V117-P119 WeakPolarHBondContact O-CD 3.44Å; P119-E121 PolarHBondContact O-N 3.5Å; P119-V122 HydrophobicContact CB-CG2 4.21Å; P119-V122 HydrophobicContact CG-CG2 4.18Å; P119-V122 WeakPolarHBondContact O-CB 3.4Å; P119-V122 PolarHBondContact O-N 3Å; P119-F123 PolarHBondContact O-N 3.06Å; P119-F123 VanDerWaalsContact O-N 3.17Å
120	E	89.8	Confident	86.9	Confident	175 Å²	175	66.4 Å²	66.4	82%	0.818	34%	0.335	S	S	*	.	H	α-helix	trans	-57.7	-37.9	178.3	-173.5	176	-177.5	0	0	112.4	V122 F123 G124	E120-V122 PolarHBondContact O-N 3.47Å; E120-F123 PolarHBondContact O-N 3.26Å; E120-G124 PolarHBondContact O-N 3Å
121	E	91.8	Very high	87.4	Confident	137 Å²	137	70.8 Å²	70.8	64%	0.64	35%	0.351	S	S	*	.	H	α-helix	trans	-56.2	-40.3	174.7	-176.2	179.3	-174.1	0	0	112.1	P119 G124 A125	P119-E121 PolarHBondContact O-N 3.5Å; E121-G124 PolarHBondContact O-N 3.38Å; E121-A125 PolarHBondContact O-N 3.1Å
122	V	93.4	Very high	88.2	Confident	6 Å²	6	69 Å²	69	4%	0.036	34%	0.338	C	S	.	.	H	α-helix	trans	-73.2	-41.2	-178.7	176.1	0	0	0	0	110.4	V106 L110 L118 P119 E120 G124 A125 L126	V106-V122 HydrophobicContact CG1-CB 4.42Å; V106-V122 HydrophobicContact CG1-CG2 3.69Å; L110-V122 HydrophobicContact CD2-CB 4.14Å; L110-V122 HydrophobicContact CD2-CG1 3.65Å; L110-V122 HydrophobicContact CD2-CG2 3.77Å; L118-V122 HydrophobicContact CD2-CB 4.44Å; L118-V122 HydrophobicContact CD2-CG1 3.83Å; P119-V122 HydrophobicContact CB-CG2 4.21Å; P119-V122 HydrophobicContact CG-CG2 4.18Å; P119-V122 WeakPolarHBondContact O-CB 3.4Å; P119-V122 PolarHBondContact O-N 3Å; E120-V122 PolarHBondContact O-N 3.47Å; V122-G124 VanDerWaalsContact C-N 3.28Å; V122-G124 PolarHBondContact O-N 2.91Å; V122-A125 PolarHBondContact O-N 3.05Å; V122-L126 HydrophobicContact CG1-CD1 4.09Å; V122-L126 HydrophobicContact CG1-CG 4.24Å; V122-L126 WeakPolarHBondContact O-CB 3.45Å; V122-L126 VanDerWaalsContact O-CG 3.28Å; V122-L126 WeakPolarHBondContact O-CG 3.49Å; V122-L126 PolarHBondContact O-N 2.96Å
123	F	94.9	Very high	89.2	Confident	17 Å²	17	62.3 Å²	62.3	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-41.9	171.8	-81.1	-66.8	0	0	0	111.7	F74 L118 P119 E120 L126 K127 L158 L161	F74-F123 HydrophobicContact CD1-CZ 4.35Å; F74-F123 AromaticContact CE1-CZ 3.78Å; F74-F123 HydrophobicContact CE1-CZ 3.78Å; F74-F123 AromaticContact CZ-CZ 3.99Å; F74-F123 HydrophobicContact CZ-CZ 3.99Å; L118-F123 HydrophobicContact CB-CD2 3.81Å; L118-F123 HydrophobicContact CB-CE1 4.33Å; L118-F123 HydrophobicContact CB-CE2 3.23Å; L118-F123 HydrophobicContact CB-CZ 3.54Å; L118-F123 HydrophobicContact CD1-CD1 4.39Å; L118-F123 HydrophobicContact CD1-CE1 3.7Å; L118-F123 HydrophobicContact CD1-CE2 4.16Å; L118-F123 HydrophobicContact CD1-CZ 3.58Å; L118-F123 HydrophobicContact CG-CE2 4.32Å; L118-F123 HydrophobicContact CG-CZ 4.18Å; L118-F123 WeakPolarHBondContact O-CE2 3.45Å; P119-F123 PolarHBondContact O-N 3.06Å; P119-F123 VanDerWaalsContact O-N 3.17Å; E120-F123 PolarHBondContact O-N 3.26Å; F123-L126 PolarHBondContact O-N 2.93Å; F123-K127 WeakPolarHBondContact O-CB 3.26Å; F123-K127 PolarHBondContact O-N 3.2Å; F123-L158 HydrophobicContact CD1-CD2 3.97Å; F123-L158 HydrophobicContact CE1-CD2 4.33Å; F123-L161 HydrophobicContact CE1-CB 3.75Å; F123-L161 HydrophobicContact CZ-CB 4.18Å; F123-L161 WeakPolarHBondContact CZ-O 3.3Å
124	G	94.9	Very high	90.4	Very high	23 Å²	23	58.9 Å²	58.9	24%	0.237	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-45.2	174.7	0	0	0	0	0	112.7	E120 E121 V122 K127 R128	E120-G124 PolarHBondContact O-N 3Å; E121-G124 PolarHBondContact O-N 3.38Å; V122-G124 VanDerWaalsContact C-N 3.28Å; V122-G124 PolarHBondContact O-N 2.91Å; G124-K127 PolarHBondContact O-N 3.11Å; G124-R128 PolarHBondContact O-N 3.47Å; G124-R128 VanDerWaalsContact O-N 3.08Å; G124-R128 PolarHBondContact O-NH1 2.82Å
125	A	95.5	Very high	91.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-48	176.3	0	0	0	0	0	112	D103 V106 V107 E121 V122 K127 R128 L129	D103-A125 HydrophobicContact CB-CB 3.87Å; V106-A125 HydrophobicContact CB-CB 4.38Å; V106-A125 HydrophobicContact CG1-CB 4.17Å; V107-A125 HydrophobicContact CG2-CB 4.16Å; E121-A125 PolarHBondContact O-N 3.1Å; V122-A125 PolarHBondContact O-N 3.05Å; A125-K127 VanDerWaalsContact C-N 3.27Å; A125-K127 PolarHBondContact O-N 2.82Å; A125-R128 PolarHBondContact O-N 3.39Å; A125-L129 WeakPolarHBondContact O-CB 3.29Å; A125-L129 VanDerWaalsContact O-CG 3.29Å; A125-L129 WeakPolarHBondContact O-CG 3.15Å; A125-L129 PolarHBondContact O-N 2.8Å
126	L	96.7	Very high	93.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.7	-43	175.6	-73.4	173	0	0	0	111.4	T77 M81 V107 L118 V122 F123 W130 L158	T77-L126 HydrophobicContact CG2-CD1 4.36Å; M81-L126 HydrophobicContact CB-CD2 3.66Å; M81-L126 HydrophobicContact CE-CD2 4.36Å; M81-L126 HydrophobicContact CG-CD2 3.71Å; V107-L126 HydrophobicContact CG1-CD2 4.08Å; V107-L126 HydrophobicContact CG2-CD2 3.81Å; V107-L126 HydrophobicContact CG2-CG 4.17Å; L118-L126 HydrophobicContact CD1-CD1 4.42Å; V122-L126 HydrophobicContact CG1-CD1 4.09Å; V122-L126 HydrophobicContact CG1-CG 4.24Å; V122-L126 WeakPolarHBondContact O-CB 3.45Å; V122-L126 VanDerWaalsContact O-CG 3.28Å; V122-L126 WeakPolarHBondContact O-CG 3.49Å; V122-L126 PolarHBondContact O-N 2.96Å; F123-L126 PolarHBondContact O-N 2.93Å; L126-W130 VanDerWaalsContact O-CB 3.24Å; L126-W130 WeakPolarHBondContact O-CB 3.49Å; L126-W130 PolarHBondContact O-N 3.3Å; L126-L158 HydrophobicContact CB-CD1 3.93Å; L126-L158 HydrophobicContact CB-CD2 3.93Å; L126-L158 HydrophobicContact CD1-CD2 3.99Å
127	K	96.5	Very high	94.3	Very high	71 Å²	71	49.9 Å²	49.9	31%	0.309	25%	0.253	S	S	.	.	H	α-helix	trans	-66	-47.4	-179.4	-169.9	175.8	-172.9	171.4	0	111.8	F123 G124 A125 W130 Y131 L158 D159	F123-K127 WeakPolarHBondContact O-CB 3.26Å; F123-K127 PolarHBondContact O-N 3.2Å; G124-K127 PolarHBondContact O-N 3.11Å; A125-K127 VanDerWaalsContact C-N 3.27Å; A125-K127 PolarHBondContact O-N 2.82Å; K127-W130 PolarHBondContact O-N 3.25Å; K127-Y131 HydrophobicContact CG-CD2 4.02Å; K127-Y131 HydrophobicContact CG-CE2 3.88Å; K127-Y131 WeakPolarHBondContact O-CD2 3.47Å; K127-Y131 PolarHBondContact O-N 2.74Å; K127-L158 HydrophobicContact CB-CD1 4.07Å; K127-D159 IonicContact NZ-OD1 3.37Å; K127-D159 PolarHBondContact NZ-OD1 2.99Å; K127-D159 IonicContact NZ-OD2 2.8Å; K127-D159 PolarHBondContact NZ-OD2 3.3Å
128	R	96.5	Very high	95.1	Very high	123 Å²	123	45 Å²	45	46%	0.464	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-42.4	177.9	-73.8	-173.5	-64.3	-87.6	2	112	D103 G124 A125 D132	D103-R128 IonicContact OD1-CZ 3.38Å; D103-R128 IonicContact OD1-NE 3.15Å; D103-R128 PolarHBondContact OD1-NE 2.81Å; D103-R128 IonicContact OD1-NH2 3.81Å; D103-R128 PolarHBondContact OD1-NH2 3.2Å; D103-R128 WeakPolarHBondContact OD2-CB 3.3Å; D103-R128 IonicContact OD2-CZ 2.71Å; D103-R128 IonicContact OD2-NE 2.73Å; D103-R128 PolarHBondContact OD2-NE 3.18Å; D103-R128 IonicContact OD2-NH2 3.69Å; G124-R128 PolarHBondContact O-N 3.47Å; G124-R128 VanDerWaalsContact O-N 3.08Å; G124-R128 PolarHBondContact O-NH1 2.82Å; A125-R128 PolarHBondContact O-N 3.39Å; R128-D132 PolarHBondContact O-N 2.85Å
129	L	97.5	Very high	95.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-44.9	175.9	-69.5	170.3	0	0	0	111.6	M81 L85 A100 D103 I104 V107 A125 Y131 D132 V135	M81-L129 HydrophobicContact CE-CB 3.95Å; M81-L129 HydrophobicContact SD-CB 4.02Å; L85-L129 HydrophobicContact CD1-CD1 4.2Å; L85-L129 HydrophobicContact CD2-CD2 4.41Å; A100-L129 HydrophobicContact CB-CD2 4.28Å; D103-L129 HydrophobicContact CB-CD1 3.91Å; D103-L129 HydrophobicContact CB-CD2 3.99Å; D103-L129 HydrophobicContact CB-CG 3.77Å; I104-L129 HydrophobicContact CG1-CD1 4.48Å; I104-L129 HydrophobicContact CG1-CD2 3.87Å; V107-L129 HydrophobicContact CG2-CD1 3.88Å; A125-L129 WeakPolarHBondContact O-CB 3.29Å; A125-L129 VanDerWaalsContact O-CG 3.29Å; A125-L129 WeakPolarHBondContact O-CG 3.15Å; A125-L129 PolarHBondContact O-N 2.8Å; L129-Y131 VanDerWaalsContact C-N 3.27Å; L129-Y131 PolarHBondContact O-N 2.75Å; L129-D132 WeakPolarHBondContact O-CB 3.38Å; L129-D132 PolarHBondContact O-N 3.04Å; L129-V135 WeakPolarHBondContact O-CB 3.27Å; L129-V135 WeakPolarHBondContact O-CG1 3.36Å; L129-V135 WeakPolarHBondContact O-CG2 3.39Å
130	W	97.6	Very high	96.1	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-39.8	-177.9	-177.9	-124.9	0	0	0	112.5	M81 I84 L126 K127 D132 V135 Q136 V139 L155 D156 L158	M81-W130 HydrophobicContact CE-CB 3.96Å; M81-W130 HydrophobicContact CE-CE3 4.25Å; I84-W130 HydrophobicContact CD1-CZ3 3.9Å; L126-W130 VanDerWaalsContact O-CB 3.24Å; L126-W130 WeakPolarHBondContact O-CB 3.49Å; L126-W130 PolarHBondContact O-N 3.3Å; K127-W130 PolarHBondContact O-N 3.25Å; W130-D132 VanDerWaalsContact C-N 3.3Å; W130-D132 PolarHBondContact O-N 2.88Å; W130-V135 HydrophobicContact CE3-CG1 4.09Å; W130-Q136 PolarHBondContact O-NE2 3.09Å; W130-V139 HydrophobicContact CH2-CG1 4.27Å; W130-V139 HydrophobicContact CH2-CG2 3.94Å; W130-V139 HydrophobicContact CZ3-CG2 3.52Å; W130-L155 VanDerWaalsContact CD1-O 3.28Å; W130-L155 HydrophobicContact CD2-CB 3.5Å; W130-L155 VanDerWaalsContact CD2-CB 3.5Å; W130-L155 HydrophobicContact CD2-CD1 4.1Å; W130-L155 HydrophobicContact CD2-CG 4.31Å; W130-L155 HydrophobicContact CE3-CB 3.85Å; W130-L155 HydrophobicContact CE3-CD1 3.5Å; W130-L155 VanDerWaalsContact CE3-CD1 3.5Å; W130-L155 HydrophobicContact CE3-CG 4.19Å; W130-L155 HydrophobicContact CG-CB 3.84Å; W130-L155 HydrophobicContact CH2-CB 4.26Å; W130-L155 HydrophobicContact CH2-CD1 4.09Å; W130-L155 HydrophobicContact CZ2-CB 3.97Å; W130-L155 HydrophobicContact CZ3-CB 4.19Å; W130-L155 HydrophobicContact CZ3-CD1 3.47Å; W130-L155 VanDerWaalsContact CZ3-CD1 3.47Å; W130-L155 HydrophobicContact CZ3-CG 4.45Å; W130-D156 PolarHBondContact NE1-OD1 3.43Å; W130-L158 HydrophobicContact CB-CD1 4.36Å
131	Y	96.4	Very high	96.4	Very high	121 Å²	121	43.8 Å²	43.8	48%	0.475	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	3.8	176.6	-65.2	-65.4	0	0	0	114.3	K127 L129 P133	K127-Y131 HydrophobicContact CG-CD2 4.02Å; K127-Y131 HydrophobicContact CG-CE2 3.88Å; K127-Y131 WeakPolarHBondContact O-CD2 3.47Å; K127-Y131 PolarHBondContact O-N 2.74Å; L129-Y131 VanDerWaalsContact C-N 3.27Å; L129-Y131 PolarHBondContact O-N 2.75Å; Y131-P133 WeakPolarHBondContact O-CD 3.27Å
132	D	97.6	Very high	96.6	Very high	2 Å²	2	39 Å²	39	1%	0.011	20%	0.195	C	C	.	.			trans	-68.8	128.6	173.5	-174	-80.7	0	0	0	110.7	C95 A96 Y97 R128 L129 W130 G134 V135 Q136	C95-D132 WeakPolarHBondContact CA-OD1 3.46Å; A96-D132 PolarHBondContact N-OD1 3.4Å; A96-D132 VanDerWaalsContact N-OD1 3.1Å; A96-D132 PolarHBondContact N-OD2 2.81Å; Y97-D132 HydrophobicContact CD2-CB 3.93Å; Y97-D132 WeakPolarHBondContact CD2-OD2 3.21Å; Y97-D132 HydrophobicContact CE2-CB 4.23Å; Y97-D132 PolarHBondContact N-OD2 2.67Å; R128-D132 PolarHBondContact O-N 2.85Å; L129-D132 WeakPolarHBondContact O-CB 3.38Å; L129-D132 PolarHBondContact O-N 3.04Å; W130-D132 VanDerWaalsContact C-N 3.3Å; W130-D132 PolarHBondContact O-N 2.88Å; D132-G134 PolarHBondContact O-N 3.3Å; D132-G134 VanDerWaalsContact OD1-CA 3.28Å; D132-G134 WeakPolarHBondContact OD1-CA 3.38Å; D132-G134 PolarHBondContact OD1-N 2.99Å; D132-V135 HydrophobicContact CB-CB 4.16Å; D132-V135 HydrophobicContact CB-CG2 4.02Å; D132-V135 WeakPolarHBondContact O-CB 3.37Å; D132-V135 PolarHBondContact O-N 3.09Å; D132-V135 VanDerWaalsContact O-N 3.08Å; D132-V135 PolarHBondContact OD1-N 3.09Å; D132-Q136 PolarHBondContact O-N 2.83Å
133	P	97.4	Very high	96.6	Very high	64 Å²	64	43.8 Å²	43.8	42%	0.416	21%	0.213	S	C	.	.	H	α-helix	trans	-54.9	-34.1	177.1	-29.1	34.1	0	0	0	115.1	A96 Y131 T137	A96-P133 HydrophobicContact CB-CB 4.2Å; A96-P133 HydrophobicContact CB-CG 4.02Å; Y131-P133 WeakPolarHBondContact O-CD 3.27Å; P133-T137 WeakPolarHBondContact O-CB 3.43Å; P133-T137 PolarHBondContact O-N 3.04Å; P133-T137 PolarHBondContact O-OG1 3.28Å
134	G	97.3	Very high	96.6	Very high	6 Å²	6	47.2 Å²	47.2	6%	0.062	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-43.6	175.3	0	0	0	0	0	111.6	I93 D132 T137 A138	I93-G134 WeakPolarHBondContact CG2-O 3.34Å; D132-G134 PolarHBondContact O-N 3.3Å; D132-G134 VanDerWaalsContact OD1-CA 3.28Å; D132-G134 WeakPolarHBondContact OD1-CA 3.38Å; D132-G134 PolarHBondContact OD1-N 2.99Å; G134-T137 WeakPolarHBondContact O-CB 3.37Å; G134-T137 PolarHBondContact O-N 3.02Å; G134-A138 PolarHBondContact O-N 2.91Å
135	V	97.8	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-46.6	173.7	169.7	0	0	0	0	110.7	M81 I84 L85 M88 L129 W130 D132 T137 A138 V139	M81-V135 HydrophobicContact SD-CG1 4.4Å; I84-V135 HydrophobicContact CG2-CG1 3.93Å; L85-V135 HydrophobicContact CD2-CG2 4.31Å; M88-V135 HydrophobicContact CE-CG2 4.09Å; M88-V135 HydrophobicContact SD-CB 4.25Å; M88-V135 HydrophobicContact SD-CG2 3.51Å; M88-V135 VanDerWaalsContact SD-CG2 3.51Å; L129-V135 WeakPolarHBondContact O-CB 3.27Å; L129-V135 WeakPolarHBondContact O-CG1 3.36Å; L129-V135 WeakPolarHBondContact O-CG2 3.39Å; W130-V135 HydrophobicContact CE3-CG1 4.09Å; D132-V135 HydrophobicContact CB-CB 4.16Å; D132-V135 HydrophobicContact CB-CG2 4.02Å; D132-V135 WeakPolarHBondContact O-CB 3.37Å; D132-V135 PolarHBondContact O-N 3.09Å; D132-V135 VanDerWaalsContact O-N 3.08Å; D132-V135 PolarHBondContact OD1-N 3.09Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.13Å; V135-A138 WeakPolarHBondContact O-CB 3.42Å; V135-A138 PolarHBondContact O-N 3.3Å; V135-A138 VanDerWaalsContact O-N 3.14Å; V135-V139 WeakPolarHBondContact O-CG2 3.4Å; V135-V139 PolarHBondContact O-N 3.1Å
136	Q	97.9	Very high	96.6	Very high	61 Å²	61	50.1 Å²	50.1	29%	0.285	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-35.7	176.2	-69.5	-61.9	-46	0	0	112.5	W130 D132 V139 N140	W130-Q136 PolarHBondContact O-NE2 3.09Å; D132-Q136 PolarHBondContact O-N 2.83Å; Q136-V139 PolarHBondContact O-N 2.85Å; Q136-N140 PolarHBondContact O-N 3.15Å; Q136-N140 PolarHBondContact O-ND2 3.32Å
137	T	97.6	Very high	96.6	Very high	68 Å²	68	51.5 Å²	51.5	42%	0.417	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-42.1	173.7	-59.9	0	0	0	0	111.4	I93 P133 G134 V135 N140 R141	I93-T137 HydrophobicContact CD1-CG2 4.2Å; I93-T137 HydrophobicContact CG2-CG2 4.44Å; P133-T137 WeakPolarHBondContact O-CB 3.43Å; P133-T137 PolarHBondContact O-N 3.04Å; P133-T137 PolarHBondContact O-OG1 3.28Å; G134-T137 WeakPolarHBondContact O-CB 3.37Å; G134-T137 PolarHBondContact O-N 3.02Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.13Å; T137-N140 PolarHBondContact O-N 2.79Å; T137-R141 PolarHBondContact O-N 2.94Å
138	A	97.7	Very high	96.5	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-41.5	175.3	0	0	0	0	0	112.1	I84 M88 I93 G134 V135 N140 R141 S142 F145	I84-A138 HydrophobicContact CG2-CB 3.88Å; M88-A138 HydrophobicContact CG-CB 3.47Å; M88-A138 VanDerWaalsContact CG-CB 3.47Å; M88-A138 HydrophobicContact SD-CB 4.44Å; I93-A138 HydrophobicContact CD1-CB 3.88Å; G134-A138 PolarHBondContact O-N 2.91Å; V135-A138 WeakPolarHBondContact O-CB 3.42Å; V135-A138 PolarHBondContact O-N 3.3Å; V135-A138 VanDerWaalsContact O-N 3.14Å; A138-N140 VanDerWaalsContact C-N 3.3Å; A138-N140 PolarHBondContact O-N 3.42Å; A138-R141 CarbonylContact O-C 3.57Å; A138-R141 VanDerWaalsContact O-C 3.3Å; A138-R141 WeakPolarHBondContact O-CA 3.43Å; A138-R141 PolarHBondContact O-N 3.45Å; A138-S142 PolarHBondContact O-N 3.03Å; A138-F145 VanDerWaalsContact O-CE1 3.27Å; A138-F145 WeakPolarHBondContact O-CE1 3.47Å
139	V	97.2	Very high	96.4	Very high	16 Å²	16	46.6 Å²	46.6	10%	0.097	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-40.4	175.6	174.1	0	0	0	0	111.7	I84 W130 V135 Q136 R141 S142	I84-V139 HydrophobicContact CD1-CG2 3.72Å; I84-V139 HydrophobicContact CG1-CG2 4.15Å; I84-V139 HydrophobicContact CG2-CG2 4.28Å; W130-V139 HydrophobicContact CH2-CG1 4.27Å; W130-V139 HydrophobicContact CH2-CG2 3.94Å; W130-V139 HydrophobicContact CZ3-CG2 3.52Å; V135-V139 WeakPolarHBondContact O-CG2 3.4Å; V135-V139 PolarHBondContact O-N 3.1Å; Q136-V139 PolarHBondContact O-N 2.85Å; V139-R141 PolarHBondContact O-N 3.07Å; V139-S142 WeakPolarHBondContact O-CB 3.4Å; V139-S142 PolarHBondContact O-N 2.99Å; V139-S142 PolarHBondContact O-OG 3.19Å
140	N	95.5	Very high	96.4	Very high	120 Å²	120	47 Å²	47	64%	0.642	23%	0.233	S	C	*	.	H	α-helix	trans	-65	-17.8	174.9	-73.6	-45.3	0	0	0	113.4	Q136 T137 A138	Q136-N140 PolarHBondContact O-N 3.15Å; Q136-N140 PolarHBondContact O-ND2 3.32Å; T137-N140 PolarHBondContact O-N 2.79Å; A138-N140 VanDerWaalsContact C-N 3.3Å; A138-N140 PolarHBondContact O-N 3.42Å
141	R	95.8	Very high	96.4	Very high	80 Å²	80	46.9 Å²	46.9	30%	0.302	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	18.6	174.2	-66.3	176.9	67.8	-173.5	1.8	112.5	L91 T137 A138 V139 R143 E144	L91-R141 HydrophobicContact CD1-CB 4.07Å; T137-R141 PolarHBondContact O-N 2.94Å; A138-R141 CarbonylContact O-C 3.57Å; A138-R141 VanDerWaalsContact O-C 3.3Å; A138-R141 WeakPolarHBondContact O-CA 3.43Å; A138-R141 PolarHBondContact O-N 3.45Å; V139-R141 PolarHBondContact O-N 3.07Å; R141-R143 PolarHBondContact O-N 3.29Å; R141-E144 WeakPolarHBondContact CB-OE1 3.38Å; R141-E144 WeakPolarHBondContact CG-OE1 3.39Å; R141-E144 IonicContact CZ-OE1 3.55Å; R141-E144 IonicContact CZ-OE2 3.48Å; R141-E144 IonicContact NE-OE1 2.78Å; R141-E144 PolarHBondContact NE-OE1 2.85Å; R141-E144 IonicContact NE-OE2 3.48Å; R141-E144 PolarHBondContact NE-OE2 2.8Å; R141-E144 IonicContact NH2-OE1 3.44Å; R141-E144 PolarHBondContact NH2-OE1 3.26Å; R141-E144 IonicContact NH2-OE2 2.71Å; R141-E144 PolarHBondContact NH2-OE2 2.91Å; R141-E144 WeakPolarHBondContact O-CB 3.22Å; R141-E144 PolarHBondContact O-N 2.93Å
142	S	95.9	Very high	96.4	Very high	35 Å²	35	43.3 Å²	43.3	25%	0.245	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-59.2	-9.7	-178.2	52	0	0	0	0	115.6	A138 V139 E144 F145	A138-S142 PolarHBondContact O-N 3.03Å; V139-S142 WeakPolarHBondContact O-CB 3.4Å; V139-S142 PolarHBondContact O-N 2.99Å; V139-S142 PolarHBondContact O-OG 3.19Å; S142-E144 VanDerWaalsContact C-N 3.26Å; S142-F145 VanDerWaalsContact CA-CE1 3.47Å
143	R	93.7	Very high	96.4	Very high	108 Å²	108	46 Å²	46	41%	0.408	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-71.6	-19.4	168.6	72.3	178	-176.7	-177	2	114.2	R141 F145 L231 S280	R141-R143 PolarHBondContact O-N 3.29Å; R143-F145 VanDerWaalsContact C-N 3.34Å; R143-L231 HydrophobicContact CB-CD2 4.01Å; R143-S280 PolarHBondContact NH1-OG 3.33Å; R143-S280 VanDerWaalsContact NH1-OG 3.14Å
144	E	95.1	Very high	96.4	Very high	88 Å²	88	43 Å²	43	41%	0.411	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-88.1	-4	-176.7	-60.9	175.4	-126.4	0	0	112.6	L91 R141 S142	L91-E144 HydrophobicContact CD1-CB 4.47Å; L91-E144 HydrophobicContact CD2-CB 4.22Å; L91-E144 WeakPolarHBondContact CD2-OE2 3.4Å; R141-E144 WeakPolarHBondContact CB-OE1 3.38Å; R141-E144 WeakPolarHBondContact CG-OE1 3.39Å; R141-E144 IonicContact CZ-OE1 3.55Å; R141-E144 IonicContact CZ-OE2 3.48Å; R141-E144 IonicContact NE-OE1 2.78Å; R141-E144 PolarHBondContact NE-OE1 2.85Å; R141-E144 IonicContact NE-OE2 3.48Å; R141-E144 PolarHBondContact NE-OE2 2.8Å; R141-E144 IonicContact NH2-OE1 3.44Å; R141-E144 PolarHBondContact NH2-OE1 3.26Å; R141-E144 IonicContact NH2-OE2 2.71Å; R141-E144 PolarHBondContact NH2-OE2 2.91Å; R141-E144 WeakPolarHBondContact O-CB 3.22Å; R141-E144 PolarHBondContact O-N 2.93Å; S142-E144 VanDerWaalsContact C-N 3.26Å
145	F	96.2	Very high	96.5	Very high	19 Å²	19	42.7 Å²	42.7	8%	0.083	21%	0.212	C	C	.	.	S	Bend	trans	-151.4	175.5	177.9	63.6	-84.5	0	0	0	111.2	I84 A87 L91 A138 S142 R143 L147	I84-F145 HydrophobicContact CG1-CE2 4.22Å; I84-F145 HydrophobicContact CG1-CZ 4.33Å; A87-F145 HydrophobicContact CB-CB 3.94Å; A87-F145 HydrophobicContact CB-CD1 3.37Å; A87-F145 HydrophobicContact CB-CD2 3.56Å; A87-F145 HydrophobicContact CB-CE1 3.57Å; A87-F145 HydrophobicContact CB-CE2 3.77Å; A87-F145 HydrophobicContact CB-CG 3.35Å; A87-F145 HydrophobicContact CB-CZ 3.78Å; L91-F145 HydrophobicContact CD1-CD1 4.27Å; L91-F145 HydrophobicContact CD1-CE1 4.38Å; A138-F145 VanDerWaalsContact O-CE1 3.27Å; A138-F145 WeakPolarHBondContact O-CE1 3.47Å; S142-F145 VanDerWaalsContact CA-CE1 3.47Å; R143-F145 VanDerWaalsContact C-N 3.34Å; F145-L147 HydrophobicContact CD2-CB 4.22Å; F145-L147 HydrophobicContact CE2-CB 3.79Å; F145-L147 HydrophobicContact CE2-CD1 4.33Å; F145-L147 HydrophobicContact CE2-CD2 4.24Å; F145-L147 HydrophobicContact CE2-CG 4.34Å; F145-L147 HydrophobicContact CZ-CD2 4.36Å; F145-L147 PolarHBondContact O-N 3.03Å
146	Q	95.7	Very high	96.5	Very high	65 Å²	65	47.1 Å²	47.1	30%	0.304	24%	0.236	S	C	.	.			trans	-89	107.3	-177.8	-56.7	-62.5	-31.7	0	0	110	T232 A234	Q146-T232 PolarHBondContact NE2-O 3.06Å; Q146-A234 HydrophobicContact CG-CB 4.21Å
147	L	96.7	Very high	96.5	Very high	29 Å²	29	45.5 Å²	45.5	15%	0.152	23%	0.232	C	C	.	.			trans	-125.6	134.7	175	-172.3	60.4	0	0	0	110.6	A83 I84 F145 A151	A83-L147 HydrophobicContact CB-CD1 4.38Å; I84-L147 HydrophobicContact CD1-CD1 4.1Å; I84-L147 HydrophobicContact CD1-CD2 4.36Å; I84-L147 HydrophobicContact CG1-CD1 3.78Å; I84-L147 HydrophobicContact CG1-CD2 4.13Å; F145-L147 HydrophobicContact CD2-CB 4.22Å; F145-L147 HydrophobicContact CE2-CB 3.79Å; F145-L147 HydrophobicContact CE2-CD1 4.33Å; F145-L147 HydrophobicContact CE2-CD2 4.24Å; F145-L147 HydrophobicContact CE2-CG 4.34Å; F145-L147 HydrophobicContact CZ-CD2 4.36Å; F145-L147 PolarHBondContact O-N 3.03Å; L147-A151 HydrophobicContact CD1-CB 3.73Å; L147-A151 HydrophobicContact CD2-CB 4.18Å; L147-A151 HydrophobicContact CG-CB 3.89Å
148	N	93.8	Very high	96.4	Very high	39 Å²	39	42.6 Å²	42.6	21%	0.209	21%	0.214	C	C	.	.			trans	-69.6	133.3	176.2	-179.1	-10	0	0	0	110.4	S150 A151 R177	N148-S150 PolarHBondContact O-N 3.37Å; N148-S150 PolarHBondContact OD1-N 2.96Å; N148-A151 WeakPolarHBondContact O-CB 3.24Å; N148-A151 PolarHBondContact O-N 3.33Å; N148-R177 VanDerWaalsContact ND2-CB 3.26Å; N148-R177 WeakPolarHBondContact ND2-CB 3.49Å
149	D	94.2	Very high	96.4	Very high	53 Å²	53	47.3 Å²	47.3	28%	0.283	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-28.9	175.2	-68.7	-35.4	0	0	0	114.2	A151 K269 I272	D149-A151 VanDerWaalsContact C-N 3.3Å; D149-K269 VanDerWaalsContact OD2-CD 3.3Å; D149-K269 WeakPolarHBondContact OD2-CD 3.37Å; D149-K269 WeakPolarHBondContact OD2-CE 3.35Å; D149-K269 IonicContact OD2-NZ 3.98Å; D149-K269 PolarHBondContact OD2-NZ 3.21Å; D149-I272 HydrophobicContact CB-CD1 3.6Å
150	S	96.4	Very high	96.3	Very high	10 Å²	10	50.2 Å²	50.2	7%	0.07	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	4.8	179.3	-57.5	0	0	0	0	113.9	N148 Y153 F154 R175	N148-S150 PolarHBondContact O-N 3.37Å; N148-S150 PolarHBondContact OD1-N 2.96Å; S150-Y153 PolarHBondContact O-N 3.48Å; S150-F154 VanDerWaalsContact O-CD2 3.31Å; S150-F154 WeakPolarHBondContact O-CD2 3.38Å; S150-F154 PolarHBondContact O-N 3.1Å; S150-R175 VanDerWaalsContact CB-O 3.27Å; S150-R175 WeakPolarHBondContact CB-O 3.47Å; S150-R175 VanDerWaalsContact OG-CD 3.31Å; S150-R175 WeakPolarHBondContact OG-CD 3.31Å; S150-R175 PolarHBondContact OG-O 2.92Å
151	A	97.7	Very high	96.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-55.1	-57.1	179.6	0	0	0	0	0	111.9	S80 L147 N148 D149 Y153 F154 L155	S80-A151 WeakPolarHBondContact OG-CB 3.29Å; L147-A151 HydrophobicContact CD1-CB 3.73Å; L147-A151 HydrophobicContact CD2-CB 4.18Å; L147-A151 HydrophobicContact CG-CB 3.89Å; N148-A151 WeakPolarHBondContact O-CB 3.24Å; N148-A151 PolarHBondContact O-N 3.33Å; D149-A151 VanDerWaalsContact C-N 3.3Å; A151-Y153 VanDerWaalsContact C-N 3.33Å; A151-Y153 PolarHBondContact O-N 2.98Å; A151-F154 PolarHBondContact O-N 3.27Å; A151-L155 HydrophobicContact CB-CD1 4.44Å; A151-L155 WeakPolarHBondContact O-CB 3.43Å; A151-L155 VanDerWaalsContact O-CG 3.3Å; A151-L155 WeakPolarHBondContact O-CG 3.46Å; A151-L155 PolarHBondContact O-N 2.93Å
152	S	97	Very high	96.3	Very high	45 Å²	45	43.1 Å²	43.1	32%	0.315	22%	0.22	S	C	.	.	H	α-helix	trans	-62.4	-40.8	-179.3	-52	0	0	0	0	111.8	F154 L155 D156	S152-F154 VanDerWaalsContact C-N 3.3Å; S152-F154 PolarHBondContact O-N 3.32Å; S152-L155 PolarHBondContact O-N 3.06Å; S152-D156 WeakPolarHBondContact O-CB 3.35Å; S152-D156 PolarHBondContact O-N 2.73Å; S152-D156 VanDerWaalsContact O-OD2 3.06Å
153	Y	98	Very high	96.2	Very high	58 Å²	58	43.8 Å²	43.8	23%	0.227	22%	0.224	C	C	.	.	H	α-helix	trans	-52.8	-45.6	178.2	173.1	-97.6	0	0	0	113.1	S150 A151 S157 Q171 D172 R175	S150-Y153 PolarHBondContact O-N 3.48Å; A151-Y153 VanDerWaalsContact C-N 3.33Å; A151-Y153 PolarHBondContact O-N 2.98Å; Y153-S157 WeakPolarHBondContact O-CB 3.42Å; Y153-S157 PolarHBondContact O-OG 2.86Å; Y153-Q171 HydrophobicContact CE2-CG 4.12Å; Y153-Q171 WeakPolarHBondContact OH-CG 3.43Å; Y153-D172 WeakPolarHBondContact CE1-OD1 3.35Å; Y153-D172 PolarHBondContact OH-OD1 3.4Å; Y153-D172 VanDerWaalsContact OH-OD1 3.09Å; Y153-R175 HydrophobicContact CD1-CB 3.74Å; Y153-R175 HydrophobicContact CD1-CG 3.75Å; Y153-R175 HydrophobicContact CD2-CG 4.42Å; Y153-R175 HydrophobicContact CE1-CB 3.84Å; Y153-R175 HydrophobicContact CE1-CG 3.82Å; Y153-R175 HydrophobicContact CE2-CG 4.48Å; Y153-R175 HydrophobicContact CG-CB 4.49Å; Y153-R175 HydrophobicContact CG-CG 4.07Å
154	F	98	Very high	96	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-80.3	-40	178.9	-68.2	-57	0	0	0	112.9	V73 T77 S150 A151 S152 S157 L158 L161 D172 R175 T176	V73-F154 HydrophobicContact CB-CE1 4.33Å; V73-F154 HydrophobicContact CG1-CD1 3.72Å; V73-F154 HydrophobicContact CG1-CE1 3.61Å; V73-F154 HydrophobicContact CG1-CG 4.49Å; V73-F154 HydrophobicContact CG1-CZ 4.3Å; V73-F154 HydrophobicContact CG2-CE1 4.01Å; V73-F154 HydrophobicContact CG2-CZ 4.19Å; T77-F154 HydrophobicContact CG2-CB 4.3Å; T77-F154 WeakPolarHBondContact OG1-CB 3.31Å; S150-F154 VanDerWaalsContact O-CD2 3.31Å; S150-F154 WeakPolarHBondContact O-CD2 3.38Å; S150-F154 PolarHBondContact O-N 3.1Å; A151-F154 PolarHBondContact O-N 3.27Å; S152-F154 VanDerWaalsContact C-N 3.3Å; S152-F154 PolarHBondContact O-N 3.32Å; F154-S157 CarbonylContact O-C 3.3Å; F154-S157 WeakPolarHBondContact O-CA 3.43Å; F154-S157 PolarHBondContact O-N 2.77Å; F154-L158 PolarHBondContact O-N 3.08Å; F154-L161 HydrophobicContact CB-CD1 4.21Å; F154-L161 HydrophobicContact CD1-CD1 4.31Å; F154-L161 WeakPolarHBondContact O-CD1 3.36Å; F154-D172 HydrophobicContact CE1-CB 4.17Å; F154-R175 HydrophobicContact CE2-CB 4.1Å; F154-R175 HydrophobicContact CZ-CB 3.78Å; F154-T176 HydrophobicContact CZ-CG2 4.33Å
155	L	98.1	Very high	95.8	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70.3	-30.5	-178.6	-68.6	168.3	0	0	0	112.8	T77 M81 I84 W130 A151 S152 S157 L158	T77-L155 HydrophobicContact CG2-CD2 3.75Å; T77-L155 HydrophobicContact CG2-CG 4.39Å; M81-L155 HydrophobicContact CB-CD2 4.49Å; M81-L155 HydrophobicContact CE-CD1 4.32Å; M81-L155 HydrophobicContact CE-CD2 3.86Å; I84-L155 HydrophobicContact CD1-CD1 4.07Å; W130-L155 VanDerWaalsContact CD1-O 3.28Å; W130-L155 HydrophobicContact CD2-CB 3.5Å; W130-L155 VanDerWaalsContact CD2-CB 3.5Å; W130-L155 HydrophobicContact CD2-CD1 4.1Å; W130-L155 HydrophobicContact CD2-CG 4.31Å; W130-L155 HydrophobicContact CE3-CB 3.85Å; W130-L155 HydrophobicContact CE3-CD1 3.5Å; W130-L155 VanDerWaalsContact CE3-CD1 3.5Å; W130-L155 HydrophobicContact CE3-CG 4.19Å; W130-L155 HydrophobicContact CG-CB 3.84Å; W130-L155 HydrophobicContact CH2-CB 4.26Å; W130-L155 HydrophobicContact CH2-CD1 4.09Å; W130-L155 HydrophobicContact CZ2-CB 3.97Å; W130-L155 HydrophobicContact CZ3-CB 4.19Å; W130-L155 HydrophobicContact CZ3-CD1 3.47Å; W130-L155 VanDerWaalsContact CZ3-CD1 3.47Å; W130-L155 HydrophobicContact CZ3-CG 4.45Å; A151-L155 HydrophobicContact CB-CD1 4.44Å; A151-L155 WeakPolarHBondContact O-CB 3.43Å; A151-L155 VanDerWaalsContact O-CG 3.3Å; A151-L155 WeakPolarHBondContact O-CG 3.46Å; A151-L155 PolarHBondContact O-N 2.93Å; S152-L155 PolarHBondContact O-N 3.06Å; L155-S157 PolarHBondContact O-N 3.48Å; L155-L158 HydrophobicContact CD2-CD1 4.44Å; L155-L158 VanDerWaalsContact O-CD1 3.26Å; L155-L158 WeakPolarHBondContact O-CD1 3.48Å; L155-L158 VanDerWaalsContact O-CG 3.23Å; L155-L158 WeakPolarHBondContact O-CG 3.36Å
156	D	98	Very high	95.8	Very high	94 Å²	94	43.5 Å²	43.5	50%	0.503	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.9	170	-67.2	-32.1	0	0	0	112.3	W130 S152	W130-D156 PolarHBondContact NE1-OD1 3.43Å; S152-D156 WeakPolarHBondContact O-CB 3.35Å; S152-D156 PolarHBondContact O-N 2.73Å; S152-D156 VanDerWaalsContact O-OD2 3.06Å
157	S	97.5	Very high	95.8	Very high	27 Å²	27	43 Å²	43	19%	0.189	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	12.8	-176.4	-67	0	0	0	0	113.9	Y153 F154 L155 D159 R160 L161	Y153-S157 WeakPolarHBondContact O-CB 3.42Å; Y153-S157 PolarHBondContact O-OG 2.86Å; F154-S157 CarbonylContact O-C 3.3Å; F154-S157 WeakPolarHBondContact O-CA 3.43Å; F154-S157 PolarHBondContact O-N 2.77Å; L155-S157 PolarHBondContact O-N 3.48Å; S157-D159 PolarHBondContact O-N 3.35Å; S157-D159 VanDerWaalsContact O-N 3.1Å; S157-R160 WeakPolarHBondContact O-CA 3.48Å; S157-R160 WeakPolarHBondContact O-CB 3.39Å; S157-R160 PolarHBondContact O-N 2.83Å; S157-R160 PolarHBondContact OG-NH2 3.42Å; S157-L161 WeakPolarHBondContact O-CG 3.17Å; S157-L161 PolarHBondContact O-N 3.39Å
158	L	97.2	Very high	95.8	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-54.1	-36.6	-171.3	-74.5	165.9	0	0	0	113.9	T77 F123 L126 K127 W130 F154 L155 R160 L161 S162	T77-L158 HydrophobicContact CG2-CD2 4.02Å; F123-L158 HydrophobicContact CD1-CD2 3.97Å; F123-L158 HydrophobicContact CE1-CD2 4.33Å; L126-L158 HydrophobicContact CB-CD1 3.93Å; L126-L158 HydrophobicContact CB-CD2 3.93Å; L126-L158 HydrophobicContact CD1-CD2 3.99Å; K127-L158 HydrophobicContact CB-CD1 4.07Å; W130-L158 HydrophobicContact CB-CD1 4.36Å; F154-L158 PolarHBondContact O-N 3.08Å; L155-L158 HydrophobicContact CD2-CD1 4.44Å; L155-L158 VanDerWaalsContact O-CD1 3.26Å; L155-L158 WeakPolarHBondContact O-CD1 3.48Å; L155-L158 VanDerWaalsContact O-CG 3.23Å; L155-L158 WeakPolarHBondContact O-CG 3.36Å; L158-R160 VanDerWaalsContact C-N 3.32Å; L158-R160 PolarHBondContact O-N 3.41Å; L158-L161 PolarHBondContact O-N 2.84Å; L158-S162 WeakPolarHBondContact O-CB 2.92Å; L158-S162 PolarHBondContact O-N 3.48Å; L158-S162 PolarHBondContact O-OG 2.87Å; L158-S162 VanDerWaalsContact O-OG 3.14Å
159	D	95.9	Very high	96	Very high	99 Å²	99	43 Å²	43	53%	0.529	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-32.5	177	-70.7	-28.9	0	0	0	113.2	K127 S157 S162	K127-D159 IonicContact NZ-OD1 3.37Å; K127-D159 PolarHBondContact NZ-OD1 2.99Å; K127-D159 IonicContact NZ-OD2 2.8Å; K127-D159 PolarHBondContact NZ-OD2 3.3Å; S157-D159 PolarHBondContact O-N 3.35Å; S157-D159 VanDerWaalsContact O-N 3.1Å; D159-S162 PolarHBondContact O-OG 2.81Å
160	R	96.7	Very high	96.2	Very high	77 Å²	77	43.8 Å²	43.8	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-73.6	-43.2	174.4	179.8	178.5	62.8	88.1	-1.5	110.6	S157 L158 S162 S163 D172	S157-R160 WeakPolarHBondContact O-CA 3.48Å; S157-R160 WeakPolarHBondContact O-CB 3.39Å; S157-R160 PolarHBondContact O-N 2.83Å; S157-R160 PolarHBondContact OG-NH2 3.42Å; L158-R160 VanDerWaalsContact C-N 3.32Å; L158-R160 PolarHBondContact O-N 3.41Å; R160-S162 VanDerWaalsContact C-N 3.32Å; R160-S162 PolarHBondContact O-N 3.41Å; R160-S163 PolarHBondContact O-N 3.48Å; R160-S163 PolarHBondContact O-OG 2.53Å; R160-D172 IonicContact CZ-OD1 2.66Å; R160-D172 IonicContact CZ-OD2 2.66Å; R160-D172 VanDerWaalsContact NH1-CG 3.34Å; R160-D172 IonicContact NH1-OD1 2.69Å; R160-D172 PolarHBondContact NH1-OD1 2.86Å; R160-D172 VanDerWaalsContact NH1-OD1 3.15Å; R160-D172 IonicContact NH1-OD2 2.71Å; R160-D172 PolarHBondContact NH1-OD2 3.25Å; R160-D172 IonicContact NH2-OD1 2.72Å; R160-D172 PolarHBondContact NH2-OD1 2.79Å; R160-D172 IonicContact NH2-OD2 3.68Å
161	L	95.8	Very high	96.2	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-30.9	-178.3	-60.3	-174.5	0	0	0	112.8	V73 F74 T77 F123 F154 S157 L158 S163 Y166	V73-L161 HydrophobicContact CG1-CD1 4.21Å; V73-L161 HydrophobicContact CG1-CD2 3.88Å; F74-L161 HydrophobicContact CE1-CB 4.31Å; T77-L161 HydrophobicContact CG2-CD1 4.49Å; F123-L161 HydrophobicContact CE1-CB 3.75Å; F123-L161 HydrophobicContact CZ-CB 4.18Å; F123-L161 WeakPolarHBondContact CZ-O 3.3Å; F154-L161 HydrophobicContact CB-CD1 4.21Å; F154-L161 HydrophobicContact CD1-CD1 4.31Å; F154-L161 WeakPolarHBondContact O-CD1 3.36Å; S157-L161 WeakPolarHBondContact O-CG 3.17Å; S157-L161 PolarHBondContact O-N 3.39Å; L158-L161 PolarHBondContact O-N 2.84Å; L161-S163 VanDerWaalsContact C-N 3.34Å; L161-Y166 HydrophobicContact CD2-CD1 4.27Å; L161-Y166 HydrophobicContact CD2-CD2 4.44Å; L161-Y166 HydrophobicContact CD2-CE1 3.56Å; L161-Y166 HydrophobicContact CD2-CE2 3.79Å; L161-Y166 WeakPolarHBondContact CD2-OH 3.36Å
162	S	94.6	Very high	96.2	Very high	49 Å²	49	46.2 Å²	46.2	34%	0.343	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.7	179.5	66.5	0	0	0	0	114.3	L158 D159 R160	L158-S162 WeakPolarHBondContact O-CB 2.92Å; L158-S162 PolarHBondContact O-N 3.48Å; L158-S162 PolarHBondContact O-OG 2.87Å; L158-S162 VanDerWaalsContact O-OG 3.14Å; D159-S162 PolarHBondContact O-OG 2.81Å; R160-S162 VanDerWaalsContact C-N 3.32Å; R160-S162 PolarHBondContact O-N 3.41Å
163	S	94.3	Very high	96.3	Very high	48 Å²	48	44 Å²	44	34%	0.336	26%	0.255	S	S	.	.	S	Bend	trans	-62.6	136.5	-179.5	67.6	0	0	0	0	111.7	R160 L161 G165 Y166	R160-S163 PolarHBondContact O-N 3.48Å; R160-S163 PolarHBondContact O-OG 2.53Å; L161-S163 VanDerWaalsContact C-N 3.34Å; S163-G165 PolarHBondContact O-N 3.22Å; S163-Y166 VanDerWaalsContact O-CB 3.32Å; S163-Y166 WeakPolarHBondContact O-CB 3.36Å; S163-Y166 PolarHBondContact O-N 2.86Å; S163-Y166 WeakPolarHBondContact OG-CB 3.28Å
164	P	89.7	Confident	96.3	Very high	139 Å²	139	41.4 Å²	41.4	90%	0.903	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.1	-175.2	-28.6	35	0	0	0	114.7
165	G	91.1	Very high	96.3	Very high	61 Å²	61	43.2 Å²	43.2	63%	0.629	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	15.6	177.6	0	0	0	0	0	114.5	S163 I167	S163-G165 PolarHBondContact O-N 3.22Å; G165-I167 PolarHBondContact O-N 3.46Å; G165-I167 VanDerWaalsContact O-N 3.13Å
166	Y	94.9	Very high	96.2	Very high	9 Å²	9	43.5 Å²	43.5	4%	0.035	25%	0.253	C	S	.	.			trans	-57.3	121.4	-175.7	173.6	-120.6	0	0	0	111.6	K70 V73 F74 L161 S163 P168 D172	K70-Y166 HydrophobicContact CD-CD1 4.47Å; K70-Y166 HydrophobicContact CG-CD1 4.38Å; K70-Y166 HydrophobicContact CG-CE1 4.45Å; K70-Y166 PolarHBondContact NZ-O 3.38Å; V73-Y166 HydrophobicContact CG1-CE1 4.34Å; F74-Y166 AromaticContact CE1-CD1 3.89Å; F74-Y166 HydrophobicContact CE1-CD1 3.89Å; F74-Y166 AromaticContact CE1-CE1 3.97Å; F74-Y166 HydrophobicContact CE1-CE1 3.97Å; F74-Y166 HydrophobicContact CZ-CD1 4.02Å; F74-Y166 HydrophobicContact CZ-CE1 4.46Å; L161-Y166 HydrophobicContact CD2-CD1 4.27Å; L161-Y166 HydrophobicContact CD2-CD2 4.44Å; L161-Y166 HydrophobicContact CD2-CE1 3.56Å; L161-Y166 HydrophobicContact CD2-CE2 3.79Å; L161-Y166 WeakPolarHBondContact CD2-OH 3.36Å; S163-Y166 VanDerWaalsContact O-CB 3.32Å; S163-Y166 WeakPolarHBondContact O-CB 3.36Å; S163-Y166 PolarHBondContact O-N 2.86Å; S163-Y166 WeakPolarHBondContact OG-CB 3.28Å; Y166-P168 HydrophobicContact CE1-CG 4.11Å; Y166-P168 WeakPolarHBondContact OH-CA 3.46Å; Y166-D172 PolarHBondContact OH-OD2 3.01Å
167	I	95.8	Very high	96.1	Very high	56 Å²	56	41.9 Å²	41.9	29%	0.287	24%	0.24	S	C	.	.			trans	-119.7	129.6	169	-63.2	161.8	0	0	0	107.3	E63 C66 K67 G165 T169	E63-I167 HydrophobicContact CG-CD1 3.88Å; E63-I167 HydrophobicContact CG-CG2 3.97Å; E63-I167 WeakPolarHBondContact OE1-CD1 3Å; C66-I167 HydrophobicContact CB-CG2 4.16Å; K67-I167 HydrophobicContact CG-CG1 4.12Å; K67-I167 HydrophobicContact CG-CG2 3.98Å; G165-I167 PolarHBondContact O-N 3.46Å; G165-I167 VanDerWaalsContact O-N 3.13Å; I167-T169 PolarHBondContact O-N 2.79Å
168	P	97.5	Very high	95.9	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.026	26%	0.255	C	S	.	.			trans	-54.9	137.5	175.5	-28.1	36.5	0	0	0	112.7	C66 K70 V73 Y166 D172	C66-P168 WeakPolarHBondContact CB-O 2.86Å; C66-P168 WeakPolarHBondContact O-CD 3.47Å; C66-P168 VanDerWaalsContact O-CG 3.27Å; C66-P168 WeakPolarHBondContact O-CG 3.35Å; K70-P168 HydrophobicContact CB-CG 3.89Å; V73-P168 HydrophobicContact CG2-CB 4.48Å; V73-P168 HydrophobicContact CG2-CG 4.35Å; Y166-P168 HydrophobicContact CE1-CG 4.11Å; Y166-P168 WeakPolarHBondContact OH-CA 3.46Å; P168-D172 WeakPolarHBondContact CA-OD2 3.48Å; P168-D172 HydrophobicContact CB-CB 3.93Å
169	T	97.8	Very high	95.6	Very high	64 Å²	64	50.8 Å²	50.8	39%	0.393	28%	0.278	S	S	.	.			trans	-79.5	164.9	169.6	63.1	0	0	0	0	110	I167 Q171 D172 V173	I167-T169 PolarHBondContact O-N 2.79Å; T169-Q171 PolarHBondContact O-N 3.19Å; T169-Q171 PolarHBondContact OG1-N 2.75Å; T169-D172 PolarHBondContact N-OD2 3.03Å; T169-D172 WeakPolarHBondContact O-CB 3.34Å; T169-D172 PolarHBondContact O-N 2.82Å; T169-D172 VanDerWaalsContact OG1-CG 3.28Å; T169-D172 PolarHBondContact OG1-N 2.95Å; T169-D172 VanDerWaalsContact OG1-N 3.07Å; T169-D172 PolarHBondContact OG1-OD2 3.31Å; T169-V173 WeakPolarHBondContact O-CG2 3.36Å; T169-V173 PolarHBondContact O-N 3.08Å
170	Q	97.6	Very high	95.4	Very high	69 Å²	69	47.2 Å²	47.2	32%	0.322	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-30.3	170.4	-63.4	-169.9	10.5	0	0	111.9	I55 Y61 V173 L174	I55-Q170 HydrophobicContact CD1-CB 4.17Å; Y61-Q170 HydrophobicContact CD2-CG 4.47Å; Y61-Q170 PolarHBondContact O-NE2 2.86Å; Q170-V173 WeakPolarHBondContact O-CB 3.36Å; Q170-V173 PolarHBondContact O-N 3Å; Q170-L174 WeakPolarHBondContact O-CG 3.22Å; Q170-L174 PolarHBondContact O-N 3.47Å
171	Q	97.8	Very high	95.1	Very high	61 Å²	61	46 Å²	46	29%	0.285	27%	0.271	S	S	.	.	H	α-helix	trans	-68	-39.3	174.4	-167.8	63.6	4.9	0	0	112.4	Y153 T169 V173 L174 R175 T326	Y153-Q171 HydrophobicContact CE2-CG 4.12Å; Y153-Q171 WeakPolarHBondContact OH-CG 3.43Å; T169-Q171 PolarHBondContact O-N 3.19Å; T169-Q171 PolarHBondContact OG1-N 2.75Å; Q171-V173 VanDerWaalsContact C-N 3.32Å; Q171-L174 PolarHBondContact O-N 3Å; Q171-R175 WeakPolarHBondContact O-CB 3.22Å; Q171-R175 VanDerWaalsContact O-CG 3.3Å; Q171-R175 WeakPolarHBondContact O-CG 3.42Å; Q171-R175 PolarHBondContact O-N 3.35Å; Q171-T326 PolarHBondContact NE2-O 3.08Å; Q171-T326 PolarHBondContact OE1-O 3.15Å
172	D	98.1	Very high	94.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-45.7	171.3	-63.7	-49.9	0	0	0	110.2	V73 Y153 F154 R160 Y166 P168 T169 L174 R175 T176	V73-D172 HydrophobicContact CG2-CB 4.13Å; Y153-D172 WeakPolarHBondContact CE1-OD1 3.35Å; Y153-D172 PolarHBondContact OH-OD1 3.4Å; Y153-D172 VanDerWaalsContact OH-OD1 3.09Å; F154-D172 HydrophobicContact CE1-CB 4.17Å; R160-D172 IonicContact CZ-OD1 2.66Å; R160-D172 IonicContact CZ-OD2 2.66Å; R160-D172 VanDerWaalsContact NH1-CG 3.34Å; R160-D172 IonicContact NH1-OD1 2.69Å; R160-D172 PolarHBondContact NH1-OD1 2.86Å; R160-D172 VanDerWaalsContact NH1-OD1 3.15Å; R160-D172 IonicContact NH1-OD2 2.71Å; R160-D172 PolarHBondContact NH1-OD2 3.25Å; R160-D172 IonicContact NH2-OD1 2.72Å; R160-D172 PolarHBondContact NH2-OD1 2.79Å; R160-D172 IonicContact NH2-OD2 3.68Å; Y166-D172 PolarHBondContact OH-OD2 3.01Å; P168-D172 WeakPolarHBondContact CA-OD2 3.48Å; P168-D172 HydrophobicContact CB-CB 3.93Å; T169-D172 PolarHBondContact N-OD2 3.03Å; T169-D172 WeakPolarHBondContact O-CB 3.34Å; T169-D172 PolarHBondContact O-N 2.82Å; T169-D172 VanDerWaalsContact OG1-CG 3.28Å; T169-D172 PolarHBondContact OG1-N 2.95Å; T169-D172 VanDerWaalsContact OG1-N 3.07Å; T169-D172 PolarHBondContact OG1-OD2 3.31Å; D172-L174 VanDerWaalsContact C-N 3.3Å; D172-L174 PolarHBondContact O-N 3.47Å; D172-R175 CarbonylContact O-C 3.59Å; D172-R175 PolarHBondContact O-N 2.91Å; D172-R175 VanDerWaalsContact O-N 3.08Å; D172-T176 VanDerWaalsContact O-CG2 3.3Å; D172-T176 WeakPolarHBondContact O-CG2 3.17Å; D172-T176 PolarHBondContact O-N 3.31Å
173	V	98	Very high	94.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-44.3	177	175.9	0	0	0	0	110.9	K51 Y61 Y69 T169 Q170 Q171 R175 T176	K51-V173 HydrophobicContact CD-CG1 4.33Å; K51-V173 PolarHBondContact NZ-O 2.95Å; Y61-V173 HydrophobicContact CD1-CG1 4.23Å; Y61-V173 HydrophobicContact CD2-CG1 4.22Å; Y61-V173 HydrophobicContact CE1-CG1 3.91Å; Y61-V173 HydrophobicContact CE2-CG1 3.91Å; Y61-V173 HydrophobicContact CG-CG1 4.38Å; Y69-V173 HydrophobicContact CD1-CG1 4.18Å; Y69-V173 HydrophobicContact CD1-CG2 4.48Å; Y69-V173 HydrophobicContact CD2-CB 4.47Å; Y69-V173 HydrophobicContact CD2-CG1 4.03Å; Y69-V173 HydrophobicContact CD2-CG2 3.7Å; Y69-V173 HydrophobicContact CE1-CG1 3.94Å; Y69-V173 HydrophobicContact CE2-CG1 3.77Å; Y69-V173 HydrophobicContact CE2-CG2 4.23Å; Y69-V173 HydrophobicContact CG-CB 4.47Å; Y69-V173 HydrophobicContact CG-CG1 4.23Å; Y69-V173 HydrophobicContact CG-CG2 3.84Å; T169-V173 WeakPolarHBondContact O-CG2 3.36Å; T169-V173 PolarHBondContact O-N 3.08Å; Q170-V173 WeakPolarHBondContact O-CB 3.36Å; Q170-V173 PolarHBondContact O-N 3Å; Q171-V173 VanDerWaalsContact C-N 3.32Å; V173-R175 VanDerWaalsContact C-N 3.35Å; V173-R175 PolarHBondContact O-N 3.43Å; V173-T176 PolarHBondContact O-N 2.96Å; V173-T176 PolarHBondContact O-OG1 3.1Å
174	L	97.9	Very high	94.9	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-36.3	176.5	-71.6	170.7	0	0	0	113.1	T48 K51 Q52 I55 Q170 Q171 D172	T48-L174 HydrophobicContact CG2-CB 4.35Å; T48-L174 HydrophobicContact CG2-CD2 3.88Å; K51-L174 HydrophobicContact CB-CD2 3.7Å; Q52-L174 HydrophobicContact CG-CD2 3.8Å; I55-L174 HydrophobicContact CD1-CD1 3.76Å; I55-L174 HydrophobicContact CD1-CD2 3.92Å; I55-L174 HydrophobicContact CD1-CG 3.86Å; Q170-L174 WeakPolarHBondContact O-CG 3.22Å; Q170-L174 PolarHBondContact O-N 3.47Å; Q171-L174 PolarHBondContact O-N 3Å; D172-L174 VanDerWaalsContact C-N 3.3Å; D172-L174 PolarHBondContact O-N 3.47Å
175	R	97.9	Very high	95.1	Very high	38 Å²	38	45.9 Å²	45.9	14%	0.143	26%	0.259	C	S	.	.	H	α-helix	trans	-83	-14.5	-179.5	-68.9	-77.4	177.3	172.1	-3.1	113.7	S150 Y153 F154 Q171 D172 V173 D271 T326	S150-R175 VanDerWaalsContact CB-O 3.27Å; S150-R175 WeakPolarHBondContact CB-O 3.47Å; S150-R175 VanDerWaalsContact OG-CD 3.31Å; S150-R175 WeakPolarHBondContact OG-CD 3.31Å; S150-R175 PolarHBondContact OG-O 2.92Å; Y153-R175 HydrophobicContact CD1-CB 3.74Å; Y153-R175 HydrophobicContact CD1-CG 3.75Å; Y153-R175 HydrophobicContact CD2-CG 4.42Å; Y153-R175 HydrophobicContact CE1-CB 3.84Å; Y153-R175 HydrophobicContact CE1-CG 3.82Å; Y153-R175 HydrophobicContact CE2-CG 4.48Å; Y153-R175 HydrophobicContact CG-CB 4.49Å; Y153-R175 HydrophobicContact CG-CG 4.07Å; F154-R175 HydrophobicContact CE2-CB 4.1Å; F154-R175 HydrophobicContact CZ-CB 3.78Å; Q171-R175 WeakPolarHBondContact O-CB 3.22Å; Q171-R175 VanDerWaalsContact O-CG 3.3Å; Q171-R175 WeakPolarHBondContact O-CG 3.42Å; Q171-R175 PolarHBondContact O-N 3.35Å; D172-R175 CarbonylContact O-C 3.59Å; D172-R175 PolarHBondContact O-N 2.91Å; D172-R175 VanDerWaalsContact O-N 3.08Å; V173-R175 VanDerWaalsContact C-N 3.35Å; V173-R175 PolarHBondContact O-N 3.43Å; R175-D271 IonicContact NH2-OD2 3.61Å; R175-T326 PolarHBondContact NH2-OG1 2.97Å
176	T	96.9	Very high	95.3	Very high	6 Å²	6	44 Å²	44	4%	0.037	24%	0.235	C	C	.	.			trans	-64.6	138.8	172.8	59.4	0	0	0	0	112.1	K51 Y69 V72 V73 N76 F154 D172 V173	K51-T176 PolarHBondContact NZ-O 2.88Å; K51-T176 PolarHBondContact NZ-OG1 3.1Å; Y69-T176 HydrophobicContact CD1-CG2 4.18Å; V72-T176 HydrophobicContact CB-CG2 4.28Å; V72-T176 HydrophobicContact CG1-CG2 3.98Å; V73-T176 HydrophobicContact CG2-CG2 3.55Å; N76-T176 WeakPolarHBondContact OD1-CA 3.32Å; F154-T176 HydrophobicContact CZ-CG2 4.33Å; D172-T176 VanDerWaalsContact O-CG2 3.3Å; D172-T176 WeakPolarHBondContact O-CG2 3.17Å; D172-T176 PolarHBondContact O-N 3.31Å; V173-T176 PolarHBondContact O-N 2.96Å; V173-T176 PolarHBondContact O-OG1 3.1Å
177	R	94.5	Very high	95.3	Very high	61 Å²	61	48.3 Å²	48.3	23%	0.23	26%	0.256	C	S	.	.			trans	-110.6	114.6	175.3	-178.8	64.1	-177.1	134.3	0.3	110.1	E43 N76 N148	E43-R177 VanDerWaalsContact CG-NH2 3.34Å; E43-R177 IonicContact OE1-NE 3.16Å; E43-R177 IonicContact OE1-NH2 3.83Å; N76-R177 PolarHBondContact ND2-O 2.66Å; N76-R177 PolarHBondContact OD1-N 3.48Å; N76-R177 PolarHBondContact OD1-O 3.31Å; N148-R177 VanDerWaalsContact ND2-CB 3.26Å; N148-R177 WeakPolarHBondContact ND2-CB 3.49Å
178	V	93.4	Very high	95.3	Very high	82 Å²	82	46.2 Å²	46.2	50%	0.497	24%	0.244	S	C	.	.			trans	-120	133.8	165.7	-177.2	0	0	0	0	107.4	V72 T180	V72-V178 HydrophobicContact CG1-CG2 3.65Å; V72-V178 HydrophobicContact CG2-CG2 4.49Å; V178-T180 PolarHBondContact O-N 2.84Å
179	R	92.5	Very high	94.9	Very high	138 Å²	138	49.7 Å²	49.7	52%	0.521	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-68.7	116.9	173.7	177.7	-178.1	168.4	169.8	5.4	108.7	G181 S205	R179-G181 PolarHBondContact O-N 3.39Å; R179-S205 PolarHBondContact NH2-OG 3.4Å
180	T	90.8	Very high	94.4	Very high	24 Å²	24	48.1 Å²	48.1	15%	0.147	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-70.6	116.3	175.2	-40.7	0	0	0	0	109.8	S47 V178 V184 G201	S47-T180 PolarHBondContact OG-OG1 2.88Å; V178-T180 PolarHBondContact O-N 2.84Å; T180-V184 HydrophobicContact CG2-CG2 4.33Å; T180-G201 WeakPolarHBondContact O-CA 3.26Å
181	G	90.4	Very high	93.8	Very high	52 Å²	52	49.7 Å²	49.7	54%	0.536	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-101.1	136.9	169.2	0	0	0	0	0	110.3	R179	R179-G181 PolarHBondContact O-N 3.39Å
182	G	91.7	Very high	93.1	Very high	19 Å²	19	49.6 Å²	49.6	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	72.8	-143.6	177.8	0	0	0	0	0	113.9	G201 E206	G182-G201 PolarHBondContact O-N 3.26Å; G182-G201 VanDerWaalsContact O-N 3.17Å; G182-E206 PolarHBondContact N-OE2 3.07Å
183	I	93.7	Very high	92.5	Very high	70 Å²	70	50.2 Å²	50.2	36%	0.359	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.3	-174.3	-60.1	157	0	0	0	107.2	F198 D199 V200 H212 C213	I183-F198 HydrophobicContact CG2-CD1 3.89Å; I183-D199 WeakPolarHBondContact CA-O 3.06Å; I183-V200 HydrophobicContact CB-CG1 4.43Å; I183-V200 HydrophobicContact CG1-CG1 3.92Å; I183-V200 HydrophobicContact CG2-CG1 4.24Å; I183-H212 HydrophobicContact CD1-CB 4.04Å; I183-C213 WeakPolarHBondContact CD1-SG 3.39Å; I183-C213 VanDerWaalsContact CG2-SG 3.52Å
184	V	94.3	Very high	92.2	Very high	67 Å²	67	52.6 Å²	52.6	41%	0.406	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.2	175.3	-180	0	0	0	0	108.3	T180 F198 D199	T180-V184 HydrophobicContact CG2-CG2 4.33Å; V184-F198 WeakPolarHBondContact O-CA 3.23Å; V184-D199 PolarHBondContact N-O 3.37Å; V184-D199 PolarHBondContact O-N 2.9Å
185	E	95.6	Very high	92	Very high	80 Å²	80	52.5 Å²	52.5	37%	0.374	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	129	177.2	-173.6	174.4	-177.1	0	0	109.8	H187 R196 M197 F198	E185-H187 IonicContact OE1-CE1 2.86Å; E185-H187 PolarHBondContact OE1-CE1 3.04Å; E185-H187 IonicContact OE1-NE2 3.36Å; E185-H187 PolarHBondContact OE1-NE2 2.65Å; E185-R196 WeakPolarHBondContact OE1-CD 3.44Å; E185-M197 WeakPolarHBondContact CA-O 3.4Å; E185-F198 HydrophobicContact CB-CD1 4.29Å; E185-F198 HydrophobicContact CB-CE1 4.06Å; E185-F198 HydrophobicContact CG-CD1 4.33Å; E185-F198 HydrophobicContact CG-CE1 3.84Å; E185-F198 HydrophobicContact CG-CE2 4.23Å; E185-F198 HydrophobicContact CG-CZ 3.79Å; E185-F198 VanDerWaalsContact OE1-CZ 3.27Å; E185-F198 WeakPolarHBondContact OE1-CZ 3.11Å
186	T	95	Very high	91.8	Very high	22 Å²	22	54.4 Å²	54.4	14%	0.135	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.6	176.9	-59.8	0	0	0	0	109.3	V50 M58 F188 M197	V50-T186 HydrophobicContact CG1-CG2 4.22Å; V50-T186 WeakPolarHBondContact CG1-OG1 3.44Å; M58-T186 HydrophobicContact SD-CG2 3.94Å; T186-F188 HydrophobicContact CG2-CD1 4.39Å; T186-M197 PolarHBondContact N-O 3.17Å; T186-M197 PolarHBondContact O-N 2.76Å
187	H	95.2	Very high	91.8	Very high	99 Å²	99	54.1 Å²	54.1	46%	0.458	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.1	179.1	-59.2	-98	0	0	0	110.5	E185 I195	E185-H187 IonicContact OE1-CE1 2.86Å; E185-H187 PolarHBondContact OE1-CE1 3.04Å; E185-H187 IonicContact OE1-NE2 3.36Å; E185-H187 PolarHBondContact OE1-NE2 2.65Å; H187-I195 WeakPolarHBondContact CA-O 3.38Å
188	F	93.9	Very high	91.9	Very high	11 Å²	11	52.1 Å²	52.1	5%	0.048	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	157	171.6	59.2	-84.2	0	0	0	110.6	M53 H57 M58 T186 F190 I195 M197 F335	M53-F188 HydrophobicContact CB-CD1 4.11Å; M53-F188 HydrophobicContact CB-CE1 3.8Å; M53-F188 HydrophobicContact CB-CZ 4.05Å; M53-F188 HydrophobicContact CG-CE1 3.75Å; M53-F188 HydrophobicContact CG-CE2 4.44Å; M53-F188 HydrophobicContact CG-CZ 3.69Å; M53-F188 HydrophobicContact SD-CE1 4.25Å; M53-F188 HydrophobicContact SD-CE2 3.92Å; M53-F188 HydrophobicContact SD-CZ 3.54Å; M53-F188 VanDerWaalsContact SD-CZ 3.54Å; H57-F188 HydrophobicContact CB-CB 4.14Å; H57-F188 HydrophobicContact CB-CD2 3.86Å; H57-F188 HydrophobicContact CB-CG 4.29Å; H57-F188 AromaticContact CD2-CD2 3.71Å; H57-F188 AromaticContact CD2-CE2 3.67Å; H57-F188 AromaticContact CG-CD2 3.94Å; M58-F188 HydrophobicContact CG-CB 3.95Å; M58-F188 HydrophobicContact SD-CB 4.24Å; T186-F188 HydrophobicContact CG2-CD1 4.39Å; F188-F190 HydrophobicContact CD2-CB 4.33Å; F188-F190 HydrophobicContact CE2-CB 4.35Å; F188-I195 HydrophobicContact CD1-CG2 4.46Å; F188-I195 HydrophobicContact CD2-CB 4.23Å; F188-I195 HydrophobicContact CD2-CD1 4.45Å; F188-I195 HydrophobicContact CE1-CB 4.19Å; F188-I195 HydrophobicContact CE1-CG2 3.73Å; F188-I195 HydrophobicContact CE2-CB 3.89Å; F188-I195 HydrophobicContact CE2-CD1 3.71Å; F188-I195 HydrophobicContact CE2-CG1 4.34Å; F188-I195 HydrophobicContact CE2-CG2 4Å; F188-I195 HydrophobicContact CZ-CB 3.87Å; F188-I195 HydrophobicContact CZ-CD1 4.15Å; F188-I195 HydrophobicContact CZ-CG2 3.46Å; F188-I195 VanDerWaalsContact CZ-CG2 3.46Å; F188-I195 PolarHBondContact N-O 2.91Å; F188-I195 VanDerWaalsContact N-O 3.1Å; F188-I195 PolarHBondContact O-N 3.09Å; F188-M197 HydrophobicContact CE1-CB 3.92Å; F188-M197 HydrophobicContact CE1-CE 4.04Å; F188-M197 HydrophobicContact CE1-SD 4.37Å; F188-M197 HydrophobicContact CZ-CE 3.91Å; F188-F335 AromaticContact CE2-CE1 3.84Å; F188-F335 HydrophobicContact CE2-CE1 3.84Å; F188-F335 AromaticContact CE2-CZ 3.98Å; F188-F335 HydrophobicContact CE2-CZ 3.98Å; F188-F335 HydrophobicContact CZ-CE1 4.06Å; F188-F335 AromaticContact CZ-CZ 3.72Å; F188-F335 HydrophobicContact CZ-CZ 3.72Å
189	S	89.5	Confident	92	Very high	78 Å²	78	48.4 Å²	48.4	55%	0.545	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.3	174	-172.3	0	0	0	0	110.4	L193	S189-L193 CarbonylContact C-O 3.57Å; S189-L193 VanDerWaalsContact CA-O 3.29Å; S189-L193 WeakPolarHBondContact CA-O 3.42Å; S189-L193 PolarHBondContact OG-O 2.84Å
190	F	88.1	Confident	92.2	Very high	30 Å²	30	41.9 Å²	41.9	13%	0.132	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	128.3	176.7	-176.6	-132.3	0	0	0	110.5	H57 F188 G192 L193 I195 F335 D336 T339	H57-F190 AromaticContact CE1-CD2 3.15Å; H57-F190 WeakPolarHBondContact CE1-CD2 3.45Å; H57-F190 AromaticContact CE1-CE2 3.38Å; H57-F190 WeakPolarHBondContact CE1-CE2 3.5Å; H57-F190 AromaticContact CE1-CG 3.68Å; H57-F190 AromaticContact ND1-CD2 3.57Å; H57-F190 AromaticContact NE2-CD2 3.95Å; F188-F190 HydrophobicContact CD2-CB 4.33Å; F188-F190 HydrophobicContact CE2-CB 4.35Å; F190-G192 PolarHBondContact O-N 2.85Å; F190-G192 VanDerWaalsContact O-N 3.09Å; F190-L193 PolarHBondContact N-O 3.38Å; F190-L193 WeakPolarHBondContact O-CA 3.49Å; F190-L193 VanDerWaalsContact O-CB 3.26Å; F190-L193 WeakPolarHBondContact O-CB 3.15Å; F190-L193 PolarHBondContact O-N 2.97Å; F190-I195 HydrophobicContact CB-CD1 3.95Å; F190-I195 HydrophobicContact CD1-CD1 4.39Å; F190-F335 HydrophobicContact CD1-CD1 4.05Å; F190-F335 AromaticContact CD1-CE1 3.86Å; F190-F335 HydrophobicContact CD1-CE1 3.86Å; F190-F335 HydrophobicContact CE1-CD1 4Å; F190-F335 HydrophobicContact CE1-CE1 4.26Å; F190-D336 HydrophobicContact CZ-CB 4.38Å; F190-D336 WeakPolarHBondContact CZ-OD1 3.5Å; F190-T339 HydrophobicContact CD1-CG2 3.64Å; F190-T339 WeakPolarHBondContact CD1-OG1 3.22Å; F190-T339 HydrophobicContact CE1-CG2 3.82Å; F190-T339 WeakPolarHBondContact CE1-OG1 3.37Å
191	K	84.4	Confident	92.4	Very high	103 Å²	103	40.8 Å²	40.8	45%	0.448	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	34.1	-175.9	-63	-172.1	177.3	177.9	0	114.5	L193 D336 D340 I343	K191-L193 PolarHBondContact O-N 3.39Å; K191-D336 WeakPolarHBondContact CE-OD1 3.18Å; K191-D336 IonicContact NZ-OD1 3.38Å; K191-D336 PolarHBondContact NZ-OD1 3.48Å; K191-D336 IonicContact NZ-OD2 3.25Å; K191-D340 VanDerWaalsContact NZ-CG 3.26Å; K191-D340 IonicContact NZ-OD1 2.97Å; K191-D340 PolarHBondContact NZ-OD1 2.89Å; K191-D340 IonicContact NZ-OD2 2.71Å; K191-D340 PolarHBondContact NZ-OD2 2.71Å; K191-D340 VanDerWaalsContact NZ-OD2 3.16Å; K191-I343 HydrophobicContact CB-CD1 4.37Å
192	G	83	Confident	92.5	Very high	59 Å²	59	38.7 Å²	38.7	61%	0.608	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.2	0	-178.1	0	0	0	0	0	115	F190	F190-G192 PolarHBondContact O-N 2.85Å; F190-G192 VanDerWaalsContact O-N 3.09Å
193	L	86.6	Confident	92.6	Very high	13 Å²	13	39.4 Å²	39.4	7%	0.068	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	133.2	170.1	-165.5	72	0	0	0	109.3	K32 A34 S189 F190 K191 I195 I343	K32-L193 CarbonylContact O-C 3.52Å; K32-L193 WeakPolarHBondContact O-CA 3.07Å; K32-L193 WeakPolarHBondContact O-CD1 3.46Å; A34-L193 HydrophobicContact CB-CD1 4.31Å; A34-L193 HydrophobicContact CB-CD2 3.61Å; A34-L193 HydrophobicContact CB-CG 4.05Å; S189-L193 CarbonylContact C-O 3.57Å; S189-L193 VanDerWaalsContact CA-O 3.29Å; S189-L193 WeakPolarHBondContact CA-O 3.42Å; S189-L193 PolarHBondContact OG-O 2.84Å; F190-L193 PolarHBondContact N-O 3.38Å; F190-L193 WeakPolarHBondContact O-CA 3.49Å; F190-L193 VanDerWaalsContact O-CB 3.26Å; F190-L193 WeakPolarHBondContact O-CB 3.15Å; F190-L193 PolarHBondContact O-N 2.97Å; K191-L193 PolarHBondContact O-N 3.39Å; L193-I195 HydrophobicContact CB-CG1 4.49Å; L193-I195 HydrophobicContact CD2-CD1 4.27Å; L193-I195 HydrophobicContact CD2-CG1 3.97Å; L193-I195 HydrophobicContact CG-CG1 4.18Å; L193-I343 HydrophobicContact CD2-CG1 4.13Å
194	S	90.8	Very high	92.6	Very high	50 Å²	50	40.1 Å²	40.1	35%	0.35	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112	167.2	-176.1	0	0	0	0	108.5	K32 E33 A34	K32-S194 WeakPolarHBondContact O-CB 3.48Å; K32-S194 PolarHBondContact O-N 2.73Å; E33-S194 CarbonylContact C-O 3.54Å; E33-S194 VanDerWaalsContact CA-O 3.24Å; E33-S194 WeakPolarHBondContact CA-O 3.46Å; A34-S194 PolarHBondContact N-O 3.15Å
195	I	93.1	Very high	92.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126	-177.7	-63.9	176.9	0	0	0	109.2	A34 L36 H187 F188 F190 L193 F335	A34-I195 WeakPolarHBondContact O-CA 3.32Å; L36-I195 HydrophobicContact CD1-CG2 3.56Å; L36-I195 HydrophobicContact CG-CG2 3.81Å; H187-I195 WeakPolarHBondContact CA-O 3.38Å; F188-I195 HydrophobicContact CD1-CG2 4.46Å; F188-I195 HydrophobicContact CD2-CB 4.23Å; F188-I195 HydrophobicContact CD2-CD1 4.45Å; F188-I195 HydrophobicContact CE1-CB 4.19Å; F188-I195 HydrophobicContact CE1-CG2 3.73Å; F188-I195 HydrophobicContact CE2-CB 3.89Å; F188-I195 HydrophobicContact CE2-CD1 3.71Å; F188-I195 HydrophobicContact CE2-CG1 4.34Å; F188-I195 HydrophobicContact CE2-CG2 4Å; F188-I195 HydrophobicContact CZ-CB 3.87Å; F188-I195 HydrophobicContact CZ-CD1 4.15Å; F188-I195 HydrophobicContact CZ-CG2 3.46Å; F188-I195 VanDerWaalsContact CZ-CG2 3.46Å; F188-I195 PolarHBondContact N-O 2.91Å; F188-I195 VanDerWaalsContact N-O 3.1Å; F188-I195 PolarHBondContact O-N 3.09Å; F190-I195 HydrophobicContact CB-CD1 3.95Å; F190-I195 HydrophobicContact CD1-CD1 4.39Å; L193-I195 HydrophobicContact CB-CG1 4.49Å; L193-I195 HydrophobicContact CD2-CD1 4.27Å; L193-I195 HydrophobicContact CD2-CG1 3.97Å; L193-I195 HydrophobicContact CG-CG1 4.18Å; I195-F335 HydrophobicContact CD1-CE1 4.01Å; I195-F335 HydrophobicContact CD1-CZ 4.07Å
196	R	94.6	Very high	92.4	Very high	77 Å²	77	37.6 Å²	37.6	29%	0.291	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	105.9	168.5	-60.9	-167.8	-77.2	178.8	-17.9	109	E33 A34 K35 L36 E185 F198	E33-R196 VanDerWaalsContact CD-CZ 3.48Å; E33-R196 VanDerWaalsContact CD-NH2 3.34Å; E33-R196 HydrophobicContact CG-CG 4.34Å; E33-R196 WeakPolarHBondContact OE1-CD 3.49Å; E33-R196 WeakPolarHBondContact OE1-CG 3.41Å; E33-R196 IonicContact OE1-CZ 3.34Å; E33-R196 IonicContact OE1-NE 3.75Å; E33-R196 PolarHBondContact OE1-NE 3.19Å; E33-R196 IonicContact OE1-NH2 2.73Å; E33-R196 IonicContact OE2-CZ 2.66Å; E33-R196 VanDerWaalsContact OE2-CZ 3.25Å; E33-R196 IonicContact OE2-NE 2.7Å; E33-R196 PolarHBondContact OE2-NE 2.69Å; E33-R196 IonicContact OE2-NH2 3.54Å; E33-R196 PolarHBondContact OE2-NH2 3.01Å; A34-R196 PolarHBondContact O-N 3.34Å; K35-R196 CarbonylContact C-O 3.53Å; K35-R196 WeakPolarHBondContact CA-O 3.46Å; L36-R196 PolarHBondContact N-O 3.26Å; E185-R196 WeakPolarHBondContact OE1-CD 3.44Å; R196-F198 HydrophobicContact CB-CE2 3.79Å
197	M	95.9	Very high	92.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.5	-179.9	-177.1	173.3	-74.6	0	0	110.5	L36 L38 V50 M53 E185 T186 F188 I221 F335	L36-M197 HydrophobicContact CD1-CE 4.05Å; L36-M197 CarbonylContact O-C 3.59Å; L36-M197 WeakPolarHBondContact O-CA 3.44Å; L38-M197 HydrophobicContact CD1-CG 4.08Å; L38-M197 HydrophobicContact CD1-SD 3.79Å; L38-M197 HydrophobicContact CD2-CE 4.32Å; L38-M197 HydrophobicContact CD2-CG 4.35Å; L38-M197 HydrophobicContact CD2-SD 4.17Å; L38-M197 HydrophobicContact CG-CG 3.93Å; L38-M197 HydrophobicContact CG-SD 4.09Å; V50-M197 HydrophobicContact CG2-SD 4.05Å; M53-M197 HydrophobicContact CG-CE 3.67Å; M53-M197 HydrophobicContact CG-SD 3.73Å; M53-M197 HydrophobicContact SD-CE 4.07Å; E185-M197 WeakPolarHBondContact CA-O 3.4Å; T186-M197 PolarHBondContact N-O 3.17Å; T186-M197 PolarHBondContact O-N 2.76Å; F188-M197 HydrophobicContact CE1-CB 3.92Å; F188-M197 HydrophobicContact CE1-CE 4.04Å; F188-M197 HydrophobicContact CE1-SD 4.37Å; F188-M197 HydrophobicContact CZ-CE 3.91Å; M197-I221 HydrophobicContact CE-CD1 4.4Å; M197-F335 HydrophobicContact CE-CE2 3.72Å; M197-F335 HydrophobicContact CE-CZ 4.08Å
198	F	97.1	Very high	92.3	Very high	19 Å²	19	42.8 Å²	42.8	8%	0.083	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113.8	179	-69.5	-97.2	0	0	0	109.9	K35 L36 L37 L38 I183 V184 E185 R196	K35-F198 HydrophobicContact CD-CD2 4.22Å; K35-F198 HydrophobicContact CD-CE2 3.82Å; K35-F198 HydrophobicContact CD-CZ 4.49Å; K35-F198 HydrophobicContact CG-CD2 3.79Å; K35-F198 HydrophobicContact CG-CE2 3.66Å; L36-F198 PolarHBondContact O-N 2.9Å; L37-F198 HydrophobicContact CD1-CB 3.75Å; L38-F198 PolarHBondContact N-O 3.25Å; I183-F198 HydrophobicContact CG2-CD1 3.89Å; V184-F198 WeakPolarHBondContact O-CA 3.23Å; E185-F198 HydrophobicContact CB-CD1 4.29Å; E185-F198 HydrophobicContact CB-CE1 4.06Å; E185-F198 HydrophobicContact CG-CD1 4.33Å; E185-F198 HydrophobicContact CG-CE1 3.84Å; E185-F198 HydrophobicContact CG-CE2 4.23Å; E185-F198 HydrophobicContact CG-CZ 3.79Å; E185-F198 VanDerWaalsContact OE1-CZ 3.27Å; E185-F198 WeakPolarHBondContact OE1-CZ 3.11Å; R196-F198 HydrophobicContact CB-CE2 3.79Å
199	D	96.6	Very high	92.3	Very high	5 Å²	5	46 Å²	46	3%	0.027	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.6	170.1	-178.4	31.1	0	0	0	110.3	L38 K46 S47 V50 I183 V184	L38-D199 HydrophobicContact CD1-CB 4.28Å; K46-D199 VanDerWaalsContact CB-OD1 3.24Å; K46-D199 WeakPolarHBondContact CB-OD1 3.33Å; S47-D199 VanDerWaalsContact CA-OD2 3.31Å; S47-D199 WeakPolarHBondContact CA-OD2 3.48Å; S47-D199 VanDerWaalsContact CB-OD2 3.3Å; S47-D199 WeakPolarHBondContact CB-OD2 3.42Å; S47-D199 PolarHBondContact OG-OD2 2.83Å; V50-D199 HydrophobicContact CG2-CB 3.59Å; I183-D199 WeakPolarHBondContact CA-O 3.06Å; V184-D199 PolarHBondContact N-O 3.37Å; V184-D199 PolarHBondContact O-N 2.9Å
200	V	96	Very high	92.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.8	-175.5	-60.3	0	0	0	0	110.7	L37 L38 L39 K46 I183 G202 W210	L37-V200 HydrophobicContact CD1-CG1 4.32Å; L38-V200 WeakPolarHBondContact O-CG2 3.2Å; L39-V200 HydrophobicContact CD2-CG2 3.67Å; K46-V200 WeakPolarHBondContact CE-O 3.33Å; I183-V200 HydrophobicContact CB-CG1 4.43Å; I183-V200 HydrophobicContact CG1-CG1 3.92Å; I183-V200 HydrophobicContact CG2-CG1 4.24Å; V200-G202 PolarHBondContact O-N 3.01Å; V200-W210 VanDerWaalsContact CG2-CD1 3.47Å; V200-W210 HydrophobicContact CG2-CD2 4.24Å; V200-W210 HydrophobicContact CG2-CG 4.08Å; V200-W210 HydrophobicContact CG2-CZ2 4.36Å; V200-W210 VanDerWaalsContact CG2-NE1 3.27Å
201	G	94.8	Very high	92.7	Very high	1 Å²	1	45 Å²	45	1%	0.01	23%	0.229	C	C	.	.			trans	-54.5	124.4	175.1	0	0	0	0	0	112	T180 G182 E206 W210	T180-G201 WeakPolarHBondContact O-CA 3.26Å; G182-G201 PolarHBondContact O-N 3.26Å; G182-G201 VanDerWaalsContact O-N 3.17Å; G201-E206 WeakPolarHBondContact O-CB 3.17Å; G201-W210 PolarHBondContact O-NE1 3.43Å
202	G	92.5	Very high	93.1	Very high	7 Å²	7	47.1 Å²	47.1	7%	0.072	24%	0.24	C	C	.	.			trans	-86	-18.1	-175.2	0	0	0	0	0	115.8	G40 G42 V200 R207	G40-G202 WeakPolarHBondContact O-CA 3.31Å; G42-G202 VanDerWaalsContact N-C 3.32Å; G42-G202 PolarHBondContact N-O 2.81Å; V200-G202 PolarHBondContact O-N 3.01Å; G202-R207 PolarHBondContact O-NE 2.82Å
203	Q	93.4	Very high	93.6	Very high	34 Å²	34	44.4 Å²	44.4	16%	0.159	21%	0.212	C	C	.	.	S	Bend	trans	-69.5	152	-178.8	-70.6	-174.7	-5.7	0	0	111.3	S205 E206 R207 E235	Q203-S205 PolarHBondContact O-N 2.96Å; Q203-S205 VanDerWaalsContact O-N 3.09Å; Q203-E206 PolarHBondContact O-N 3.17Å; Q203-R207 WeakPolarHBondContact O-CG 3.28Å; Q203-R207 PolarHBondContact O-N 3.46Å; Q203-E235 WeakPolarHBondContact CB-OE1 3.3Å; Q203-E235 WeakPolarHBondContact CG-OE1 3.43Å
204	R	93.8	Very high	93.9	Very high	86 Å²	86	44.4 Å²	44.4	33%	0.325	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.7	-173.4	-75.2	-178	170.3	174.9	-2.1	113.1	E206 R207 D236 E244	R204-E206 VanDerWaalsContact C-N 3.27Å; R204-E206 PolarHBondContact O-N 2.72Å; R204-R207 PolarHBondContact O-N 3.39Å; R204-D236 IonicContact CZ-OD2 3.75Å; R204-D236 IonicContact NH1-OD2 3.7Å; R204-D236 PolarHBondContact NH1-OD2 3.44Å; R204-D236 IonicContact NH2-OD2 2.6Å; R204-E244 IonicContact CZ-OE1 3.62Å; R204-E244 IonicContact CZ-OE2 2.63Å; R204-E244 IonicContact NE-OE1 3.91Å; R204-E244 PolarHBondContact NE-OE1 3.44Å; R204-E244 IonicContact NE-OE2 2.83Å; R204-E244 IonicContact NH2-OE1 2.96Å; R204-E244 IonicContact NH2-OE2 2.74Å; R204-E244 PolarHBondContact NH2-OE2 2.96Å
205	S	93	Very high	93.9	Very high	71 Å²	71	49.4 Å²	49.4	50%	0.497	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-27	177.4	47.8	0	0	0	0	114.5	R179 Q203	R179-S205 PolarHBondContact NH2-OG 3.4Å; Q203-S205 PolarHBondContact O-N 2.96Å; Q203-S205 VanDerWaalsContact O-N 3.09Å
206	E	94.2	Very high	93.7	Very high	22 Å²	22	52.3 Å²	52.3	10%	0.103	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-19.5	-177	-63.6	-60.8	117.1	0	0	113	G182 G201 Q203 R204 K208 K209	G182-E206 PolarHBondContact N-OE2 3.07Å; G201-E206 WeakPolarHBondContact O-CB 3.17Å; Q203-E206 PolarHBondContact O-N 3.17Å; R204-E206 VanDerWaalsContact C-N 3.27Å; R204-E206 PolarHBondContact O-N 2.72Å; E206-K208 VanDerWaalsContact C-N 3.26Å; E206-K208 PolarHBondContact O-N 3.02Å; E206-K208 VanDerWaalsContact O-N 3.16Å; E206-K209 WeakPolarHBondContact O-CB 3.48Å; E206-K209 PolarHBondContact O-N 3.1Å; E206-K209 IonicContact OE1-NZ 3.66Å; E206-K209 PolarHBondContact OE1-NZ 2.87Å; E206-K209 IonicContact OE2-NZ 3.84Å; E206-K209 PolarHBondContact OE2-NZ 2.94Å
207	R	94.2	Very high	93.7	Very high	47 Å²	47	49.3 Å²	49.3	18%	0.177	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-64	-25.9	-171.4	-58.2	-166.9	-167.7	152.9	5.4	114.8	G202 Q203 R204 K209 W210 E244	G202-R207 PolarHBondContact O-NE 2.82Å; Q203-R207 WeakPolarHBondContact O-CG 3.28Å; Q203-R207 PolarHBondContact O-N 3.46Å; R204-R207 PolarHBondContact O-N 3.39Å; R207-K209 PolarHBondContact O-N 3.32Å; R207-W210 HydrophobicContact CB-CD2 4.19Å; R207-W210 HydrophobicContact CB-CZ2 4.44Å; R207-W210 HydrophobicContact CG-CD2 4.4Å; R207-W210 HydrophobicContact CG-CH2 4.24Å; R207-W210 HydrophobicContact CG-CZ2 3.77Å; R207-W210 VanDerWaalsContact O-CB 3.28Å; R207-W210 WeakPolarHBondContact O-CB 3.39Å; R207-W210 VanDerWaalsContact O-CG 3.24Å; R207-W210 PolarHBondContact O-N 2.82Å; R207-W210 VanDerWaalsContact O-N 3.1Å; R207-E244 IonicContact CZ-OE1 2.98Å; R207-E244 IonicContact NH1-OE1 2.66Å; R207-E244 PolarHBondContact NH1-OE1 3.01Å; R207-E244 IonicContact NH2-OE1 3.23Å; R207-E244 PolarHBondContact NH2-OE1 3.02Å
208	K	92.7	Very high	93.4	Very high	184 Å²	184	50.9 Å²	50.9	80%	0.8	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-59.8	-26.7	174.6	-66.6	-177.3	-178.9	179	0	112.4	E206 W210 I211	E206-K208 VanDerWaalsContact C-N 3.26Å; E206-K208 PolarHBondContact O-N 3.02Å; E206-K208 VanDerWaalsContact O-N 3.16Å; K208-W210 VanDerWaalsContact C-N 3.3Å; K208-W210 PolarHBondContact O-N 3.18Å; K208-I211 WeakPolarHBondContact O-CG2 3.31Å
209	K	93.9	Very high	93.2	Very high	79 Å²	79	50 Å²	50	34%	0.343	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-77.4	-15.2	-179.7	-57.7	175	-173.9	166.1	0	112.8	E206 R207 I211 H212	E206-K209 WeakPolarHBondContact O-CB 3.48Å; E206-K209 PolarHBondContact O-N 3.1Å; E206-K209 IonicContact OE1-NZ 3.66Å; E206-K209 PolarHBondContact OE1-NZ 2.87Å; E206-K209 IonicContact OE2-NZ 3.84Å; E206-K209 PolarHBondContact OE2-NZ 2.94Å; R207-K209 PolarHBondContact O-N 3.32Å; K209-I211 VanDerWaalsContact C-N 3.26Å; K209-I211 PolarHBondContact O-N 3.19Å; K209-H212 WeakPolarHBondContact O-CB 3.3Å; K209-H212 PolarHBondContact O-CD2 3.44Å; K209-H212 PolarHBondContact O-N 2.73Å; K209-H212 VanDerWaalsContact O-N 3.16Å
210	W	94.9	Very high	93.1	Very high	9 Å²	9	49.7 Å²	49.7	3%	0.034	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-61.1	-35.4	-174.3	-68.3	5.3	0	0	0	113.1	L39 V200 G201 R207 K208 H212 C213 F214 L248 I252	L39-W210 HydrophobicContact CB-CH2 4.47Å; L39-W210 HydrophobicContact CB-CZ3 4.41Å; L39-W210 HydrophobicContact CD2-CD2 3.81Å; L39-W210 HydrophobicContact CD2-CE3 3.74Å; L39-W210 HydrophobicContact CD2-CG 4.3Å; L39-W210 HydrophobicContact CD2-CH2 4.29Å; L39-W210 HydrophobicContact CD2-CZ2 4.4Å; L39-W210 HydrophobicContact CD2-CZ3 3.97Å; V200-W210 VanDerWaalsContact CG2-CD1 3.47Å; V200-W210 HydrophobicContact CG2-CD2 4.24Å; V200-W210 HydrophobicContact CG2-CG 4.08Å; V200-W210 HydrophobicContact CG2-CZ2 4.36Å; V200-W210 VanDerWaalsContact CG2-NE1 3.27Å; G201-W210 PolarHBondContact O-NE1 3.43Å; R207-W210 HydrophobicContact CB-CD2 4.19Å; R207-W210 HydrophobicContact CB-CZ2 4.44Å; R207-W210 HydrophobicContact CG-CD2 4.4Å; R207-W210 HydrophobicContact CG-CH2 4.24Å; R207-W210 HydrophobicContact CG-CZ2 3.77Å; R207-W210 VanDerWaalsContact O-CB 3.28Å; R207-W210 WeakPolarHBondContact O-CB 3.39Å; R207-W210 VanDerWaalsContact O-CG 3.24Å; R207-W210 PolarHBondContact O-N 2.82Å; R207-W210 VanDerWaalsContact O-N 3.1Å; K208-W210 VanDerWaalsContact C-N 3.3Å; K208-W210 PolarHBondContact O-N 3.18Å; W210-H212 PolarHBondContact O-N 3.48Å; W210-H212 VanDerWaalsContact O-N 3.08Å; W210-C213 PolarHBondContact O-N 2.96Å; W210-F214 HydrophobicContact CB-CE1 3.76Å; W210-F214 HydrophobicContact CB-CZ 4.09Å; W210-F214 WeakPolarHBondContact O-CD1 3.45Å; W210-F214 VanDerWaalsContact O-CE1 3.25Å; W210-F214 WeakPolarHBondContact O-CE1 3.27Å; W210-L248 HydrophobicContact CH2-CD1 3.8Å; W210-L248 HydrophobicContact CH2-CD2 3.55Å; W210-L248 HydrophobicContact CH2-CG 4.03Å; W210-L248 HydrophobicContact CZ3-CD1 3.6Å; W210-L248 HydrophobicContact CZ3-CD2 4.17Å; W210-L248 HydrophobicContact CZ3-CG 4.13Å; W210-I252 HydrophobicContact CE3-CD1 4.13Å; W210-I252 HydrophobicContact CZ3-CD1 4.02Å; W210-I252 HydrophobicContact CZ3-CG1 4.27Å
211	I	91.7	Very high	93.1	Very high	78 Å²	78	49.7 Å²	49.7	40%	0.4	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-55.8	-28.4	179.5	-169	59.5	0	0	0	112.6	K208 K209 C213 F214 W257	K208-I211 WeakPolarHBondContact O-CG2 3.31Å; K209-I211 VanDerWaalsContact C-N 3.26Å; K209-I211 PolarHBondContact O-N 3.19Å; I211-C213 PolarHBondContact O-N 3.46Å; I211-F214 HydrophobicContact CD1-CB 4.32Å; I211-F214 HydrophobicContact CD1-CD2 3.56Å; I211-F214 HydrophobicContact CD1-CE2 4.15Å; I211-F214 HydrophobicContact CD1-CG 4.11Å; I211-F214 PolarHBondContact O-N 2.75Å; I211-W257 HydrophobicContact CD1-CZ2 4.33Å
212	H	91.7	Very high	93.2	Very high	146 Å²	146	49.6 Å²	49.6	68%	0.676	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-67.6	-12.8	177.4	-58.4	-58	0	0	0	113.5	I183 K209 W210	I183-H212 HydrophobicContact CD1-CB 4.04Å; K209-H212 WeakPolarHBondContact O-CB 3.3Å; K209-H212 PolarHBondContact O-CD2 3.44Å; K209-H212 PolarHBondContact O-N 2.73Å; K209-H212 VanDerWaalsContact O-N 3.16Å; W210-H212 PolarHBondContact O-N 3.48Å; W210-H212 VanDerWaalsContact O-N 3.08Å
213	C	94	Very high	93.5	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.02	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-106.9	-1.8	178.7	-59.9	0	0	0	0	113.7	K35 L37 I183 W210 I211 E215 V217	K35-C213 WeakPolarHBondContact CE-O 3.24Å; K35-C213 PolarHBondContact NZ-O 3.43Å; L37-C213 HydrophobicContact CD1-CB 3.64Å; L37-C213 HydrophobicContact CD2-CB 4.4Å; I183-C213 WeakPolarHBondContact CD1-SG 3.39Å; I183-C213 VanDerWaalsContact CG2-SG 3.52Å; W210-C213 PolarHBondContact O-N 2.96Å; I211-C213 PolarHBondContact O-N 3.46Å; C213-E215 PolarHBondContact O-N 3.36Å; C213-V217 WeakPolarHBondContact O-CG2 3.45Å
214	F	93.7	Very high	93.8	Very high	13 Å²	13	47.7 Å²	47.7	6%	0.057	24%	0.242	C	C	.	.			trans	-77.7	-20.5	-167.4	-77.4	14.4	0	0	0	114.3	L37 W210 I211 V217 I252 W257 F258	L37-F214 HydrophobicContact CD2-CD1 3.8Å; L37-F214 HydrophobicContact CD2-CE1 3.93Å; W210-F214 HydrophobicContact CB-CE1 3.76Å; W210-F214 HydrophobicContact CB-CZ 4.09Å; W210-F214 WeakPolarHBondContact O-CD1 3.45Å; W210-F214 VanDerWaalsContact O-CE1 3.25Å; W210-F214 WeakPolarHBondContact O-CE1 3.27Å; I211-F214 HydrophobicContact CD1-CB 4.32Å; I211-F214 HydrophobicContact CD1-CD2 3.56Å; I211-F214 HydrophobicContact CD1-CE2 4.15Å; I211-F214 HydrophobicContact CD1-CG 4.11Å; I211-F214 PolarHBondContact O-N 2.75Å; F214-V217 WeakPolarHBondContact O-CG2 3.45Å; F214-I252 HydrophobicContact CZ-CD1 4.09Å; F214-W257 HydrophobicContact CB-CB 4.3Å; F214-W257 HydrophobicContact CB-CD2 4.18Å; F214-W257 HydrophobicContact CB-CE3 4.22Å; F214-W257 HydrophobicContact CB-CG 4.23Å; F214-W257 HydrophobicContact CD2-CB 3.89Å; F214-W257 AromaticContact CD2-CD1 3.92Å; F214-W257 AromaticContact CD2-CG 3.84Å; F214-W257 HydrophobicContact CD2-CG 3.84Å; F214-F258 HydrophobicContact CB-CE1 4.19Å; F214-F258 HydrophobicContact CB-CZ 4.13Å; F214-F258 HydrophobicContact CD1-CE1 4.17Å; F214-F258 HydrophobicContact CD1-CE2 4.18Å; F214-F258 AromaticContact CD1-CZ 3.36Å; F214-F258 HydrophobicContact CD1-CZ 3.36Å; F214-F258 HydrophobicContact CD2-CE1 4.33Å; F214-F258 AromaticContact CD2-CE2 3.92Å; F214-F258 HydrophobicContact CD2-CE2 3.92Å; F214-F258 AromaticContact CD2-CZ 3.62Å; F214-F258 HydrophobicContact CD2-CZ 3.62Å; F214-F258 AromaticContact CE1-CE2 3.88Å; F214-F258 HydrophobicContact CE1-CE2 3.88Å; F214-F258 AromaticContact CE1-CZ 3.47Å; F214-F258 HydrophobicContact CE1-CZ 3.47Å; F214-F258 VanDerWaalsContact CE1-CZ 3.47Å; F214-F258 AromaticContact CE2-CE2 3.62Å; F214-F258 HydrophobicContact CE2-CE2 3.62Å; F214-F258 AromaticContact CE2-CZ 3.74Å; F214-F258 HydrophobicContact CE2-CZ 3.74Å; F214-F258 AromaticContact CG-CE1 3.99Å; F214-F258 HydrophobicContact CG-CE1 3.99Å; F214-F258 HydrophobicContact CG-CE2 4.19Å; F214-F258 AromaticContact CG-CZ 3.43Å; F214-F258 HydrophobicContact CG-CZ 3.43Å; F214-F258 VanDerWaalsContact CG-CZ 3.43Å; F214-F258 AromaticContact CZ-CE2 3.59Å; F214-F258 HydrophobicContact CZ-CE2 3.59Å; F214-F258 AromaticContact CZ-CZ 3.66Å; F214-F258 HydrophobicContact CZ-CZ 3.66Å
215	E	91.4	Very high	94	Very high	155 Å²	155	43.9 Å²	43.9	72%	0.724	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	135.7	178.4	-173.3	175.3	-168.9	0	0	111.8	K35 C213 V217	K35-E215 PolarHBondContact NZ-O 3.24Å; C213-E215 PolarHBondContact O-N 3.36Å; E215-V217 VanDerWaalsContact C-N 3.28Å; E215-V217 PolarHBondContact O-N 3.16Å
216	G	88.8	Confident	94.3	Very high	62 Å²	62	40.5 Å²	40.5	64%	0.639	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	25.9	172.1	0	0	0	0	0	115	K35 T218	K35-G216 WeakPolarHBondContact CB-O 3.39Å; G216-T218 PolarHBondContact O-N 2.91Å
217	V	92.6	Very high	94.4	Very high	14 Å²	14	39.5 Å²	39.5	9%	0.085	20%	0.2	C	C	.	.			trans	-73.9	120.6	177.5	177.6	0	0	0	0	109.9	K35 L37 C213 F214 E215 A219 I220 F258 T261	K35-V217 HydrophobicContact CD-CG2 4.32Å; L37-V217 HydrophobicContact CB-CG1 3.84Å; L37-V217 HydrophobicContact CB-CG2 4.12Å; L37-V217 HydrophobicContact CD2-CG2 3.98Å; C213-V217 WeakPolarHBondContact O-CG2 3.45Å; F214-V217 WeakPolarHBondContact O-CG2 3.45Å; E215-V217 VanDerWaalsContact C-N 3.28Å; E215-V217 PolarHBondContact O-N 3.16Å; V217-A219 WeakPolarHBondContact CG1-O 3.38Å; V217-I220 HydrophobicContact CG1-CG1 3.96Å; V217-F258 HydrophobicContact CB-CE1 4.28Å; V217-F258 HydrophobicContact CG2-CE1 4.18Å; V217-T261 HydrophobicContact CB-CG2 4.41Å; V217-T261 HydrophobicContact CG1-CG2 3.84Å
218	T	90.2	Very high	94.6	Very high	32 Å²	32	37.6 Å²	37.6	20%	0.196	19%	0.194	C	C	.	.	S	Bend	trans	-73.9	-48.1	176.2	-50.1	0	0	0	0	111.1	A34 K35 G216 I342 N346	A34-T218 WeakPolarHBondContact CA-OG1 3.39Å; A34-T218 HydrophobicContact CB-CG2 4.13Å; K35-T218 PolarHBondContact N-OG1 3.35Å; K35-T218 WeakPolarHBondContact O-CB 3.35Å; K35-T218 PolarHBondContact O-N 3.39Å; G216-T218 PolarHBondContact O-N 2.91Å; T218-I342 HydrophobicContact CG2-CG2 3.74Å; T218-N346 WeakPolarHBondContact CG2-ND2 3.47Å; T218-N346 WeakPolarHBondContact CG2-OD1 3.19Å
219	A	92.4	Very high	94.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	150.2	177	0	0	0	0	0	111.4	K35 L36 L37 V217 S262 I342	K35-A219 PolarHBondContact O-N 3.4Å; L36-A219 WeakPolarHBondContact CA-O 3.48Å; L36-A219 HydrophobicContact CD2-CB 3.94Å; L37-A219 PolarHBondContact N-O 2.98Å; L37-A219 VanDerWaalsContact N-O 3.08Å; V217-A219 WeakPolarHBondContact CG1-O 3.38Å; A219-S262 WeakPolarHBondContact CA-O 3.29Å; A219-I342 HydrophobicContact CB-CD1 3.67Å; A219-I342 HydrophobicContact CB-CG1 3.88Å
220	I	94.9	Very high	95	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.8	173.3	-63.6	167.6	0	0	0	108.2	L37 L39 V217 F222 I252 F258 T261 S262 I263 V264	L37-I220 WeakPolarHBondContact O-CA 3.25Å; L39-I220 HydrophobicContact CB-CG2 4.27Å; L39-I220 HydrophobicContact CD1-CD1 4.41Å; L39-I220 HydrophobicContact CD1-CG2 3.93Å; L39-I220 HydrophobicContact CG-CG2 4.18Å; V217-I220 HydrophobicContact CG1-CG1 3.96Å; I220-F222 HydrophobicContact CG2-CB 4.35Å; I220-I252 HydrophobicContact CD1-CG2 3.89Å; I220-I252 HydrophobicContact CG2-CG2 4.45Å; I220-F258 HydrophobicContact CD1-CB 3.99Å; I220-F258 HydrophobicContact CD1-CD1 3.62Å; I220-F258 HydrophobicContact CD1-CD2 3.47Å; I220-F258 VanDerWaalsContact CD1-CD2 3.47Å; I220-F258 HydrophobicContact CD1-CE1 3.81Å; I220-F258 HydrophobicContact CD1-CE2 3.67Å; I220-F258 HydrophobicContact CD1-CG 3.42Å; I220-F258 VanDerWaalsContact CD1-CG 3.42Å; I220-F258 HydrophobicContact CD1-CZ 3.79Å; I220-F258 HydrophobicContact CG1-CD1 4.46Å; I220-F258 HydrophobicContact CG1-CE1 4.41Å; I220-T261 HydrophobicContact CD1-CG2 4.16Å; I220-T261 HydrophobicContact CG1-CG2 3.91Å; I220-S262 PolarHBondContact N-O 3.41Å; I220-I263 HydrophobicContact CB-CG1 4.28Å; I220-I263 HydrophobicContact CD1-CG1 4.4Å; I220-V264 PolarHBondContact O-N 2.66Å
221	I	96.5	Very high	95.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	105.8	164	-58.1	170.2	0	0	0	106.5	L36 L37 L38 L39 M197 V223 V264 F266 F335	L36-I221 HydrophobicContact CD1-CD1 4.27Å; L37-I221 PolarHBondContact O-N 2.7Å; L38-I221 WeakPolarHBondContact CA-O 3.27Å; L38-I221 HydrophobicContact CD2-CB 3.61Å; L38-I221 HydrophobicContact CD2-CD1 3.85Å; L38-I221 HydrophobicContact CD2-CG1 4.23Å; L38-I221 HydrophobicContact CD2-CG2 4.01Å; L39-I221 PolarHBondContact N-O 2.87Å; M197-I221 HydrophobicContact CE-CD1 4.4Å; I221-V223 HydrophobicContact CG2-CG2 4.16Å; I221-V264 CarbonylContact C-O 3.56Å; I221-V264 WeakPolarHBondContact CA-O 2.99Å; I221-V264 HydrophobicContact CG1-CB 4.21Å; I221-F266 HydrophobicContact CG2-CB 4.46Å; I221-F266 HydrophobicContact CG2-CD1 4.02Å; I221-F266 HydrophobicContact CG2-CD2 3.72Å; I221-F266 HydrophobicContact CG2-CE1 4.15Å; I221-F266 HydrophobicContact CG2-CE2 3.84Å; I221-F266 HydrophobicContact CG2-CG 3.8Å; I221-F266 HydrophobicContact CG2-CZ 4.05Å; I221-F335 HydrophobicContact CD1-CD2 4.46Å; I221-F335 HydrophobicContact CD1-CE2 3.99Å
222	F	97.8	Very high	95.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.4	176.5	-164.3	-81.3	0	0	0	109.8	L39 I220 V224 L248 F249 I252 V264 L265 F266	L39-F222 HydrophobicContact CB-CD2 3.76Å; L39-F222 HydrophobicContact CB-CE2 4.21Å; L39-F222 CarbonylContact O-C 3.59Å; L39-F222 WeakPolarHBondContact O-CA 3.22Å; I220-F222 HydrophobicContact CG2-CB 4.35Å; F222-V224 HydrophobicContact CD1-CG2 3.83Å; F222-V224 HydrophobicContact CE1-CG2 3.87Å; F222-L248 HydrophobicContact CE2-CD2 4.28Å; F222-L248 HydrophobicContact CE2-CG 4.02Å; F222-L248 HydrophobicContact CZ-CB 4.16Å; F222-L248 HydrophobicContact CZ-CD2 3.97Å; F222-L248 HydrophobicContact CZ-CG 3.89Å; F222-F249 HydrophobicContact CB-CD2 3.98Å; F222-F249 HydrophobicContact CB-CE2 4.04Å; F222-F249 HydrophobicContact CD1-CB 4.33Å; F222-F249 AromaticContact CD1-CD2 3.54Å; F222-F249 HydrophobicContact CD1-CD2 3.54Å; F222-F249 HydrophobicContact CD1-CE2 4.32Å; F222-F249 HydrophobicContact CD1-CG 4.37Å; F222-F249 AromaticContact CD2-CD2 3.89Å; F222-F249 HydrophobicContact CD2-CD2 3.89Å; F222-F249 HydrophobicContact CE1-CB 3.79Å; F222-F249 AromaticContact CE1-CD2 3.9Å; F222-F249 HydrophobicContact CE1-CD2 3.9Å; F222-F249 HydrophobicContact CE1-CG 4.32Å; F222-F249 HydrophobicContact CE2-CB 4.25Å; F222-F249 HydrophobicContact CE2-CD2 4.21Å; F222-F249 AromaticContact CG-CD2 3.53Å; F222-F249 HydrophobicContact CG-CD2 3.53Å; F222-F249 HydrophobicContact CG-CE2 4.11Å; F222-F249 HydrophobicContact CZ-CB 3.74Å; F222-F249 HydrophobicContact CZ-CD2 4.21Å; F222-I252 HydrophobicContact CD2-CB 4.48Å; F222-I252 HydrophobicContact CD2-CG1 4.48Å; F222-I252 HydrophobicContact CD2-CG2 4.42Å; F222-I252 HydrophobicContact CE2-CB 4.4Å; F222-I252 HydrophobicContact CE2-CG1 4.09Å; F222-V264 PolarHBondContact N-O 3.37Å; F222-L265 HydrophobicContact CD1-CD1 4.2Å; F222-F266 PolarHBondContact O-N 3.17Å
223	V	98.5	Very high	95.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.1	-173.3	-167.8	0	0	0	0	109.9	L39 S44 K46 I49 I221 F266 N268	L39-V223 PolarHBondContact O-N 3.15Å; S44-V223 WeakPolarHBondContact CB-O 3.36Å; S44-V223 VanDerWaalsContact O-CG1 3.23Å; S44-V223 WeakPolarHBondContact O-CG1 3.16Å; S44-V223 PolarHBondContact OG-O 3.45Å; S44-V223 VanDerWaalsContact OG-O 3.08Å; K46-V223 HydrophobicContact CG-CB 4.05Å; K46-V223 HydrophobicContact CG-CG2 3.82Å; I49-V223 HydrophobicContact CD1-CB 4.4Å; I49-V223 HydrophobicContact CD1-CG1 3.98Å; I49-V223 HydrophobicContact CD1-CG2 3.47Å; I49-V223 VanDerWaalsContact CD1-CG2 3.47Å; I221-V223 HydrophobicContact CG2-CG2 4.16Å; V223-F266 HydrophobicContact CG1-CB 4.31Å; V223-F266 HydrophobicContact CG2-CB 4.35Å; V223-N268 HydrophobicContact CG1-CB 3.78Å
224	V	98.7	Very high	95.4	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.3	177.4	179.6	0	0	0	0	108.6	F222 M226 M242 L265 F266 L267 N268 F306	F222-V224 HydrophobicContact CD1-CG2 3.83Å; F222-V224 HydrophobicContact CE1-CG2 3.87Å; V224-M226 PolarHBondContact O-N 2.95Å; V224-M242 HydrophobicContact CG1-CE 4.1Å; V224-M242 HydrophobicContact CG1-SD 3.81Å; V224-L265 HydrophobicContact CG2-CD1 3.66Å; V224-F266 PolarHBondContact N-O 3.27Å; V224-L267 HydrophobicContact CB-CD2 4.13Å; V224-L267 HydrophobicContact CG1-CD2 4.33Å; V224-L267 HydrophobicContact CG2-CD2 4.37Å; V224-N268 WeakPolarHBondContact O-CA 3.39Å; V224-N268 WeakPolarHBondContact O-CB 3.44Å; V224-N268 PolarHBondContact O-N 2.86Å; V224-F306 HydrophobicContact CB-CZ 4.27Å; V224-F306 HydrophobicContact CG1-CE1 4.33Å; V224-F306 HydrophobicContact CG1-CE2 3.81Å; V224-F306 HydrophobicContact CG1-CZ 3.58Å; V224-F306 HydrophobicContact CG2-CD1 4Å; V224-F306 HydrophobicContact CG2-CE1 3.5Å; V224-F306 VanDerWaalsContact CG2-CE1 3.5Å; V224-F306 HydrophobicContact CG2-CE2 4.22Å; V224-F306 HydrophobicContact CG2-CZ 3.63Å
225	A	98.4	Very high	95.3	Very high	6 Å²	6	24.5 Å²	24.5	5%	0.05	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	106.8	168.3	0	0	0	0	0	109.9	S227 E228 K269	A225-S227 VanDerWaalsContact C-N 3.29Å; A225-S227 PolarHBondContact O-N 3.4Å; A225-E228 HydrophobicContact CB-CB 4.21Å; A225-E228 HydrophobicContact CB-CG 3.62Å; A225-E228 WeakPolarHBondContact CB-OE1 3.22Å; A225-E228 PolarHBondContact O-N 3.39Å; A225-K269 HydrophobicContact CB-CD 3.75Å; A225-K269 HydrophobicContact CB-CG 4.4Å
226	M	98.5	Very high	95.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-62.2	-38.4	179.2	-67.8	-175.7	75.3	0	0	112.3	V224 E228 Y229 L267 N268 R270 F273 S299 I302 F322	V224-M226 PolarHBondContact O-N 2.95Å; M226-E228 PolarHBondContact O-N 3.37Å; M226-E228 VanDerWaalsContact O-N 3.11Å; M226-Y229 VanDerWaalsContact O-CD1 3.3Å; M226-Y229 WeakPolarHBondContact O-CD1 3.3Å; M226-L267 HydrophobicContact CG-CB 3.99Å; M226-L267 HydrophobicContact SD-CB 3.72Å; M226-N268 WeakPolarHBondContact CB-O 3.44Å; M226-N268 WeakPolarHBondContact CG-O 3.13Å; M226-N268 PolarHBondContact N-O 2.65Å; M226-R270 HydrophobicContact SD-CB 4.37Å; M226-F273 HydrophobicContact CB-CB 3.73Å; M226-F273 HydrophobicContact CB-CD1 4.42Å; M226-F273 HydrophobicContact CB-CD2 4.01Å; M226-F273 HydrophobicContact CB-CG 3.79Å; M226-F273 HydrophobicContact CE-CD1 3.59Å; M226-F273 HydrophobicContact CE-CE1 3.67Å; M226-F273 HydrophobicContact CE-CG 4.1Å; M226-F273 HydrophobicContact CE-CZ 4.22Å; M226-F273 WeakPolarHBondContact O-CD2 3.33Å; M226-F273 HydrophobicContact SD-CD1 4.48Å; M226-S299 VanDerWaalsContact CE-CB 3.5Å; M226-I302 HydrophobicContact CE-CD1 4.15Å; M226-F322 HydrophobicContact CE-CD1 4.1Å; M226-F322 HydrophobicContact CE-CE1 3.81Å; M226-F322 HydrophobicContact SD-CD1 3.66Å; M226-F322 HydrophobicContact SD-CE1 3.97Å
227	S	97.8	Very high	95.6	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.007	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-69.4	-4.1	-176.4	60.5	0	0	0	0	115.3	A225 K269 K276	A225-S227 VanDerWaalsContact C-N 3.29Å; A225-S227 PolarHBondContact O-N 3.4Å; S227-K269 VanDerWaalsContact OG-CD 3.28Å; S227-K269 WeakPolarHBondContact OG-CD 3.3Å; S227-K276 WeakPolarHBondContact O-CD 3.28Å; S227-K276 PolarHBondContact O-NZ 3.31Å
228	E	97.4	Very high	95.6	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.037	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-97.5	6.8	-176.4	-63.1	-176.1	-158.5	0	0	113.2	A225 M226 D230 L231 R241 K269	A225-E228 HydrophobicContact CB-CB 4.21Å; A225-E228 HydrophobicContact CB-CG 3.62Å; A225-E228 WeakPolarHBondContact CB-OE1 3.22Å; A225-E228 PolarHBondContact O-N 3.39Å; M226-E228 PolarHBondContact O-N 3.37Å; M226-E228 VanDerWaalsContact O-N 3.11Å; E228-D230 PolarHBondContact O-N 3.38Å; E228-L231 HydrophobicContact CB-CD1 4.27Å; E228-L231 HydrophobicContact CG-CD1 4.03Å; E228-L231 PolarHBondContact O-N 2.91Å; E228-L231 VanDerWaalsContact O-N 3.08Å; E228-R241 HydrophobicContact CB-CB 3.94Å; E228-R241 VanDerWaalsContact CD-NH1 3.34Å; E228-R241 IonicContact OE1-NH1 2.9Å; E228-R241 WeakPolarHBondContact OE2-CD 3.36Å; E228-R241 IonicContact OE2-CZ 3Å; E228-R241 IonicContact OE2-NE 3.65Å; E228-R241 IonicContact OE2-NH1 3.75Å; E228-R241 PolarHBondContact OE2-NH1 3Å; E228-K269 IonicContact OE1-NZ 3.64Å; E228-K269 PolarHBondContact OE1-NZ 2.86Å
229	Y	97.9	Very high	95.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.9	-179.5	72.3	-83.6	0	0	0	114.5	M226 N240 F273 K276 I277 S280 L282 C285	M226-Y229 VanDerWaalsContact O-CD1 3.3Å; M226-Y229 WeakPolarHBondContact O-CD1 3.3Å; Y229-N240 PolarHBondContact O-ND2 3.4Å; Y229-F273 AromaticContact CD1-CD2 3.72Å; Y229-F273 HydrophobicContact CD1-CD2 3.72Å; Y229-F273 AromaticContact CD1-CE2 3.73Å; Y229-F273 HydrophobicContact CD1-CE2 3.73Å; Y229-F273 AromaticContact CE1-CD2 3.68Å; Y229-F273 HydrophobicContact CE1-CD2 3.68Å; Y229-F273 AromaticContact CE1-CE2 3.75Å; Y229-F273 HydrophobicContact CE1-CE2 3.75Å; Y229-F273 HydrophobicContact CG-CE2 4.45Å; Y229-K276 HydrophobicContact CE1-CB 4.34Å; Y229-K276 HydrophobicContact CE1-CD 3.9Å; Y229-K276 HydrophobicContact CE1-CG 4.21Å; Y229-K276 PolarHBondContact OH-O 3.45Å; Y229-I277 HydrophobicContact CE2-CD1 4.4Å; Y229-I277 WeakPolarHBondContact OH-CA 3.35Å; Y229-I277 PolarHBondContact OH-N 2.92Å; Y229-S280 WeakPolarHBondContact CE2-O 3.46Å; Y229-S280 WeakPolarHBondContact OH-CB 3.49Å; Y229-S280 PolarHBondContact OH-O 3.16Å; Y229-L282 HydrophobicContact CD2-CD1 3.96Å; Y229-L282 HydrophobicContact CG-CD1 4.16Å; Y229-C285 VanDerWaalsContact O-CB 3.32Å; Y229-C285 WeakPolarHBondContact O-CB 3.2Å
230	D	97	Very high	96.2	Very high	11 Å²	11	34 Å²	34	6%	0.059	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	20	178.6	65.7	-15	0	0	0	112.5	E228 K276 S280 I284	E228-D230 PolarHBondContact O-N 3.38Å; D230-K276 VanDerWaalsContact CG-CE 3.49Å; D230-K276 WeakPolarHBondContact OD1-CD 3.32Å; D230-K276 WeakPolarHBondContact OD1-CE 3.46Å; D230-K276 IonicContact OD1-NZ 2.76Å; D230-K276 PolarHBondContact OD1-NZ 3.01Å; D230-K276 WeakPolarHBondContact OD2-CE 3.26Å; D230-K276 IonicContact OD2-NZ 3.64Å; D230-S280 VanDerWaalsContact OD2-CB 3.26Å; D230-S280 WeakPolarHBondContact OD2-CB 3.3Å; D230-S280 PolarHBondContact OD2-OG 3.3Å; D230-I284 HydrophobicContact CB-CD1 4.01Å; D230-I284 HydrophobicContact CB-CG2 4.13Å
231	L	97.2	Very high	96.3	Very high	16 Å²	16	34.8 Å²	34.8	8%	0.084	18%	0.181	C	C	.	.			trans	-111.3	154.8	176.5	-59.2	-174.4	0	0	0	111.5	R143 E228 N240 R241	R143-L231 HydrophobicContact CB-CD2 4.01Å; E228-L231 HydrophobicContact CB-CD1 4.27Å; E228-L231 HydrophobicContact CG-CD1 4.03Å; E228-L231 PolarHBondContact O-N 2.91Å; E228-L231 VanDerWaalsContact O-N 3.08Å; L231-N240 WeakPolarHBondContact O-CA 3.36Å; L231-R241 HydrophobicContact CB-CG 3.93Å; L231-R241 WeakPolarHBondContact O-CG 3.43Å; L231-R241 PolarHBondContact O-N 2.77Å
232	T	96.5	Very high	96.4	Very high	49 Å²	49	34.9 Å²	34.9	30%	0.301	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	158.8	168.5	59.5	0	0	0	0	111.2	Q146 Q237 M239 R241	Q146-T232 PolarHBondContact NE2-O 3.06Å; T232-Q237 WeakPolarHBondContact CB-O 3.49Å; T232-Q237 VanDerWaalsContact CG2-O 3.26Å; T232-Q237 WeakPolarHBondContact CG2-O 3.48Å; T232-M239 CarbonylContact C-O 3.59Å; T232-M239 WeakPolarHBondContact CA-O 3.39Å; T232-M239 WeakPolarHBondContact CB-O 3.39Å; T232-R241 VanDerWaalsContact C-CG 3.4Å; T232-R241 WeakPolarHBondContact O-CG 3.24Å; T232-R241 PolarHBondContact O-NE 2.96Å
233	L	94.9	Very high	96.3	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	142.8	179.3	-65.7	173.4	0	0	0	110.4	E235 D236 M239 R241 E244	L233-E235 PolarHBondContact O-N 2.93Å; L233-D236 HydrophobicContact CB-CB 4.25Å; L233-D236 WeakPolarHBondContact CB-O 3.01Å; L233-D236 HydrophobicContact CD1-CB 4.35Å; L233-D236 PolarHBondContact N-O 2.94Å; L233-D236 CarbonylContact O-C 3.54Å; L233-D236 VanDerWaalsContact O-C 3.31Å; L233-D236 PolarHBondContact O-N 3.37Å; L233-M239 HydrophobicContact CD1-CB 3.85Å; L233-M239 HydrophobicContact CD1-CG 3.59Å; L233-M239 HydrophobicContact CG-CB 4.3Å; L233-M239 HydrophobicContact CG-CG 4.19Å; L233-M239 PolarHBondContact N-O 3.11Å; L233-R241 HydrophobicContact CD2-CB 4.39Å; L233-R241 HydrophobicContact CD2-CG 3.92Å; L233-R241 HydrophobicContact CG-CG 4.35Å; L233-E244 HydrophobicContact CD1-CB 3.97Å; L233-E244 HydrophobicContact CD1-CG 3.74Å; L233-E244 HydrophobicContact CD2-CB 4.26Å; L233-E244 HydrophobicContact CD2-CG 4.07Å; L233-E244 HydrophobicContact CG-CB 4.37Å; L233-E244 HydrophobicContact CG-CG 4.41Å
234	A	92.4	Very high	96.3	Very high	62 Å²	62	38.8 Å²	38.8	51%	0.512	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.1	171.3	0	0	0	0	0	111.2	Q146	Q146-A234 HydrophobicContact CG-CB 4.21Å
235	E	91.9	Very high	96.3	Very high	88 Å²	88	39 Å²	39	41%	0.411	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.1	177.9	-56.2	97.4	139.6	0	0	114.1	Q203 L233	Q203-E235 WeakPolarHBondContact CB-OE1 3.3Å; Q203-E235 WeakPolarHBondContact CG-OE1 3.43Å; L233-E235 PolarHBondContact O-N 2.93Å
236	D	93.7	Very high	96.2	Very high	50 Å²	50	40 Å²	40	27%	0.267	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	97.5	-171.1	-174.1	-6.9	0	0	0	110.3	R204 L233 E238 M239	R204-D236 IonicContact CZ-OD2 3.75Å; R204-D236 IonicContact NH1-OD2 3.7Å; R204-D236 PolarHBondContact NH1-OD2 3.44Å; R204-D236 IonicContact NH2-OD2 2.6Å; L233-D236 HydrophobicContact CB-CB 4.25Å; L233-D236 WeakPolarHBondContact CB-O 3.01Å; L233-D236 HydrophobicContact CD1-CB 4.35Å; L233-D236 PolarHBondContact N-O 2.94Å; L233-D236 CarbonylContact O-C 3.54Å; L233-D236 VanDerWaalsContact O-C 3.31Å; L233-D236 PolarHBondContact O-N 3.37Å; D236-E238 PolarHBondContact O-N 3.13Å; D236-E238 PolarHBondContact OD1-N 3.43Å; D236-M239 HydrophobicContact CB-CB 4.11Å; D236-M239 PolarHBondContact O-N 2.73Å; D236-M239 VanDerWaalsContact O-N 3.14Å
237	Q	91.8	Very high	96.1	Very high	148 Å²	148	44.2 Å²	44.2	69%	0.692	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	-11.5	-171.7	-68.2	-173.8	-9.3	0	0	114.1	T232	T232-Q237 WeakPolarHBondContact CB-O 3.49Å; T232-Q237 VanDerWaalsContact CG2-O 3.26Å; T232-Q237 WeakPolarHBondContact CG2-O 3.48Å
238	E	94	Very high	96.1	Very high	181 Å²	181	44.9 Å²	44.9	85%	0.846	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	-16.2	175.4	-60.6	-61.5	130.5	0	0	111.9	D236	D236-E238 PolarHBondContact O-N 3.13Å; D236-E238 PolarHBondContact OD1-N 3.43Å
239	M	96.2	Very high	96	Very high	60 Å²	60	44.5 Å²	44.5	30%	0.296	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.4	-176.7	-176.6	62.4	67.7	0	0	111.3	T232 L233 D236 E244	T232-M239 CarbonylContact C-O 3.59Å; T232-M239 WeakPolarHBondContact CA-O 3.39Å; T232-M239 WeakPolarHBondContact CB-O 3.39Å; L233-M239 HydrophobicContact CD1-CB 3.85Å; L233-M239 HydrophobicContact CD1-CG 3.59Å; L233-M239 HydrophobicContact CG-CB 4.3Å; L233-M239 HydrophobicContact CG-CG 4.19Å; L233-M239 PolarHBondContact N-O 3.11Å; D236-M239 HydrophobicContact CB-CB 4.11Å; D236-M239 PolarHBondContact O-N 2.73Å; D236-M239 VanDerWaalsContact O-N 3.14Å; M239-E244 HydrophobicContact CG-CB 3.99Å
240	N	97.4	Very high	95.9	Very high	24 Å²	24	46.8 Å²	46.8	13%	0.128	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	134.4	170.9	-179.1	-77	0	0	0	111.4	Y229 L231 M242 M243 E244 C285	Y229-N240 PolarHBondContact O-ND2 3.4Å; L231-N240 WeakPolarHBondContact O-CA 3.36Å; N240-M242 PolarHBondContact O-N 3.44Å; N240-M242 WeakPolarHBondContact OD1-CA 3.49Å; N240-M242 WeakPolarHBondContact OD1-CB 3.49Å; N240-M242 PolarHBondContact OD1-N 3.19Å; N240-M243 HydrophobicContact CB-CB 4.09Å; N240-M243 HydrophobicContact CB-CG 3.94Å; N240-M243 PolarHBondContact O-N 2.89Å; N240-M243 PolarHBondContact OD1-N 3.04Å; N240-M243 VanDerWaalsContact OD1-N 3.14Å; N240-E244 PolarHBondContact O-N 3.01Å; N240-C285 PolarHBondContact OD1-SG 2.97Å
241	R	97.6	Very high	95.8	Very high	16 Å²	16	49.7 Å²	49.7	6%	0.06	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-37.5	-175.2	-64.6	-159	177.3	-165.2	-2.9	113.6	E43 E228 L231 T232 L233 S245	E43-R241 IonicContact OE2-CZ 3.67Å; E43-R241 IonicContact OE2-NH1 3.46Å; E43-R241 PolarHBondContact OE2-NH1 3.48Å; E43-R241 IonicContact OE2-NH2 3.76Å; E43-R241 PolarHBondContact OE2-NH2 3.25Å; E228-R241 HydrophobicContact CB-CB 3.94Å; E228-R241 VanDerWaalsContact CD-NH1 3.34Å; E228-R241 IonicContact OE1-NH1 2.9Å; E228-R241 WeakPolarHBondContact OE2-CD 3.36Å; E228-R241 IonicContact OE2-CZ 3Å; E228-R241 IonicContact OE2-NE 3.65Å; E228-R241 IonicContact OE2-NH1 3.75Å; E228-R241 PolarHBondContact OE2-NH1 3Å; L231-R241 HydrophobicContact CB-CG 3.93Å; L231-R241 WeakPolarHBondContact O-CG 3.43Å; L231-R241 PolarHBondContact O-N 2.77Å; T232-R241 VanDerWaalsContact C-CG 3.4Å; T232-R241 WeakPolarHBondContact O-CG 3.24Å; T232-R241 PolarHBondContact O-NE 2.96Å; L233-R241 HydrophobicContact CD2-CB 4.39Å; L233-R241 HydrophobicContact CD2-CG 3.92Å; L233-R241 HydrophobicContact CG-CG 4.35Å; R241-S245 WeakPolarHBondContact O-CB 3.46Å; R241-S245 PolarHBondContact O-N 3.47Å
242	M	98	Very high	95.6	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-69.3	-41.6	176.6	177.3	67	75.1	0	0	111	V224 N240 E244 S245 M246 F286 I302 F306	V224-M242 HydrophobicContact CG1-CE 4.1Å; V224-M242 HydrophobicContact CG1-SD 3.81Å; N240-M242 PolarHBondContact O-N 3.44Å; N240-M242 WeakPolarHBondContact OD1-CA 3.49Å; N240-M242 WeakPolarHBondContact OD1-CB 3.49Å; N240-M242 PolarHBondContact OD1-N 3.19Å; M242-E244 PolarHBondContact O-N 2.91Å; M242-S245 CarbonylContact O-C 3.31Å; M242-S245 WeakPolarHBondContact O-CA 3.22Å; M242-S245 WeakPolarHBondContact O-CB 3.49Å; M242-S245 PolarHBondContact O-N 3.46Å; M242-S245 VanDerWaalsContact O-N 3.1Å; M242-M246 WeakPolarHBondContact O-CG 3.36Å; M242-M246 PolarHBondContact O-N 2.86Å; M242-F286 HydrophobicContact CG-CE2 4.02Å; M242-F286 HydrophobicContact CG-CZ 3.86Å; M242-I302 HydrophobicContact CE-CD1 4.23Å; M242-I302 HydrophobicContact CE-CG2 4.16Å; M242-I302 HydrophobicContact SD-CG2 4.36Å; M242-F306 HydrophobicContact SD-CE2 3.58Å; M242-F306 VanDerWaalsContact SD-CE2 3.58Å; M242-F306 HydrophobicContact SD-CZ 3.77Å
243	M	97.5	Very high	95.5	Very high	70 Å²	70	46.8 Å²	46.8	35%	0.345	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-39.6	175.3	-64.4	-53.6	-62.7	0	0	112.6	N240 S245 M246 T247 C285 F286	N240-M243 HydrophobicContact CB-CB 4.09Å; N240-M243 HydrophobicContact CB-CG 3.94Å; N240-M243 PolarHBondContact O-N 2.89Å; N240-M243 PolarHBondContact OD1-N 3.04Å; N240-M243 VanDerWaalsContact OD1-N 3.14Å; M243-S245 VanDerWaalsContact C-N 3.34Å; M243-M246 PolarHBondContact O-N 3.33Å; M243-M246 HydrophobicContact SD-SD 4.24Å; M243-T247 WeakPolarHBondContact O-CB 3.37Å; M243-T247 PolarHBondContact O-N 3.14Å; M243-T247 PolarHBondContact O-OG1 2.97Å; M243-C285 VanDerWaalsContact SD-SG 3.68Å; M243-F286 HydrophobicContact SD-CE1 4.25Å
244	E	97.4	Very high	95.3	Very high	12 Å²	12	48 Å²	48	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-44.9	170.1	174.8	75.6	175.7	0	0	111.1	R204 R207 L233 M239 N240 M242 M246 T247 L248	R204-E244 IonicContact CZ-OE1 3.62Å; R204-E244 IonicContact CZ-OE2 2.63Å; R204-E244 IonicContact NE-OE1 3.91Å; R204-E244 PolarHBondContact NE-OE1 3.44Å; R204-E244 IonicContact NE-OE2 2.83Å; R204-E244 IonicContact NH2-OE1 2.96Å; R204-E244 IonicContact NH2-OE2 2.74Å; R204-E244 PolarHBondContact NH2-OE2 2.96Å; R207-E244 IonicContact CZ-OE1 2.98Å; R207-E244 IonicContact NH1-OE1 2.66Å; R207-E244 PolarHBondContact NH1-OE1 3.01Å; R207-E244 IonicContact NH2-OE1 3.23Å; R207-E244 PolarHBondContact NH2-OE1 3.02Å; L233-E244 HydrophobicContact CD1-CB 3.97Å; L233-E244 HydrophobicContact CD1-CG 3.74Å; L233-E244 HydrophobicContact CD2-CB 4.26Å; L233-E244 HydrophobicContact CD2-CG 4.07Å; L233-E244 HydrophobicContact CG-CB 4.37Å; L233-E244 HydrophobicContact CG-CG 4.41Å; M239-E244 HydrophobicContact CG-CB 3.99Å; N240-E244 PolarHBondContact O-N 3.01Å; M242-E244 PolarHBondContact O-N 2.91Å; E244-M246 VanDerWaalsContact C-N 3.34Å; E244-M246 PolarHBondContact O-N 3.14Å; E244-T247 PolarHBondContact O-N 3.22Å; E244-L248 VanDerWaalsContact O-CB 3.29Å; E244-L248 WeakPolarHBondContact O-CB 3.41Å; E244-L248 PolarHBondContact O-N 3.14Å
245	S	98.1	Very high	95.3	Very high	4 Å²	4	46.9 Å²	46.9	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-40.7	178.5	-172.6	0	0	0	0	111.8	R241 M242 M243 L248 F249	R241-S245 WeakPolarHBondContact O-CB 3.46Å; R241-S245 PolarHBondContact O-N 3.47Å; M242-S245 CarbonylContact O-C 3.31Å; M242-S245 WeakPolarHBondContact O-CA 3.22Å; M242-S245 WeakPolarHBondContact O-CB 3.49Å; M242-S245 PolarHBondContact O-N 3.46Å; M242-S245 VanDerWaalsContact O-N 3.1Å; M243-S245 VanDerWaalsContact C-N 3.34Å; S245-L248 PolarHBondContact O-N 2.9Å; S245-F249 WeakPolarHBondContact O-CB 3.47Å; S245-F249 PolarHBondContact O-N 3.04Å
246	M	97.4	Very high	95.2	Very high	28 Å²	28	49.9 Å²	49.9	14%	0.138	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-47.8	174.1	-74.4	-175.4	66.8	0	0	111.9	M242 M243 E244 L248 F249 T250 F286 C305 F306	M242-M246 WeakPolarHBondContact O-CG 3.36Å; M242-M246 PolarHBondContact O-N 2.86Å; M243-M246 PolarHBondContact O-N 3.33Å; M243-M246 HydrophobicContact SD-SD 4.24Å; E244-M246 VanDerWaalsContact C-N 3.34Å; E244-M246 PolarHBondContact O-N 3.14Å; M246-L248 PolarHBondContact O-N 3.22Å; M246-F249 WeakPolarHBondContact O-CB 3.5Å; M246-F249 PolarHBondContact O-N 3.44Å; M246-F249 VanDerWaalsContact O-N 3.09Å; M246-T250 PolarHBondContact O-N 3.1Å; M246-T250 PolarHBondContact O-OG1 3.05Å; M246-T250 VanDerWaalsContact O-OG1 3.07Å; M246-F286 HydrophobicContact CE-CE1 4.37Å; M246-F286 HydrophobicContact SD-CE1 3.52Å; M246-F286 VanDerWaalsContact SD-CE1 3.52Å; M246-F286 HydrophobicContact SD-CZ 3.67Å; M246-C305 HydrophobicContact CE-CB 3.68Å; M246-C305 HydrophobicContact SD-CB 4.3Å; M246-F306 HydrophobicContact CB-CE1 4.32Å; M246-F306 HydrophobicContact CB-CZ 4.23Å; M246-F306 HydrophobicContact CG-CD1 4.38Å; M246-F306 HydrophobicContact CG-CD2 4.23Å; M246-F306 HydrophobicContact CG-CE1 3.76Å; M246-F306 HydrophobicContact CG-CE2 3.58Å; M246-F306 HydrophobicContact CG-CZ 3.3Å; M246-F306 HydrophobicContact SD-CE2 4.43Å
247	T	96.4	Very high	95.1	Very high	88 Å²	88	53.8 Å²	53.8	54%	0.54	27%	0.269	S	S	.	.	H	α-helix	trans	-57	-42.9	176.8	-58.5	0	0	0	0	111.3	M243 E244 S251	M243-T247 WeakPolarHBondContact O-CB 3.37Å; M243-T247 PolarHBondContact O-N 3.14Å; M243-T247 PolarHBondContact O-OG1 2.97Å; E244-T247 PolarHBondContact O-N 3.22Å; T247-S251 PolarHBondContact O-N 3.42Å; T247-S251 VanDerWaalsContact O-N 3.1Å
248	L	96.7	Very high	95	Very high	15 Å²	15	46.8 Å²	46.8	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-44.7	175.9	-175.5	62.3	0	0	0	111.8	W210 F222 E244 S245 M246 S251 I252	W210-L248 HydrophobicContact CH2-CD1 3.8Å; W210-L248 HydrophobicContact CH2-CD2 3.55Å; W210-L248 HydrophobicContact CH2-CG 4.03Å; W210-L248 HydrophobicContact CZ3-CD1 3.6Å; W210-L248 HydrophobicContact CZ3-CD2 4.17Å; W210-L248 HydrophobicContact CZ3-CG 4.13Å; F222-L248 HydrophobicContact CE2-CD2 4.28Å; F222-L248 HydrophobicContact CE2-CG 4.02Å; F222-L248 HydrophobicContact CZ-CB 4.16Å; F222-L248 HydrophobicContact CZ-CD2 3.97Å; F222-L248 HydrophobicContact CZ-CG 3.89Å; E244-L248 VanDerWaalsContact O-CB 3.29Å; E244-L248 WeakPolarHBondContact O-CB 3.41Å; E244-L248 PolarHBondContact O-N 3.14Å; S245-L248 PolarHBondContact O-N 2.9Å; M246-L248 PolarHBondContact O-N 3.22Å; L248-S251 WeakPolarHBondContact O-CB 3.28Å; L248-S251 PolarHBondContact O-N 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.45Å; L248-I252 PolarHBondContact O-N 3.43Å
249	F	96.8	Very high	94.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-47.3	177.4	-177.8	-102	0	0	0	111.6	F222 S245 M246 S251 I252 C253 I263 L265 F306 I318	F222-F249 HydrophobicContact CB-CD2 3.98Å; F222-F249 HydrophobicContact CB-CE2 4.04Å; F222-F249 HydrophobicContact CD1-CB 4.33Å; F222-F249 AromaticContact CD1-CD2 3.54Å; F222-F249 HydrophobicContact CD1-CD2 3.54Å; F222-F249 HydrophobicContact CD1-CE2 4.32Å; F222-F249 HydrophobicContact CD1-CG 4.37Å; F222-F249 AromaticContact CD2-CD2 3.89Å; F222-F249 HydrophobicContact CD2-CD2 3.89Å; F222-F249 HydrophobicContact CE1-CB 3.79Å; F222-F249 AromaticContact CE1-CD2 3.9Å; F222-F249 HydrophobicContact CE1-CD2 3.9Å; F222-F249 HydrophobicContact CE1-CG 4.32Å; F222-F249 HydrophobicContact CE2-CB 4.25Å; F222-F249 HydrophobicContact CE2-CD2 4.21Å; F222-F249 AromaticContact CG-CD2 3.53Å; F222-F249 HydrophobicContact CG-CD2 3.53Å; F222-F249 HydrophobicContact CG-CE2 4.11Å; F222-F249 HydrophobicContact CZ-CB 3.74Å; F222-F249 HydrophobicContact CZ-CD2 4.21Å; S245-F249 WeakPolarHBondContact O-CB 3.47Å; S245-F249 PolarHBondContact O-N 3.04Å; M246-F249 WeakPolarHBondContact O-CB 3.5Å; M246-F249 PolarHBondContact O-N 3.44Å; M246-F249 VanDerWaalsContact O-N 3.09Å; F249-S251 VanDerWaalsContact C-N 3.26Å; F249-S251 PolarHBondContact O-N 2.89Å; F249-I252 PolarHBondContact O-N 2.94Å; F249-I252 VanDerWaalsContact O-N 3.09Å; F249-C253 HydrophobicContact CD1-CB 4.33Å; F249-C253 HydrophobicContact CE1-CB 4.03Å; F249-C253 HydrophobicContact CZ-CB 4.3Å; F249-C253 VanDerWaalsContact O-CB 3.22Å; F249-C253 WeakPolarHBondContact O-CB 3.23Å; F249-C253 PolarHBondContact O-N 2.92Å; F249-I263 HydrophobicContact CE2-CG2 3.82Å; F249-I263 HydrophobicContact CZ-CG2 4.16Å; F249-L265 HydrophobicContact CD2-CD1 4.21Å; F249-L265 HydrophobicContact CE2-CD1 3.92Å; F249-L265 HydrophobicContact CZ-CD1 4.47Å; F249-F306 HydrophobicContact CB-CD1 3.72Å; F249-F306 HydrophobicContact CB-CE1 3.74Å; F249-F306 HydrophobicContact CD1-CB 4.4Å; F249-F306 AromaticContact CD1-CD1 3.72Å; F249-F306 HydrophobicContact CD1-CD1 3.72Å; F249-F306 HydrophobicContact CD2-CD1 4.25Å; F249-F306 HydrophobicContact CE1-CB 4.38Å; F249-F306 HydrophobicContact CE1-CD1 4.41Å; F249-F306 WeakPolarHBondContact CE1-O 3.47Å; F249-F306 AromaticContact CG-CD1 3.62Å; F249-F306 HydrophobicContact CG-CD1 3.62Å; F249-F306 HydrophobicContact CG-CE1 4.15Å; F249-I318 HydrophobicContact CE1-CD1 4.19Å; F249-I318 HydrophobicContact CZ-CD1 4.01Å; F249-I318 HydrophobicContact CZ-CG1 4.5Å; F249-I318 HydrophobicContact CZ-CG2 4.26Å
250	T	95.3	Very high	94.1	Very high	49 Å²	49	47.4 Å²	47.4	30%	0.301	24%	0.243	S	C	.	.	H	α-helix	trans	-56.6	-41.6	176.5	-57.7	0	0	0	0	111.3	M246 N254	M246-T250 PolarHBondContact O-N 3.1Å; M246-T250 PolarHBondContact O-OG1 3.05Å; M246-T250 VanDerWaalsContact O-OG1 3.07Å; T250-N254 WeakPolarHBondContact O-CB 3.3Å; T250-N254 PolarHBondContact O-N 3.25Å; T250-N254 VanDerWaalsContact O-N 3.16Å; T250-N254 PolarHBondContact O-ND2 3.47Å
251	S	94.5	Very high	93.7	Very high	72 Å²	72	47 Å²	47	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-42.3	176.3	-178.6	0	0	0	0	112.7	T247 L248 F249 N255	T247-S251 PolarHBondContact O-N 3.42Å; T247-S251 VanDerWaalsContact O-N 3.1Å; L248-S251 WeakPolarHBondContact O-CB 3.28Å; L248-S251 PolarHBondContact O-N 3.3Å; F249-S251 VanDerWaalsContact C-N 3.26Å; F249-S251 PolarHBondContact O-N 2.89Å; S251-N255 WeakPolarHBondContact O-CB 3.35Å; S251-N255 PolarHBondContact O-N 3.3Å
252	I	94	Very high	93.3	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-73.2	-46.2	179	-65.8	-56.1	0	0	0	111.6	L39 W210 F214 I220 F222 L248 F249 N254 N255 F258	L39-I252 HydrophobicContact CD1-CD1 3.81Å; L39-I252 HydrophobicContact CD1-CG1 4.02Å; L39-I252 HydrophobicContact CD1-CG2 3.76Å; W210-I252 HydrophobicContact CE3-CD1 4.13Å; W210-I252 HydrophobicContact CZ3-CD1 4.02Å; W210-I252 HydrophobicContact CZ3-CG1 4.27Å; F214-I252 HydrophobicContact CZ-CD1 4.09Å; I220-I252 HydrophobicContact CD1-CG2 3.89Å; I220-I252 HydrophobicContact CG2-CG2 4.45Å; F222-I252 HydrophobicContact CD2-CB 4.48Å; F222-I252 HydrophobicContact CD2-CG1 4.48Å; F222-I252 HydrophobicContact CD2-CG2 4.42Å; F222-I252 HydrophobicContact CE2-CB 4.4Å; F222-I252 HydrophobicContact CE2-CG1 4.09Å; L248-I252 WeakPolarHBondContact O-CG1 3.45Å; L248-I252 PolarHBondContact O-N 3.43Å; F249-I252 PolarHBondContact O-N 2.94Å; F249-I252 VanDerWaalsContact O-N 3.09Å; I252-N254 PolarHBondContact O-N 2.89Å; I252-N255 WeakPolarHBondContact O-CB 3.41Å; I252-N255 PolarHBondContact O-N 3.27Å; I252-N255 VanDerWaalsContact O-N 3.13Å; I252-F258 HydrophobicContact CD1-CE2 4.23Å; I252-F258 HydrophobicContact CG2-CD2 4.01Å; I252-F258 HydrophobicContact CG2-CE2 4.1Å
253	C	92.8	Very high	93.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.3	-40.5	-178.4	-172.3	0	0	0	0	111.5	F249 I263 K316	F249-C253 HydrophobicContact CD1-CB 4.33Å; F249-C253 HydrophobicContact CE1-CB 4.03Å; F249-C253 HydrophobicContact CZ-CB 4.3Å; F249-C253 VanDerWaalsContact O-CB 3.22Å; F249-C253 WeakPolarHBondContact O-CB 3.23Å; F249-C253 PolarHBondContact O-N 2.92Å; C253-I263 HydrophobicContact CB-CD1 4.2Å; C253-K316 PolarHBondContact O-NZ 2.68Å
254	N	91.8	Very high	92.9	Very high	36 Å²	36	44 Å²	44	19%	0.193	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	5.7	-177.9	-59.7	-67.1	0	0	0	113.6	T250 I252 S309 T311	T250-N254 WeakPolarHBondContact O-CB 3.3Å; T250-N254 PolarHBondContact O-N 3.25Å; T250-N254 VanDerWaalsContact O-N 3.16Å; T250-N254 PolarHBondContact O-ND2 3.47Å; I252-N254 PolarHBondContact O-N 2.89Å; N254-S309 PolarHBondContact ND2-O 3.27Å; N254-T311 PolarHBondContact OD1-N 3.13Å; N254-T311 PolarHBondContact OD1-OG1 2.94Å
255	N	91.2	Very high	92.9	Very high	38 Å²	38	43.5 Å²	43.5	20%	0.203	23%	0.227	C	C	.	.			trans	-68	137.4	-179.7	-160.7	-54.4	0	0	0	111.8	S251 I252 W257 F258	S251-N255 WeakPolarHBondContact O-CB 3.35Å; S251-N255 PolarHBondContact O-N 3.3Å; I252-N255 WeakPolarHBondContact O-CB 3.41Å; I252-N255 PolarHBondContact O-N 3.27Å; I252-N255 VanDerWaalsContact O-N 3.13Å; N255-W257 VanDerWaalsContact C-N 3.26Å; N255-W257 PolarHBondContact O-N 3.17Å; N255-W257 VanDerWaalsContact OD1-CD1 3.31Å; N255-W257 PolarHBondContact OD1-N 2.83Å; N255-F258 HydrophobicContact CB-CD2 3.81Å; N255-F258 HydrophobicContact CB-CE2 4.48Å; N255-F258 PolarHBondContact O-N 3.25Å
256	Q	90.9	Very high	92.9	Very high	151 Å²	151	43.3 Å²	43.3	71%	0.706	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-60.4	-32.5	178.5	69.3	-176.2	12.8	0	0	113.7	F258 T259	Q256-F258 PolarHBondContact O-N 3.43Å; Q256-T259 PolarHBondContact O-N 3.26Å; Q256-T259 PolarHBondContact O-OG1 2.96Å
257	W	90.9	Very high	93	Very high	133 Å²	133	42 Å²	42	50%	0.504	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-63.3	-21.3	177.1	-75.1	96.8	0	0	0	112.9	I211 F214 N255	I211-W257 HydrophobicContact CD1-CZ2 4.33Å; F214-W257 HydrophobicContact CB-CB 4.3Å; F214-W257 HydrophobicContact CB-CD2 4.18Å; F214-W257 HydrophobicContact CB-CE3 4.22Å; F214-W257 HydrophobicContact CB-CG 4.23Å; F214-W257 HydrophobicContact CD2-CB 3.89Å; F214-W257 AromaticContact CD2-CD1 3.92Å; F214-W257 AromaticContact CD2-CG 3.84Å; F214-W257 HydrophobicContact CD2-CG 3.84Å; N255-W257 VanDerWaalsContact C-N 3.26Å; N255-W257 PolarHBondContact O-N 3.17Å; N255-W257 VanDerWaalsContact OD1-CD1 3.31Å; N255-W257 PolarHBondContact OD1-N 2.83Å
258	F	90.7	Very high	93.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-119.3	30.3	-172.5	-54.6	-45.8	0	0	0	112.2	L37 L39 F214 V217 I220 I252 N255 Q256 E260 T261 K316	L37-F258 HydrophobicContact CD2-CE1 4.43Å; L37-F258 HydrophobicContact CD2-CZ 3.97Å; L39-F258 HydrophobicContact CD1-CE2 4.35Å; F214-F258 HydrophobicContact CB-CE1 4.19Å; F214-F258 HydrophobicContact CB-CZ 4.13Å; F214-F258 HydrophobicContact CD1-CE1 4.17Å; F214-F258 HydrophobicContact CD1-CE2 4.18Å; F214-F258 AromaticContact CD1-CZ 3.36Å; F214-F258 HydrophobicContact CD1-CZ 3.36Å; F214-F258 HydrophobicContact CD2-CE1 4.33Å; F214-F258 AromaticContact CD2-CE2 3.92Å; F214-F258 HydrophobicContact CD2-CE2 3.92Å; F214-F258 AromaticContact CD2-CZ 3.62Å; F214-F258 HydrophobicContact CD2-CZ 3.62Å; F214-F258 AromaticContact CE1-CE2 3.88Å; F214-F258 HydrophobicContact CE1-CE2 3.88Å; F214-F258 AromaticContact CE1-CZ 3.47Å; F214-F258 HydrophobicContact CE1-CZ 3.47Å; F214-F258 VanDerWaalsContact CE1-CZ 3.47Å; F214-F258 AromaticContact CE2-CE2 3.62Å; F214-F258 HydrophobicContact CE2-CE2 3.62Å; F214-F258 AromaticContact CE2-CZ 3.74Å; F214-F258 HydrophobicContact CE2-CZ 3.74Å; F214-F258 AromaticContact CG-CE1 3.99Å; F214-F258 HydrophobicContact CG-CE1 3.99Å; F214-F258 HydrophobicContact CG-CE2 4.19Å; F214-F258 AromaticContact CG-CZ 3.43Å; F214-F258 HydrophobicContact CG-CZ 3.43Å; F214-F258 VanDerWaalsContact CG-CZ 3.43Å; F214-F258 AromaticContact CZ-CE2 3.59Å; F214-F258 HydrophobicContact CZ-CE2 3.59Å; F214-F258 AromaticContact CZ-CZ 3.66Å; F214-F258 HydrophobicContact CZ-CZ 3.66Å; V217-F258 HydrophobicContact CB-CE1 4.28Å; V217-F258 HydrophobicContact CG2-CE1 4.18Å; I220-F258 HydrophobicContact CD1-CB 3.99Å; I220-F258 HydrophobicContact CD1-CD1 3.62Å; I220-F258 HydrophobicContact CD1-CD2 3.47Å; I220-F258 VanDerWaalsContact CD1-CD2 3.47Å; I220-F258 HydrophobicContact CD1-CE1 3.81Å; I220-F258 HydrophobicContact CD1-CE2 3.67Å; I220-F258 HydrophobicContact CD1-CG 3.42Å; I220-F258 VanDerWaalsContact CD1-CG 3.42Å; I220-F258 HydrophobicContact CD1-CZ 3.79Å; I220-F258 HydrophobicContact CG1-CD1 4.46Å; I220-F258 HydrophobicContact CG1-CE1 4.41Å; I252-F258 HydrophobicContact CD1-CE2 4.23Å; I252-F258 HydrophobicContact CG2-CD2 4.01Å; I252-F258 HydrophobicContact CG2-CE2 4.1Å; N255-F258 HydrophobicContact CB-CD2 3.81Å; N255-F258 HydrophobicContact CB-CE2 4.48Å; N255-F258 PolarHBondContact O-N 3.25Å; Q256-F258 PolarHBondContact O-N 3.43Å; F258-E260 VanDerWaalsContact C-N 3.33Å; F258-E260 PolarHBondContact O-N 3.25Å; F258-T261 HydrophobicContact CD1-CG2 4.41Å; F258-K316 PolarHBondContact O-NZ 2.99Å
259	T	87.2	Confident	93.2	Very high	65 Å²	65	38 Å²	38	40%	0.399	19%	0.194	S	C	.	.	S	Bend	trans	-61.8	-43.5	-177.7	-57.8	0	0	0	0	111.5	Q256 R312	Q256-T259 PolarHBondContact O-N 3.26Å; Q256-T259 PolarHBondContact O-OG1 2.96Å; T259-R312 VanDerWaalsContact CG2-NH2 3.33Å; T259-R312 PolarHBondContact OG1-NH1 3.23Å; T259-R312 PolarHBondContact OG1-NH2 3.33Å
260	E	84.1	Confident	93.2	Very high	190 Å²	190	42.1 Å²	42.1	89%	0.888	21%	0.209	S	C	*	.	S	Bend	trans	-103.2	-1.7	-178.1	-62.8	175.7	177.4	0	0	112.3	F258	F258-E260 VanDerWaalsContact C-N 3.33Å; F258-E260 PolarHBondContact O-N 3.25Å
261	T	88.7	Confident	93.3	Very high	16 Å²	16	41.8 Å²	41.8	10%	0.098	21%	0.206	C	C	.	.			trans	-79.7	125	-178	-51.2	0	0	0	0	111	V217 I220 F258 K316	V217-T261 HydrophobicContact CB-CG2 4.41Å; V217-T261 HydrophobicContact CG1-CG2 3.84Å; I220-T261 HydrophobicContact CD1-CG2 4.16Å; I220-T261 HydrophobicContact CG1-CG2 3.91Å; F258-T261 HydrophobicContact CD1-CG2 4.41Å; T261-K316 VanDerWaalsContact O-CE 3.23Å; T261-K316 WeakPolarHBondContact O-CE 3.37Å
262	S	88.6	Confident	93.4	Very high	21 Å²	21	40.2 Å²	40.2	15%	0.147	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	140.3	173.1	-65.1	0	0	0	0	111	A219 I220 N345	A219-S262 WeakPolarHBondContact CA-O 3.29Å; I220-S262 PolarHBondContact N-O 3.41Å; S262-N345 PolarHBondContact OG-ND2 3.48Å; S262-N345 VanDerWaalsContact OG-ND2 3.16Å
263	I	93.1	Very high	93.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.1	176.6	-66.4	-174.5	0	0	0	109.8	I220 F249 C253 K316 D317 I318 Y319	I220-I263 HydrophobicContact CB-CG1 4.28Å; I220-I263 HydrophobicContact CD1-CG1 4.4Å; F249-I263 HydrophobicContact CE2-CG2 3.82Å; F249-I263 HydrophobicContact CZ-CG2 4.16Å; C253-I263 HydrophobicContact CB-CD1 4.2Å; I263-K316 HydrophobicContact CD1-CD 4.4Å; I263-K316 VanDerWaalsContact CG1-CE 3.49Å; I263-D317 PolarHBondContact N-O 3.39Å; I263-I318 WeakPolarHBondContact O-CA 3.47Å; I263-Y319 PolarHBondContact O-N 2.88Å
264	V	94.9	Very high	93.9	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.3	170.9	-178.9	0	0	0	0	107.1	I220 I221 F222 F266 Y319 V338	I220-V264 PolarHBondContact O-N 2.66Å; I221-V264 CarbonylContact C-O 3.56Å; I221-V264 WeakPolarHBondContact CA-O 2.99Å; I221-V264 HydrophobicContact CG1-CB 4.21Å; F222-V264 PolarHBondContact N-O 3.37Å; V264-F266 HydrophobicContact CG1-CD1 3.71Å; V264-F266 HydrophobicContact CG1-CE1 3.39Å; V264-F266 HydrophobicContact CG1-CZ 4.42Å; V264-Y319 CarbonylContact C-O 3.43Å; V264-Y319 WeakPolarHBondContact CA-O 3.49Å; V264-V338 HydrophobicContact CB-CG1 4.36Å; V264-V338 HydrophobicContact CB-CG2 4.46Å; V264-V338 HydrophobicContact CG1-CB 4.42Å; V264-V338 HydrophobicContact CG1-CG1 4.09Å; V264-V338 HydrophobicContact CG1-CG2 3.44Å; V264-V338 VanDerWaalsContact CG1-CG2 3.44Å; V264-V338 HydrophobicContact CG2-CB 4.49Å; V264-V338 HydrophobicContact CG2-CG1 3.56Å; V264-V338 HydrophobicContact CG2-CG2 4.18Å
265	L	96.8	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.9	-178.5	177.4	67.6	0	0	0	109.8	F222 V224 F249 L267 F306 I318 Y319 S320 H321	F222-L265 HydrophobicContact CD1-CD1 4.2Å; V224-L265 HydrophobicContact CG2-CD1 3.66Å; F249-L265 HydrophobicContact CD2-CD1 4.21Å; F249-L265 HydrophobicContact CE2-CD1 3.92Å; F249-L265 HydrophobicContact CZ-CD1 4.47Å; L265-L267 HydrophobicContact CD1-CD2 4.48Å; L265-L267 HydrophobicContact CD2-CD1 4.5Å; L265-L267 HydrophobicContact CD2-CD2 4.08Å; L265-L267 HydrophobicContact CD2-CG 4.23Å; L265-L267 HydrophobicContact CG-CD2 4.17Å; L265-L267 HydrophobicContact CG-CG 4.17Å; L265-F306 HydrophobicContact CD1-CB 4.46Å; L265-F306 HydrophobicContact CD1-CD1 4.21Å; L265-F306 HydrophobicContact CD1-CG 4.43Å; L265-F306 HydrophobicContact CD2-CB 3.46Å; L265-F306 VanDerWaalsContact CD2-CB 3.46Å; L265-F306 HydrophobicContact CD2-CG 4.16Å; L265-I318 HydrophobicContact CB-CG2 3.92Å; L265-I318 HydrophobicContact CD2-CG2 4.36Å; L265-Y319 PolarHBondContact N-O 2.97Å; L265-S320 CarbonylContact O-C 3.53Å; L265-S320 WeakPolarHBondContact O-CA 3.01Å; L265-H321 PolarHBondContact O-N 3.15Å
266	F	98.4	Very high	94.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	106	172.6	-79.3	13.5	0	0	0	109.7	I49 I221 F222 V223 V224 V264 N268 H321 T323 I331 V334 V338	I49-F266 HydrophobicContact CD1-CD2 3.6Å; I49-F266 HydrophobicContact CD1-CE2 4.06Å; I49-F266 HydrophobicContact CG1-CD2 4.37Å; I49-F266 HydrophobicContact CG1-CE2 4.47Å; I49-F266 HydrophobicContact CG2-CE2 4.5Å; I221-F266 HydrophobicContact CG2-CB 4.46Å; I221-F266 HydrophobicContact CG2-CD1 4.02Å; I221-F266 HydrophobicContact CG2-CD2 3.72Å; I221-F266 HydrophobicContact CG2-CE1 4.15Å; I221-F266 HydrophobicContact CG2-CE2 3.84Å; I221-F266 HydrophobicContact CG2-CG 3.8Å; I221-F266 HydrophobicContact CG2-CZ 4.05Å; F222-F266 PolarHBondContact O-N 3.17Å; V223-F266 HydrophobicContact CG1-CB 4.31Å; V223-F266 HydrophobicContact CG2-CB 4.35Å; V224-F266 PolarHBondContact N-O 3.27Å; V264-F266 HydrophobicContact CG1-CD1 3.71Å; V264-F266 HydrophobicContact CG1-CE1 3.39Å; V264-F266 HydrophobicContact CG1-CZ 4.42Å; F266-N268 PolarHBondContact O-N 3.2Å; F266-H321 HydrophobicContact CD1-CB 4.5Å; F266-T323 HydrophobicContact CB-CG2 4.36Å; F266-T323 HydrophobicContact CD1-CG2 4.17Å; F266-T323 HydrophobicContact CD2-CG2 4.02Å; F266-T323 HydrophobicContact CE1-CG2 4.49Å; F266-T323 HydrophobicContact CE2-CG2 4.37Å; F266-T323 HydrophobicContact CG-CG2 3.93Å; F266-I331 HydrophobicContact CE2-CD1 4.48Å; F266-V334 HydrophobicContact CD1-CG1 4.21Å; F266-V334 HydrophobicContact CE1-CG1 3.39Å; F266-V334 HydrophobicContact CZ-CG1 3.6Å; F266-V338 HydrophobicContact CE1-CG2 4.17Å
267	L	98.6	Very high	94.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	84.4	170.1	-63.7	170.6	0	0	0	107.5	V224 M226 L265 I302 R303 F306 H321 F322 T323	V224-L267 HydrophobicContact CB-CD2 4.13Å; V224-L267 HydrophobicContact CG1-CD2 4.33Å; V224-L267 HydrophobicContact CG2-CD2 4.37Å; M226-L267 HydrophobicContact CG-CB 3.99Å; M226-L267 HydrophobicContact SD-CB 3.72Å; L265-L267 HydrophobicContact CD1-CD2 4.48Å; L265-L267 HydrophobicContact CD2-CD1 4.5Å; L265-L267 HydrophobicContact CD2-CD2 4.08Å; L265-L267 HydrophobicContact CD2-CG 4.23Å; L265-L267 HydrophobicContact CG-CD2 4.17Å; L265-L267 HydrophobicContact CG-CG 4.17Å; L267-I302 HydrophobicContact CD2-CG2 4.21Å; L267-R303 HydrophobicContact CD1-CB 3.55Å; L267-R303 HydrophobicContact CD1-CG 3.86Å; L267-F306 HydrophobicContact CD2-CD2 4.32Å; L267-H321 PolarHBondContact N-O 3.38Å; L267-F322 HydrophobicContact CB-CD1 3.58Å; L267-F322 HydrophobicContact CB-CE1 4.01Å; L267-F322 HydrophobicContact CD1-CD1 3.78Å; L267-F322 HydrophobicContact CD1-CE1 3.41Å; L267-F322 VanDerWaalsContact CD1-CE1 3.41Å; L267-F322 HydrophobicContact CD1-CZ 4.26Å; L267-F322 HydrophobicContact CG-CD1 4.34Å; L267-F322 HydrophobicContact CG-CE1 4.34Å; L267-F322 CarbonylContact O-C 3.55Å; L267-F322 WeakPolarHBondContact O-CA 3.4Å; L267-T323 PolarHBondContact O-N 3.37Å
268	N	98.6	Very high	94.9	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	168.2	-167.7	-171.2	35.9	0	0	0	113.1	S44 V223 V224 M226 F266 R270 T323 A325	S44-N268 PolarHBondContact O-ND2 3.35Å; V223-N268 HydrophobicContact CG1-CB 3.78Å; V224-N268 WeakPolarHBondContact O-CA 3.39Å; V224-N268 WeakPolarHBondContact O-CB 3.44Å; V224-N268 PolarHBondContact O-N 2.86Å; M226-N268 WeakPolarHBondContact CB-O 3.44Å; M226-N268 WeakPolarHBondContact CG-O 3.13Å; M226-N268 PolarHBondContact N-O 2.65Å; F266-N268 PolarHBondContact O-N 3.2Å; N268-R270 PolarHBondContact O-N 3.07Å; N268-T323 CarbonylContact C-O 3.28Å; N268-T323 VanDerWaalsContact CA-O 3.3Å; N268-T323 WeakPolarHBondContact CA-O 3.21Å; N268-T323 WeakPolarHBondContact CA-OG1 3.19Å; N268-T323 WeakPolarHBondContact CB-OG1 3.33Å; N268-T323 PolarHBondContact OD1-O 3.33Å; N268-T323 PolarHBondContact OD1-OG1 3.18Å; N268-A325 WeakPolarHBondContact OD1-CB 3.25Å; N268-A325 PolarHBondContact OD1-N 3.2Å
269	K	98.1	Very high	95.1	Very high	18 Å²	18	47.6 Å²	47.6	8%	0.078	23%	0.23	C	C	.	.			trans	60.2	35	-176.8	-49.4	-177.1	-174.4	177.8	0	112	E43 D149 A225 S227 E228 D271 I272 F273 T323	E43-K269 WeakPolarHBondContact O-CE 3.39Å; E43-K269 PolarHBondContact O-NZ 3.24Å; D149-K269 VanDerWaalsContact OD2-CD 3.3Å; D149-K269 WeakPolarHBondContact OD2-CD 3.37Å; D149-K269 WeakPolarHBondContact OD2-CE 3.35Å; D149-K269 IonicContact OD2-NZ 3.98Å; D149-K269 PolarHBondContact OD2-NZ 3.21Å; A225-K269 HydrophobicContact CB-CD 3.75Å; A225-K269 HydrophobicContact CB-CG 4.4Å; S227-K269 VanDerWaalsContact OG-CD 3.28Å; S227-K269 WeakPolarHBondContact OG-CD 3.3Å; E228-K269 IonicContact OE1-NZ 3.64Å; E228-K269 PolarHBondContact OE1-NZ 2.86Å; K269-D271 WeakPolarHBondContact CA-OD1 3.36Å; K269-D271 PolarHBondContact O-N 3.15Å; K269-I272 HydrophobicContact CB-CB 4.49Å; K269-I272 HydrophobicContact CB-CD1 4.42Å; K269-I272 PolarHBondContact O-N 2.9Å; K269-F273 PolarHBondContact O-N 3.43Å; K269-T323 PolarHBondContact N-O 3.36Å; K269-T323 VanDerWaalsContact N-O 3.1Å
270	R	98	Very high	95.5	Very high	85 Å²	85	44.8 Å²	44.8	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-58.2	-33.9	-180	75.9	179.4	-173	168.1	3.6	112.2	M226 N268 F273 E274 Y295 T323 C324	M226-R270 HydrophobicContact SD-CB 4.37Å; N268-R270 PolarHBondContact O-N 3.07Å; R270-F273 PolarHBondContact O-N 3.05Å; R270-E274 VanDerWaalsContact O-CB 3.29Å; R270-E274 WeakPolarHBondContact O-CB 3.29Å; R270-E274 PolarHBondContact O-N 3.12Å; R270-Y295 HydrophobicContact CB-CE2 4.04Å; R270-T323 WeakPolarHBondContact CG-O 3.37Å; R270-T323 PolarHBondContact N-O 3.4Å; R270-C324 HydrophobicContact CG-CB 4.44Å
271	D	97.1	Very high	96.1	Very high	43 Å²	43	37.8 Å²	37.8	23%	0.23	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-42.8	177.7	57.7	-48.1	0	0	0	112	R175 K269 N275 C324	R175-D271 IonicContact NH2-OD2 3.61Å; K269-D271 WeakPolarHBondContact CA-OD1 3.36Å; K269-D271 PolarHBondContact O-N 3.15Å; D271-N275 PolarHBondContact O-ND2 3.14Å; D271-C324 PolarHBondContact OD1-SG 2.8Å
272	I	97.4	Very high	96.5	Very high	39 Å²	39	37 Å²	37	20%	0.2	18%	0.18	C	C	.	.	H	α-helix	trans	-73.9	-41.3	177.4	-55	179.2	0	0	0	109.6	D149 K269 N275 K276	D149-I272 HydrophobicContact CB-CD1 3.6Å; K269-I272 HydrophobicContact CB-CB 4.49Å; K269-I272 HydrophobicContact CB-CD1 4.42Å; K269-I272 PolarHBondContact O-N 2.9Å; I272-N275 PolarHBondContact O-N 3.48Å; I272-K276 VanDerWaalsContact O-CB 3.3Å; I272-K276 WeakPolarHBondContact O-CB 3.39Å; I272-K276 PolarHBondContact O-N 3.11Å
273	F	98.3	Very high	97	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-47.1	178	176	-103.8	0	0	0	112.4	M226 Y229 K269 R270 N275 K276 I277 Y295 A298 I302	M226-F273 HydrophobicContact CB-CB 3.73Å; M226-F273 HydrophobicContact CB-CD1 4.42Å; M226-F273 HydrophobicContact CB-CD2 4.01Å; M226-F273 HydrophobicContact CB-CG 3.79Å; M226-F273 HydrophobicContact CE-CD1 3.59Å; M226-F273 HydrophobicContact CE-CE1 3.67Å; M226-F273 HydrophobicContact CE-CG 4.1Å; M226-F273 HydrophobicContact CE-CZ 4.22Å; M226-F273 WeakPolarHBondContact O-CD2 3.33Å; M226-F273 HydrophobicContact SD-CD1 4.48Å; Y229-F273 AromaticContact CD1-CD2 3.72Å; Y229-F273 HydrophobicContact CD1-CD2 3.72Å; Y229-F273 AromaticContact CD1-CE2 3.73Å; Y229-F273 HydrophobicContact CD1-CE2 3.73Å; Y229-F273 AromaticContact CE1-CD2 3.68Å; Y229-F273 HydrophobicContact CE1-CD2 3.68Å; Y229-F273 AromaticContact CE1-CE2 3.75Å; Y229-F273 HydrophobicContact CE1-CE2 3.75Å; Y229-F273 HydrophobicContact CG-CE2 4.45Å; K269-F273 PolarHBondContact O-N 3.43Å; R270-F273 PolarHBondContact O-N 3.05Å; F273-N275 VanDerWaalsContact C-N 3.27Å; F273-N275 PolarHBondContact O-N 3.07Å; F273-K276 PolarHBondContact O-N 3.05Å; F273-I277 HydrophobicContact CE2-CB 4.33Å; F273-I277 HydrophobicContact CE2-CD1 4.27Å; F273-I277 HydrophobicContact CZ-CB 4.22Å; F273-I277 HydrophobicContact CZ-CD1 4.21Å; F273-I277 HydrophobicContact CZ-CG1 4.19Å; F273-I277 WeakPolarHBondContact O-CB 3.34Å; F273-I277 WeakPolarHBondContact O-CG2 3.48Å; F273-I277 PolarHBondContact O-N 3.12Å; F273-Y295 AromaticContact CD1-CD2 3.68Å; F273-Y295 HydrophobicContact CD1-CD2 3.68Å; F273-Y295 AromaticContact CD1-CE2 3.92Å; F273-Y295 HydrophobicContact CD1-CE2 3.92Å; F273-Y295 HydrophobicContact CE1-CD2 4.03Å; F273-Y295 HydrophobicContact CE1-CE2 4.46Å; F273-A298 HydrophobicContact CE1-CB 4.19Å; F273-A298 HydrophobicContact CZ-CB 3.69Å; F273-I302 HydrophobicContact CD2-CD1 4.49Å; F273-I302 HydrophobicContact CE2-CD1 3.64Å; F273-I302 HydrophobicContact CZ-CD1 3.65Å
274	E	98	Very high	97.1	Very high	91 Å²	91	42.4 Å²	42.4	43%	0.425	21%	0.208	S	C	.	.	H	α-helix	trans	-54.7	-41.2	177.7	-179.4	170.9	-145.9	0	0	112.4	R270 I277 Y295	R270-E274 VanDerWaalsContact O-CB 3.29Å; R270-E274 WeakPolarHBondContact O-CB 3.29Å; R270-E274 PolarHBondContact O-N 3.12Å; E274-I277 WeakPolarHBondContact O-CG2 3.31Å; E274-Y295 HydrophobicContact CB-CD2 3.64Å; E274-Y295 HydrophobicContact CB-CE2 4.27Å; E274-Y295 HydrophobicContact CB-CG 4.18Å; E274-Y295 HydrophobicContact CG-CD2 4.12Å; E274-Y295 HydrophobicContact CG-CG 4.14Å
275	N	95.9	Very high	97.2	Very high	97 Å²	97	42.8 Å²	42.8	52%	0.519	21%	0.211	S	C	.	.	H	α-helix	trans	-74.4	-36.1	176.3	-72.8	-67	0	0	0	113.1	D271 I272 F273	D271-N275 PolarHBondContact O-ND2 3.14Å; I272-N275 PolarHBondContact O-N 3.48Å; F273-N275 VanDerWaalsContact C-N 3.27Å; F273-N275 PolarHBondContact O-N 3.07Å
276	K	96.5	Very high	97.2	Very high	38 Å²	38	43.5 Å²	43.5	17%	0.165	21%	0.214	C	C	.	.	H	α-helix	trans	-76.5	-39.2	-174	-160	-179.9	-150.4	-178.2	0	112.5	S227 Y229 D230 I272 F273 M278 K279 S280	S227-K276 WeakPolarHBondContact O-CD 3.28Å; S227-K276 PolarHBondContact O-NZ 3.31Å; Y229-K276 HydrophobicContact CE1-CB 4.34Å; Y229-K276 HydrophobicContact CE1-CD 3.9Å; Y229-K276 HydrophobicContact CE1-CG 4.21Å; Y229-K276 PolarHBondContact OH-O 3.45Å; D230-K276 VanDerWaalsContact CG-CE 3.49Å; D230-K276 WeakPolarHBondContact OD1-CD 3.32Å; D230-K276 WeakPolarHBondContact OD1-CE 3.46Å; D230-K276 IonicContact OD1-NZ 2.76Å; D230-K276 PolarHBondContact OD1-NZ 3.01Å; D230-K276 WeakPolarHBondContact OD2-CE 3.26Å; D230-K276 IonicContact OD2-NZ 3.64Å; I272-K276 VanDerWaalsContact O-CB 3.3Å; I272-K276 WeakPolarHBondContact O-CB 3.39Å; I272-K276 PolarHBondContact O-N 3.11Å; F273-K276 PolarHBondContact O-N 3.05Å; K276-M278 PolarHBondContact O-N 3.09Å; K276-K279 PolarHBondContact O-N 2.99Å; K276-S280 PolarHBondContact O-N 3.48Å
277	I	97.7	Very high	97.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-32.8	-175.8	-168.9	61.5	0	0	0	112.5	Y229 F273 E274 K279 L282 N293 A298	Y229-I277 HydrophobicContact CE2-CD1 4.4Å; Y229-I277 WeakPolarHBondContact OH-CA 3.35Å; Y229-I277 PolarHBondContact OH-N 2.92Å; F273-I277 HydrophobicContact CE2-CB 4.33Å; F273-I277 HydrophobicContact CE2-CD1 4.27Å; F273-I277 HydrophobicContact CZ-CB 4.22Å; F273-I277 HydrophobicContact CZ-CD1 4.21Å; F273-I277 HydrophobicContact CZ-CG1 4.19Å; F273-I277 WeakPolarHBondContact O-CB 3.34Å; F273-I277 WeakPolarHBondContact O-CG2 3.48Å; F273-I277 PolarHBondContact O-N 3.12Å; E274-I277 WeakPolarHBondContact O-CG2 3.31Å; I277-K279 PolarHBondContact O-N 3.36Å; I277-K279 VanDerWaalsContact O-N 3.16Å; I277-L282 HydrophobicContact CD1-CB 3.87Å; I277-N293 HydrophobicContact CG1-CB 4.49Å; I277-A298 HydrophobicContact CD1-CB 3.9Å; I277-A298 HydrophobicContact CG1-CB 3.8Å
278	M	96.1	Very high	97	Very high	123 Å²	123	56.5 Å²	56.5	61%	0.606	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.2	175.7	-64.3	-172.6	-78	0	0	114	K276	K276-M278 PolarHBondContact O-N 3.09Å
279	K	94.5	Very high	97	Very high	168 Å²	168	57 Å²	57	73%	0.73	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-19.4	-172.8	-58.9	178.3	-174.9	176.1	0	113.5	K276 I277	K276-K279 PolarHBondContact O-N 2.99Å; I277-K279 PolarHBondContact O-N 3.36Å; I277-K279 VanDerWaalsContact O-N 3.16Å
280	S	95.8	Very high	96.9	Very high	6 Å²	6	63 Å²	63	4%	0.042	32%	0.324	C	S	.	.	S	Bend	trans	-135	113.5	-175.1	-168.8	0	0	0	0	108.5	R143 Y229 D230 K276 I284	R143-S280 PolarHBondContact NH1-OG 3.33Å; R143-S280 VanDerWaalsContact NH1-OG 3.14Å; Y229-S280 WeakPolarHBondContact CE2-O 3.46Å; Y229-S280 WeakPolarHBondContact OH-CB 3.49Å; Y229-S280 PolarHBondContact OH-O 3.16Å; D230-S280 VanDerWaalsContact OD2-CB 3.26Å; D230-S280 WeakPolarHBondContact OD2-CB 3.3Å; D230-S280 PolarHBondContact OD2-OG 3.3Å; K276-S280 PolarHBondContact O-N 3.48Å; S280-I284 WeakPolarHBondContact OG-CD1 3.2Å
281	P	96.7	Very high	96.9	Very high	42 Å²	42	60.2 Å²	60.2	27%	0.273	32%	0.322	S	S	.	.			trans	-69.7	145.2	-169.7	28	-35.5	0	0	0	112.5	T283 I284 N293	P281-T283 PolarHBondContact O-N 3.43Å; P281-T283 VanDerWaalsContact O-N 3.15Å; P281-I284 HydrophobicContact CG-CD1 4.21Å; P281-I284 HydrophobicContact CG-CG1 4.22Å; P281-I284 WeakPolarHBondContact O-CG1 3.35Å; P281-I284 PolarHBondContact O-N 3.01Å; P281-N293 WeakPolarHBondContact CA-OD1 3.29Å
282	L	98	Very high	96.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.2	-24.4	179.3	-171.6	61.3	0	0	0	112.6	Y229 I277 I284 C285 F286 Y289 N293 A298 Y301 I302	Y229-L282 HydrophobicContact CD2-CD1 3.96Å; Y229-L282 HydrophobicContact CG-CD1 4.16Å; I277-L282 HydrophobicContact CD1-CB 3.87Å; L282-I284 PolarHBondContact O-N 3.44Å; L282-C285 PolarHBondContact O-N 2.6Å; L282-F286 HydrophobicContact CD1-CD2 3.64Å; L282-F286 HydrophobicContact CD1-CE2 3.98Å; L282-F286 HydrophobicContact CD2-CD2 4.22Å; L282-F286 HydrophobicContact CG-CD2 3.73Å; L282-F286 HydrophobicContact CG-CE2 4.49Å; L282-F286 PolarHBondContact O-N 3.08Å; L282-Y289 HydrophobicContact CB-CD1 3.72Å; L282-Y289 HydrophobicContact CB-CE1 3.94Å; L282-Y289 HydrophobicContact CB-CG 4.35Å; L282-Y289 HydrophobicContact CD2-CD1 3.84Å; L282-Y289 HydrophobicContact CD2-CD2 3.89Å; L282-Y289 HydrophobicContact CD2-CE1 3.91Å; L282-Y289 HydrophobicContact CD2-CE2 3.98Å; L282-Y289 HydrophobicContact CD2-CG 3.8Å; L282-Y289 HydrophobicContact CG-CD1 4.17Å; L282-Y289 HydrophobicContact CG-CE1 4.49Å; L282-Y289 HydrophobicContact CG-CG 4.33Å; L282-N293 PolarHBondContact N-OD1 2.88Å; L282-A298 HydrophobicContact CD2-CB 3.97Å; L282-Y301 HydrophobicContact CD2-CD1 3.79Å; L282-Y301 HydrophobicContact CD2-CG 4.41Å; L282-I302 HydrophobicContact CD1-CD1 3.91Å; L282-I302 HydrophobicContact CD1-CG1 4.15Å; L282-I302 HydrophobicContact CD2-CG1 4.41Å
283	T	97.7	Very high	96.7	Very high	59 Å²	59	61 Å²	61	36%	0.362	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-61	-14.8	179.5	53.7	0	0	0	0	114.6	P281 C285 F286 Y289	P281-T283 PolarHBondContact O-N 3.43Å; P281-T283 VanDerWaalsContact O-N 3.15Å; T283-C285 VanDerWaalsContact C-N 3.27Å; T283-C285 PolarHBondContact O-N 3.19Å; T283-F286 WeakPolarHBondContact CA-O 3.26Å; T283-Y289 HydrophobicContact CG2-CD1 4.45Å; T283-Y289 WeakPolarHBondContact CG2-O 3.3Å
284	I	96	Very high	96.6	Very high	76 Å²	76	63.3 Å²	63.3	39%	0.39	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-59.1	-40.6	169.3	-67.7	168.8	0	0	0	111.1	D230 S280 P281 L282	D230-I284 HydrophobicContact CB-CD1 4.01Å; D230-I284 HydrophobicContact CB-CG2 4.13Å; S280-I284 WeakPolarHBondContact OG-CD1 3.2Å; P281-I284 HydrophobicContact CG-CD1 4.21Å; P281-I284 HydrophobicContact CG-CG1 4.22Å; P281-I284 WeakPolarHBondContact O-CG1 3.35Å; P281-I284 PolarHBondContact O-N 3.01Å; L282-I284 PolarHBondContact O-N 3.44Å
285	C	97.3	Very high	96.6	Very high	10 Å²	10	60.6 Å²	60.6	7%	0.068	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-36.5	177.7	-171.5	0	0	0	0	112.1	Y229 N240 M243 L282 T283 P287	Y229-C285 VanDerWaalsContact O-CB 3.32Å; Y229-C285 WeakPolarHBondContact O-CB 3.2Å; N240-C285 PolarHBondContact OD1-SG 2.97Å; M243-C285 VanDerWaalsContact SD-SG 3.68Å; L282-C285 PolarHBondContact O-N 2.6Å; T283-C285 VanDerWaalsContact C-N 3.27Å; T283-C285 PolarHBondContact O-N 3.19Å; C285-P287 WeakPolarHBondContact O-CD 3.24Å
286	F	97.4	Very high	96.7	Very high	16 Å²	16	61.8 Å²	61.8	7%	0.07	33%	0.333	C	S	.	.			trans	-125.4	81	-171.8	-59.7	-79.6	0	0	0	110.5	M242 M243 M246 L282 T283 E288 Y289 Y301 I302 C305	M242-F286 HydrophobicContact CG-CE2 4.02Å; M242-F286 HydrophobicContact CG-CZ 3.86Å; M243-F286 HydrophobicContact SD-CE1 4.25Å; M246-F286 HydrophobicContact CE-CE1 4.37Å; M246-F286 HydrophobicContact SD-CE1 3.52Å; M246-F286 VanDerWaalsContact SD-CE1 3.52Å; M246-F286 HydrophobicContact SD-CZ 3.67Å; L282-F286 HydrophobicContact CD1-CD2 3.64Å; L282-F286 HydrophobicContact CD1-CE2 3.98Å; L282-F286 HydrophobicContact CD2-CD2 4.22Å; L282-F286 HydrophobicContact CG-CD2 3.73Å; L282-F286 HydrophobicContact CG-CE2 4.49Å; L282-F286 PolarHBondContact O-N 3.08Å; T283-F286 WeakPolarHBondContact CA-O 3.26Å; F286-E288 PolarHBondContact O-N 3.3Å; F286-Y289 WeakPolarHBondContact O-CB 3.44Å; F286-Y289 PolarHBondContact O-N 2.72Å; F286-Y301 HydrophobicContact CB-CE1 3.75Å; F286-Y301 AromaticContact CD1-CE1 3.78Å; F286-Y301 HydrophobicContact CD1-CE1 3.78Å; F286-Y301 HydrophobicContact CD2-CE1 4.17Å; F286-Y301 HydrophobicContact CE1-CE1 4.39Å; F286-Y301 HydrophobicContact CG-CD1 4.42Å; F286-Y301 AromaticContact CG-CE1 3.64Å; F286-Y301 HydrophobicContact CG-CE1 3.64Å; F286-I302 HydrophobicContact CE2-CG1 4.05Å; F286-C305 HydrophobicContact CE1-CB 4.49Å
287	P	97	Very high	96.8	Very high	107 Å²	107	64.6 Å²	64.6	70%	0.695	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.5	-174.9	-28	36	0	0	0	114.8	C285 Y289	C285-P287 WeakPolarHBondContact O-CD 3.24Å; P287-Y289 VanDerWaalsContact C-N 3.3Å
288	E	95.9	Very high	96.8	Very high	165 Å²	165	64.6 Å²	64.6	77%	0.771	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-3.4	178.5	-60.1	-69.6	179.4	0	0	113.7	F286 T290	F286-E288 PolarHBondContact O-N 3.3Å; E288-T290 PolarHBondContact O-N 3.01Å
289	Y	97.8	Very high	96.9	Very high	15 Å²	15	58.9 Å²	58.9	6%	0.059	32%	0.319	C	S	.	.			trans	-70.1	123.6	179	178	-110.8	0	0	0	111.2	L282 T283 F286 P287 G291 G292 E297 A298 Y301	L282-Y289 HydrophobicContact CB-CD1 3.72Å; L282-Y289 HydrophobicContact CB-CE1 3.94Å; L282-Y289 HydrophobicContact CB-CG 4.35Å; L282-Y289 HydrophobicContact CD2-CD1 3.84Å; L282-Y289 HydrophobicContact CD2-CD2 3.89Å; L282-Y289 HydrophobicContact CD2-CE1 3.91Å; L282-Y289 HydrophobicContact CD2-CE2 3.98Å; L282-Y289 HydrophobicContact CD2-CG 3.8Å; L282-Y289 HydrophobicContact CG-CD1 4.17Å; L282-Y289 HydrophobicContact CG-CE1 4.49Å; L282-Y289 HydrophobicContact CG-CG 4.33Å; T283-Y289 HydrophobicContact CG2-CD1 4.45Å; T283-Y289 WeakPolarHBondContact CG2-O 3.3Å; F286-Y289 WeakPolarHBondContact O-CB 3.44Å; F286-Y289 PolarHBondContact O-N 2.72Å; P287-Y289 VanDerWaalsContact C-N 3.3Å; Y289-G291 VanDerWaalsContact CE1-C 3.41Å; Y289-G291 WeakPolarHBondContact CE1-O 3.42Å; Y289-G291 VanDerWaalsContact CZ-C 3.46Å; Y289-G291 WeakPolarHBondContact OH-CA 3.48Å; Y289-G292 PolarHBondContact OH-N 3.42Å; Y289-G292 PolarHBondContact OH-O 2.75Å; Y289-E297 WeakPolarHBondContact OH-CB 3.33Å; Y289-A298 WeakPolarHBondContact OH-CA 3.1Å; Y289-A298 PolarHBondContact OH-N 3.08Å; Y289-Y301 AromaticContact CD2-CD1 3.75Å; Y289-Y301 HydrophobicContact CD2-CD1 3.75Å; Y289-Y301 AromaticContact CD2-CD2 3.53Å; Y289-Y301 HydrophobicContact CD2-CD2 3.53Å; Y289-Y301 HydrophobicContact CD2-CE1 4.07Å; Y289-Y301 AromaticContact CD2-CE2 3.85Å; Y289-Y301 HydrophobicContact CD2-CE2 3.85Å; Y289-Y301 AromaticContact CD2-CG 3.45Å; Y289-Y301 HydrophobicContact CD2-CG 3.45Å; Y289-Y301 VanDerWaalsContact CD2-CG 3.45Å; Y289-Y301 HydrophobicContact CE2-CD1 4.27Å; Y289-Y301 AromaticContact CE2-CD2 3.92Å; Y289-Y301 HydrophobicContact CE2-CD2 3.92Å; Y289-Y301 AromaticContact CE2-CG 3.68Å; Y289-Y301 HydrophobicContact CE2-CG 3.68Å; Y289-Y301 HydrophobicContact CG-CD1 4.48Å
290	T	96.9	Very high	97.1	Very high	142 Å²	142	54.9 Å²	54.9	87%	0.871	30%	0.303	S	S	*	.			trans	-110.8	-2.3	-177.6	54.9	0	0	0	0	114.1	E288	E288-T290 PolarHBondContact O-N 3.01Å
291	G	96.1	Very high	97.2	Very high	27 Å²	27	57.9 Å²	57.9	28%	0.278	31%	0.314	S	S	.	.	S	Bend	trans	-78	178.6	179.1	0	0	0	0	0	113.7	Y289 E297	Y289-G291 VanDerWaalsContact CE1-C 3.41Å; Y289-G291 WeakPolarHBondContact CE1-O 3.42Å; Y289-G291 VanDerWaalsContact CZ-C 3.46Å; Y289-G291 WeakPolarHBondContact OH-CA 3.48Å; G291-E297 WeakPolarHBondContact CA-OE2 3.48Å
292	G	95.5	Very high	97.3	Very high	24 Å²	24	55.9 Å²	55.9	25%	0.247	30%	0.301	C	S	.	.			trans	-74.1	153.8	179	0	0	0	0	0	114.2	Y289 N294 E297	Y289-G292 PolarHBondContact OH-N 3.42Å; Y289-G292 PolarHBondContact OH-O 2.75Å; G292-N294 PolarHBondContact O-N 2.66Å; G292-E297 PolarHBondContact N-OE2 2.74Å
293	N	95.5	Very high	97.3	Very high	76 Å²	76	58.1 Å²	58.1	41%	0.406	31%	0.309	S	S	.	.	S	Bend	trans	-78.6	50.1	170.8	-68.8	-36.8	0	0	0	111.8	I277 P281 L282	I277-N293 HydrophobicContact CG1-CB 4.49Å; P281-N293 WeakPolarHBondContact CA-OD1 3.29Å; L282-N293 PolarHBondContact N-OD1 2.88Å
294	N	96.9	Very high	97.2	Very high	48 Å²	48	57 Å²	57	26%	0.257	30%	0.304	S	S	.	.	S	Bend	trans	-116.2	160.1	174.8	62	69.7	0	0	0	110.2	G292 E296 E297 A298	G292-N294 PolarHBondContact O-N 2.66Å; N294-E296 PolarHBondContact O-N 2.95Å; N294-E296 PolarHBondContact OD1-N 3.36Å; N294-E297 PolarHBondContact ND2-OE1 2.74Å; N294-E297 WeakPolarHBondContact OD1-CB 3.47Å; N294-E297 WeakPolarHBondContact OD1-CG 3.34Å; N294-E297 PolarHBondContact OD1-N 3.41Å; N294-A298 WeakPolarHBondContact O-CB 3.42Å; N294-A298 PolarHBondContact O-N 2.8Å
295	Y	98.1	Very high	97.2	Very high	34 Å²	34	54.5 Å²	54.5	13%	0.133	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-45.1	-175	173.2	-99.1	0	0	0	111.7	R270 F273 E274 S299	R270-Y295 HydrophobicContact CB-CE2 4.04Å; F273-Y295 AromaticContact CD1-CD2 3.68Å; F273-Y295 HydrophobicContact CD1-CD2 3.68Å; F273-Y295 AromaticContact CD1-CE2 3.92Å; F273-Y295 HydrophobicContact CD1-CE2 3.92Å; F273-Y295 HydrophobicContact CE1-CD2 4.03Å; F273-Y295 HydrophobicContact CE1-CE2 4.46Å; E274-Y295 HydrophobicContact CB-CD2 3.64Å; E274-Y295 HydrophobicContact CB-CE2 4.27Å; E274-Y295 HydrophobicContact CB-CG 4.18Å; E274-Y295 HydrophobicContact CG-CD2 4.12Å; E274-Y295 HydrophobicContact CG-CG 4.14Å; Y295-S299 WeakPolarHBondContact O-CA 3.1Å; Y295-S299 WeakPolarHBondContact O-CB 3.39Å; Y295-S299 PolarHBondContact O-N 2.71Å; Y295-S299 PolarHBondContact O-OG 3.43Å
296	E	97.9	Very high	97.1	Very high	122 Å²	122	54 Å²	54	57%	0.57	29%	0.29	S	S	*	.	H	α-helix	trans	-61.4	-55.5	-172.8	-65.4	72.9	-162.4	0	0	111.8	N294 S299 E300	N294-E296 PolarHBondContact O-N 2.95Å; N294-E296 PolarHBondContact OD1-N 3.36Å; E296-S299 PolarHBondContact O-OG 2.93Å; E296-E300 WeakPolarHBondContact O-CB 3.46Å; E296-E300 PolarHBondContact O-N 3.44Å
297	E	98.1	Very high	96.9	Very high	96 Å²	96	56.3 Å²	56.3	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-69.2	-41.6	-177.9	-68.1	178.6	-120.9	0	0	112	Y289 G291 G292 N294 Y301	Y289-E297 WeakPolarHBondContact OH-CB 3.33Å; G291-E297 WeakPolarHBondContact CA-OE2 3.48Å; G292-E297 PolarHBondContact N-OE2 2.74Å; N294-E297 PolarHBondContact ND2-OE1 2.74Å; N294-E297 WeakPolarHBondContact OD1-CB 3.47Å; N294-E297 WeakPolarHBondContact OD1-CG 3.34Å; N294-E297 PolarHBondContact OD1-N 3.41Å; E297-Y301 WeakPolarHBondContact O-CB 3.43Å; E297-Y301 PolarHBondContact O-N 3.32Å; E297-Y301 VanDerWaalsContact O-N 3.07Å
298	A	98.4	Very high	96.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-73	-38.9	-176	0	0	0	0	0	111.9	F273 I277 L282 Y289 N294 Y301 I302	F273-A298 HydrophobicContact CE1-CB 4.19Å; F273-A298 HydrophobicContact CZ-CB 3.69Å; I277-A298 HydrophobicContact CD1-CB 3.9Å; I277-A298 HydrophobicContact CG1-CB 3.8Å; L282-A298 HydrophobicContact CD2-CB 3.97Å; Y289-A298 WeakPolarHBondContact OH-CA 3.1Å; Y289-A298 PolarHBondContact OH-N 3.08Å; N294-A298 WeakPolarHBondContact O-CB 3.42Å; N294-A298 PolarHBondContact O-N 2.8Å; A298-Y301 PolarHBondContact O-N 2.82Å; A298-I302 WeakPolarHBondContact O-CG1 3.46Å; A298-I302 PolarHBondContact O-N 3.34Å
299	S	98.3	Very high	96.3	Very high	4 Å²	4	50 Å²	50	3%	0.028	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-41.5	178.3	66.7	0	0	0	0	112	M226 Y295 E296 I302 R303 F322	M226-S299 VanDerWaalsContact CE-CB 3.5Å; Y295-S299 WeakPolarHBondContact O-CA 3.1Å; Y295-S299 WeakPolarHBondContact O-CB 3.39Å; Y295-S299 PolarHBondContact O-N 2.71Å; Y295-S299 PolarHBondContact O-OG 3.43Å; E296-S299 PolarHBondContact O-OG 2.93Å; S299-I302 PolarHBondContact O-N 3.29Å; S299-R303 PolarHBondContact O-N 2.91Å; S299-F322 VanDerWaalsContact CB-CZ 3.48Å; S299-F322 WeakPolarHBondContact O-CZ 3.46Å; S299-F322 WeakPolarHBondContact OG-CZ 3.16Å
300	E	98	Very high	95.6	Very high	84 Å²	84	51.1 Å²	51.1	39%	0.393	27%	0.274	S	S	.	.	H	α-helix	trans	-69.4	-37.4	177.9	-167.1	58.6	-148.1	0	0	111.4	E296 R303 S304	E296-E300 WeakPolarHBondContact O-CB 3.46Å; E296-E300 PolarHBondContact O-N 3.44Å; E300-R303 WeakPolarHBondContact O-CB 3.32Å; E300-R303 PolarHBondContact O-N 3.26Å; E300-R303 IonicContact OE1-NH1 3.71Å; E300-R303 IonicContact OE2-CZ 3.18Å; E300-R303 IonicContact OE2-NE 2.81Å; E300-R303 IonicContact OE2-NH1 2.67Å; E300-R303 PolarHBondContact OE2-NH1 3.48Å; E300-S304 WeakPolarHBondContact O-CB 3.44Å; E300-S304 PolarHBondContact O-N 3.34Å
301	Y	98.3	Very high	94.9	Very high	68 Å²	68	49.7 Å²	49.7	27%	0.267	27%	0.265	S	S	.	.	H	α-helix	trans	-59.3	-51.1	172.4	-177.2	-92.5	0	0	0	111.4	L282 F286 Y289 E297 A298 R303 S304 C305	L282-Y301 HydrophobicContact CD2-CD1 3.79Å; L282-Y301 HydrophobicContact CD2-CG 4.41Å; F286-Y301 HydrophobicContact CB-CE1 3.75Å; F286-Y301 AromaticContact CD1-CE1 3.78Å; F286-Y301 HydrophobicContact CD1-CE1 3.78Å; F286-Y301 HydrophobicContact CD2-CE1 4.17Å; F286-Y301 HydrophobicContact CE1-CE1 4.39Å; F286-Y301 HydrophobicContact CG-CD1 4.42Å; F286-Y301 AromaticContact CG-CE1 3.64Å; F286-Y301 HydrophobicContact CG-CE1 3.64Å; Y289-Y301 AromaticContact CD2-CD1 3.75Å; Y289-Y301 HydrophobicContact CD2-CD1 3.75Å; Y289-Y301 AromaticContact CD2-CD2 3.53Å; Y289-Y301 HydrophobicContact CD2-CD2 3.53Å; Y289-Y301 HydrophobicContact CD2-CE1 4.07Å; Y289-Y301 AromaticContact CD2-CE2 3.85Å; Y289-Y301 HydrophobicContact CD2-CE2 3.85Å; Y289-Y301 AromaticContact CD2-CG 3.45Å; Y289-Y301 HydrophobicContact CD2-CG 3.45Å; Y289-Y301 VanDerWaalsContact CD2-CG 3.45Å; Y289-Y301 HydrophobicContact CE2-CD1 4.27Å; Y289-Y301 AromaticContact CE2-CD2 3.92Å; Y289-Y301 HydrophobicContact CE2-CD2 3.92Å; Y289-Y301 AromaticContact CE2-CG 3.68Å; Y289-Y301 HydrophobicContact CE2-CG 3.68Å; Y289-Y301 HydrophobicContact CG-CD1 4.48Å; E297-Y301 WeakPolarHBondContact O-CB 3.43Å; E297-Y301 PolarHBondContact O-N 3.32Å; E297-Y301 VanDerWaalsContact O-N 3.07Å; A298-Y301 PolarHBondContact O-N 2.82Å; Y301-R303 VanDerWaalsContact C-N 3.32Å; Y301-R303 PolarHBondContact O-N 3.4Å; Y301-S304 PolarHBondContact O-N 3.42Å; Y301-S304 VanDerWaalsContact O-N 3.16Å; Y301-S304 PolarHBondContact O-OG 2.82Å; Y301-C305 VanDerWaalsContact CE1-SG 3.51Å; Y301-C305 PolarHBondContact O-N 2.77Å; Y301-C305 PolarHBondContact O-SG 3.02Å
302	I	98.2	Very high	93.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.3	-47.9	176.4	-68.6	168.4	0	0	0	110.3	M226 M242 L267 F273 L282 F286 A298 S299 S304 C305 F306	M226-I302 HydrophobicContact CE-CD1 4.15Å; M242-I302 HydrophobicContact CE-CD1 4.23Å; M242-I302 HydrophobicContact CE-CG2 4.16Å; M242-I302 HydrophobicContact SD-CG2 4.36Å; L267-I302 HydrophobicContact CD2-CG2 4.21Å; F273-I302 HydrophobicContact CD2-CD1 4.49Å; F273-I302 HydrophobicContact CE2-CD1 3.64Å; F273-I302 HydrophobicContact CZ-CD1 3.65Å; L282-I302 HydrophobicContact CD1-CD1 3.91Å; L282-I302 HydrophobicContact CD1-CG1 4.15Å; L282-I302 HydrophobicContact CD2-CG1 4.41Å; F286-I302 HydrophobicContact CE2-CG1 4.05Å; A298-I302 WeakPolarHBondContact O-CG1 3.46Å; A298-I302 PolarHBondContact O-N 3.34Å; S299-I302 PolarHBondContact O-N 3.29Å; I302-S304 VanDerWaalsContact C-N 3.33Å; I302-S304 PolarHBondContact O-N 3.22Å; I302-C305 WeakPolarHBondContact O-CB 3.17Å; I302-C305 PolarHBondContact O-N 2.98Å; I302-F306 HydrophobicContact CG2-CD2 4.02Å; I302-F306 HydrophobicContact CG2-CE2 3.94Å; I302-F306 WeakPolarHBondContact O-CD2 3.39Å; I302-F306 PolarHBondContact O-N 2.87Å
303	R	97.8	Very high	92.3	Very high	48 Å²	48	58.8 Å²	58.8	18%	0.181	31%	0.305	C	S	.	.	H	α-helix	trans	-52.7	-52.1	176.9	177.7	-171.9	-71.8	168.3	-4.4	111.2	L267 S299 E300 Y301 C305 F306 E307 S320 F322	L267-R303 HydrophobicContact CD1-CB 3.55Å; L267-R303 HydrophobicContact CD1-CG 3.86Å; S299-R303 PolarHBondContact O-N 2.91Å; E300-R303 WeakPolarHBondContact O-CB 3.32Å; E300-R303 PolarHBondContact O-N 3.26Å; E300-R303 IonicContact OE1-NH1 3.71Å; E300-R303 IonicContact OE2-CZ 3.18Å; E300-R303 IonicContact OE2-NE 2.81Å; E300-R303 IonicContact OE2-NH1 2.67Å; E300-R303 PolarHBondContact OE2-NH1 3.48Å; Y301-R303 VanDerWaalsContact C-N 3.32Å; Y301-R303 PolarHBondContact O-N 3.4Å; R303-C305 VanDerWaalsContact C-N 3.27Å; R303-C305 PolarHBondContact O-N 3.47Å; R303-F306 PolarHBondContact O-N 2.85Å; R303-F306 VanDerWaalsContact O-N 3.11Å; R303-E307 WeakPolarHBondContact CD-OE1 3.45Å; R303-E307 HydrophobicContact CG-CG 4.19Å; R303-E307 VanDerWaalsContact CG-OE1 3.31Å; R303-E307 WeakPolarHBondContact CG-OE1 3.37Å; R303-E307 PolarHBondContact O-N 2.94Å; R303-S320 WeakPolarHBondContact CD-OG 3.41Å; R303-S320 WeakPolarHBondContact CG-OG 3.34Å; R303-S320 PolarHBondContact NE-OG 3.38Å; R303-F322 HydrophobicContact CB-CZ 4.37Å; R303-F322 VanDerWaalsContact CZ-CE2 3.44Å
304	S	95.9	Very high	91	Very high	36 Å²	36	56.9 Å²	56.9	25%	0.252	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-37.1	-178.2	77.7	0	0	0	0	112.4	E300 Y301 I302 F306 E307 N308	E300-S304 WeakPolarHBondContact O-CB 3.44Å; E300-S304 PolarHBondContact O-N 3.34Å; Y301-S304 PolarHBondContact O-N 3.42Å; Y301-S304 VanDerWaalsContact O-N 3.16Å; Y301-S304 PolarHBondContact O-OG 2.82Å; I302-S304 VanDerWaalsContact C-N 3.33Å; I302-S304 PolarHBondContact O-N 3.22Å; S304-F306 VanDerWaalsContact C-N 3.34Å; S304-F306 PolarHBondContact O-N 3.42Å; S304-E307 PolarHBondContact O-N 3.05Å; S304-N308 VanDerWaalsContact O-CB 3.24Å; S304-N308 WeakPolarHBondContact O-CB 3.27Å; S304-N308 PolarHBondContact O-N 3.21Å; S304-N308 PolarHBondContact O-ND2 3.2Å
305	C	95.6	Very high	89.5	Confident	23 Å²	23	60.9 Å²	60.9	16%	0.155	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-41.5	176.5	-67.5	0	0	0	0	112.2	M246 F286 Y301 I302 R303 S309	M246-C305 HydrophobicContact CE-CB 3.68Å; M246-C305 HydrophobicContact SD-CB 4.3Å; F286-C305 HydrophobicContact CE1-CB 4.49Å; Y301-C305 VanDerWaalsContact CE1-SG 3.51Å; Y301-C305 PolarHBondContact O-N 2.77Å; Y301-C305 PolarHBondContact O-SG 3.02Å; I302-C305 WeakPolarHBondContact O-CB 3.17Å; I302-C305 PolarHBondContact O-N 2.98Å; R303-C305 VanDerWaalsContact C-N 3.27Å; R303-C305 PolarHBondContact O-N 3.47Å; C305-S309 PolarHBondContact O-OG 3.13Å
306	F	96.1	Very high	88.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-72.7	-45.6	176.3	-80	-90.4	0	0	0	111.7	V224 M242 M246 F249 L265 L267 I302 R303 S304 N308 S309	V224-F306 HydrophobicContact CB-CZ 4.27Å; V224-F306 HydrophobicContact CG1-CE1 4.33Å; V224-F306 HydrophobicContact CG1-CE2 3.81Å; V224-F306 HydrophobicContact CG1-CZ 3.58Å; V224-F306 HydrophobicContact CG2-CD1 4Å; V224-F306 HydrophobicContact CG2-CE1 3.5Å; V224-F306 VanDerWaalsContact CG2-CE1 3.5Å; V224-F306 HydrophobicContact CG2-CE2 4.22Å; V224-F306 HydrophobicContact CG2-CZ 3.63Å; M242-F306 HydrophobicContact SD-CE2 3.58Å; M242-F306 VanDerWaalsContact SD-CE2 3.58Å; M242-F306 HydrophobicContact SD-CZ 3.77Å; M246-F306 HydrophobicContact CB-CE1 4.32Å; M246-F306 HydrophobicContact CB-CZ 4.23Å; M246-F306 HydrophobicContact CG-CD1 4.38Å; M246-F306 HydrophobicContact CG-CD2 4.23Å; M246-F306 HydrophobicContact CG-CE1 3.76Å; M246-F306 HydrophobicContact CG-CE2 3.58Å; M246-F306 HydrophobicContact CG-CZ 3.3Å; M246-F306 HydrophobicContact SD-CE2 4.43Å; F249-F306 HydrophobicContact CB-CD1 3.72Å; F249-F306 HydrophobicContact CB-CE1 3.74Å; F249-F306 HydrophobicContact CD1-CB 4.4Å; F249-F306 AromaticContact CD1-CD1 3.72Å; F249-F306 HydrophobicContact CD1-CD1 3.72Å; F249-F306 HydrophobicContact CD2-CD1 4.25Å; F249-F306 HydrophobicContact CE1-CB 4.38Å; F249-F306 HydrophobicContact CE1-CD1 4.41Å; F249-F306 WeakPolarHBondContact CE1-O 3.47Å; F249-F306 AromaticContact CG-CD1 3.62Å; F249-F306 HydrophobicContact CG-CD1 3.62Å; F249-F306 HydrophobicContact CG-CE1 4.15Å; L265-F306 HydrophobicContact CD1-CB 4.46Å; L265-F306 HydrophobicContact CD1-CD1 4.21Å; L265-F306 HydrophobicContact CD1-CG 4.43Å; L265-F306 HydrophobicContact CD2-CB 3.46Å; L265-F306 VanDerWaalsContact CD2-CB 3.46Å; L265-F306 HydrophobicContact CD2-CG 4.16Å; L267-F306 HydrophobicContact CD2-CD2 4.32Å; I302-F306 HydrophobicContact CG2-CD2 4.02Å; I302-F306 HydrophobicContact CG2-CE2 3.94Å; I302-F306 WeakPolarHBondContact O-CD2 3.39Å; I302-F306 PolarHBondContact O-N 2.87Å; R303-F306 PolarHBondContact O-N 2.85Å; R303-F306 VanDerWaalsContact O-N 3.11Å; S304-F306 VanDerWaalsContact C-N 3.34Å; S304-F306 PolarHBondContact O-N 3.42Å; F306-N308 VanDerWaalsContact C-N 3.27Å; F306-N308 PolarHBondContact O-N 3.26Å; F306-S309 WeakPolarHBondContact O-CB 3.36Å; F306-S309 PolarHBondContact O-N 2.86Å; F306-S309 PolarHBondContact O-OG 2.82Å
307	E	93.4	Very high	87.5	Confident	64 Å²	64	58.7 Å²	58.7	30%	0.299	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-37.4	179.8	-71.9	177	172.4	0	0	112.4	R303 S304 S309 I318 S320	R303-E307 WeakPolarHBondContact CD-OE1 3.45Å; R303-E307 HydrophobicContact CG-CG 4.19Å; R303-E307 VanDerWaalsContact CG-OE1 3.31Å; R303-E307 WeakPolarHBondContact CG-OE1 3.37Å; R303-E307 PolarHBondContact O-N 2.94Å; S304-E307 PolarHBondContact O-N 3.05Å; E307-S309 PolarHBondContact O-N 3.46Å; E307-I318 HydrophobicContact CG-CG2 4.23Å; E307-S320 WeakPolarHBondContact OE1-CB 3.26Å; E307-S320 PolarHBondContact OE1-OG 3.27Å
308	N	91.5	Very high	87.1	Confident	127 Å²	127	55.4 Å²	55.4	68%	0.679	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	2.3	176.9	-67	-36.2	0	0	0	114.1	S304 F306 N310	S304-N308 VanDerWaalsContact O-CB 3.24Å; S304-N308 WeakPolarHBondContact O-CB 3.27Å; S304-N308 PolarHBondContact O-N 3.21Å; S304-N308 PolarHBondContact O-ND2 3.2Å; F306-N308 VanDerWaalsContact C-N 3.27Å; F306-N308 PolarHBondContact O-N 3.26Å; N308-N310 VanDerWaalsContact C-N 3.3Å
309	S	88.2	Confident	86.8	Confident	12 Å²	12	58.5 Å²	58.5	8%	0.084	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.1	178.3	-63.7	0	0	0	0	113.7	N254 C305 F306 E307 T311	N254-S309 PolarHBondContact ND2-O 3.27Å; C305-S309 PolarHBondContact O-OG 3.13Å; F306-S309 WeakPolarHBondContact O-CB 3.36Å; F306-S309 PolarHBondContact O-N 2.86Å; F306-S309 PolarHBondContact O-OG 2.82Å; E307-S309 PolarHBondContact O-N 3.46Å; S309-T311 PolarHBondContact O-N 3.39Å
310	N	83.6	Confident	86.6	Confident	38 Å²	38	59.4 Å²	59.4	20%	0.203	33%	0.329	C	S	.	.			trans	-74.5	112.5	172.1	-178.6	33.2	0	0	0	110.1	N308 R312 G314 I318	N308-N310 VanDerWaalsContact C-N 3.3Å; N310-R312 PolarHBondContact OD1-N 2.85Å; N310-G314 PolarHBondContact ND2-O 2.93Å; N310-I318 HydrophobicContact CB-CD1 4.16Å
311	T	81.5	Confident	86.6	Confident	112 Å²	112	57.8 Å²	57.8	69%	0.687	32%	0.321	S	S	*	.			trans	-104.2	-1.5	-178.4	57.8	0	0	0	0	113	N254 S309	N254-T311 PolarHBondContact OD1-N 3.13Å; N254-T311 PolarHBondContact OD1-OG1 2.94Å; S309-T311 PolarHBondContact O-N 3.39Å
312	R	74.7	Confident	86.6	Confident	102 Å²	102	55.9 Å²	55.9	39%	0.385	32%	0.315	S	S	.	.	S	Bend	trans	-77.9	147.4	178.7	-64.6	-176	75.8	167.6	-3	110.8	T259 N310 G314	T259-R312 VanDerWaalsContact CG2-NH2 3.33Å; T259-R312 PolarHBondContact OG1-NH1 3.23Å; T259-R312 PolarHBondContact OG1-NH2 3.33Å; N310-R312 PolarHBondContact OD1-N 2.85Å; R312-G314 PolarHBondContact O-N 3.23Å
313	S	63.2	Low	86.6	Confident	140 Å²	140	55.9 Å²	55.9	98%	0.979	32%	0.315	S	S	*	.	S	Bend	trans	-70.5	4.4	-177.6	51	0	0	0	0	115.4
314	G	66.9	Low	86.6	Confident	37 Å²	37	54 Å²	54	38%	0.381	31%	0.309	S	S	.	.	S	Bend	trans	-108.8	149	-179.9	0	0	0	0	0	112.2	N310 R312 K316	N310-G314 PolarHBondContact ND2-O 2.93Å; R312-G314 PolarHBondContact O-N 3.23Å; G314-K316 PolarHBondContact O-N 2.88Å
315	P	66.6	Low	86.7	Confident	131 Å²	131	52.5 Å²	52.5	85%	0.851	30%	0.298	S	S	*	.			trans	-65.2	104.4	171.3	28.4	-31.8	0	0	0	108.2
316	K	76.4	Confident	86.7	Confident	30 Å²	30	52.4 Å²	52.4	13%	0.13	30%	0.297	C	S	.	.			trans	-101.3	113.1	166.1	-173.1	166.4	-177.3	168.5	0	106.9	C253 F258 T261 I263 G314 I318	C253-K316 PolarHBondContact O-NZ 2.68Å; F258-K316 PolarHBondContact O-NZ 2.99Å; T261-K316 VanDerWaalsContact O-CE 3.23Å; T261-K316 WeakPolarHBondContact O-CE 3.37Å; I263-K316 HydrophobicContact CD1-CD 4.4Å; I263-K316 VanDerWaalsContact CG1-CE 3.49Å; G314-K316 PolarHBondContact O-N 2.88Å; K316-I318 PolarHBondContact O-N 2.6Å
317	D	77.1	Confident	86.8	Confident	80 Å²	80	55.1 Å²	55.1	43%	0.428	31%	0.312	S	S	.	.			trans	-70.2	114.8	178.7	-62.1	-27.3	0	0	0	109.3	I263 Y319	I263-D317 PolarHBondContact N-O 3.39Å; D317-Y319 HydrophobicContact CB-CD2 4.07Å; D317-Y319 HydrophobicContact CB-CE1 4.41Å; D317-Y319 HydrophobicContact CB-CE2 3.25Å; D317-Y319 VanDerWaalsContact CB-CZ 3.45Å; D317-Y319 WeakPolarHBondContact CB-OH 3.19Å; D317-Y319 PolarHBondContact OD2-OH 3.14Å
318	I	89.5	Confident	87	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.138	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	108.2	170.2	-61.4	169.6	0	0	0	106.8	F249 I263 L265 E307 N310 K316	F249-I318 HydrophobicContact CE1-CD1 4.19Å; F249-I318 HydrophobicContact CZ-CD1 4.01Å; F249-I318 HydrophobicContact CZ-CG1 4.5Å; F249-I318 HydrophobicContact CZ-CG2 4.26Å; I263-I318 WeakPolarHBondContact O-CA 3.47Å; L265-I318 HydrophobicContact CB-CG2 3.92Å; L265-I318 HydrophobicContact CD2-CG2 4.36Å; E307-I318 HydrophobicContact CG-CG2 4.23Å; N310-I318 HydrophobicContact CB-CD1 4.16Å; K316-I318 PolarHBondContact O-N 2.6Å
319	Y	91.4	Very high	87.2	Confident	66 Å²	66	51.9 Å²	51.9	26%	0.259	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	101.2	178.7	-60.9	-85.1	0	0	0	109.3	I263 V264 L265 D317 V341	I263-Y319 PolarHBondContact O-N 2.88Å; V264-Y319 CarbonylContact C-O 3.43Å; V264-Y319 WeakPolarHBondContact CA-O 3.49Å; L265-Y319 PolarHBondContact N-O 2.97Å; D317-Y319 HydrophobicContact CB-CD2 4.07Å; D317-Y319 HydrophobicContact CB-CE1 4.41Å; D317-Y319 HydrophobicContact CB-CE2 3.25Å; D317-Y319 VanDerWaalsContact CB-CZ 3.45Å; D317-Y319 WeakPolarHBondContact CB-OH 3.19Å; D317-Y319 PolarHBondContact OD2-OH 3.14Å; Y319-V341 HydrophobicContact CD1-CG1 4.31Å; Y319-V341 HydrophobicContact CD1-CG2 4.41Å; Y319-V341 HydrophobicContact CD2-CG1 4.04Å; Y319-V341 HydrophobicContact CE1-CG1 3.81Å; Y319-V341 HydrophobicContact CE1-CG2 4.23Å; Y319-V341 HydrophobicContact CE2-CG1 3.52Å; Y319-V341 HydrophobicContact CG-CG1 4.41Å; Y319-V341 VanDerWaalsContact CZ-CG1 3.4Å
320	S	95.5	Very high	87.7	Confident	22 Å²	22	52 Å²	52	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	137.8	-176	73.3	0	0	0	0	113.1	L265 R303 E307	L265-S320 CarbonylContact O-C 3.53Å; L265-S320 WeakPolarHBondContact O-CA 3.01Å; R303-S320 WeakPolarHBondContact CD-OG 3.41Å; R303-S320 WeakPolarHBondContact CG-OG 3.34Å; R303-S320 PolarHBondContact NE-OG 3.38Å; E307-S320 WeakPolarHBondContact OE1-CB 3.26Å; E307-S320 PolarHBondContact OE1-OG 3.27Å
321	H	97.1	Very high	88.3	Confident	50 Å²	50	50.2 Å²	50.2	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	132.1	178.8	-64.5	-82.5	0	0	0	110.9	L265 F266 L267 T323 V334	L265-H321 PolarHBondContact O-N 3.15Å; F266-H321 HydrophobicContact CD1-CB 4.5Å; L267-H321 PolarHBondContact N-O 3.38Å; H321-T323 HydrophobicContact CB-CG2 4.37Å; H321-V334 HydrophobicContact CB-CG1 3.55Å; H321-V334 HydrophobicContact CB-CG2 4.15Å
322	F	98.1	Very high	89	Confident	29 Å²	29	50 Å²	50	13%	0.127	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	124.3	168.2	-62.8	-56.9	0	0	0	109.9	M226 L267 S299 R303	M226-F322 HydrophobicContact CE-CD1 4.1Å; M226-F322 HydrophobicContact CE-CE1 3.81Å; M226-F322 HydrophobicContact SD-CD1 3.66Å; M226-F322 HydrophobicContact SD-CE1 3.97Å; L267-F322 HydrophobicContact CB-CD1 3.58Å; L267-F322 HydrophobicContact CB-CE1 4.01Å; L267-F322 HydrophobicContact CD1-CD1 3.78Å; L267-F322 HydrophobicContact CD1-CE1 3.41Å; L267-F322 VanDerWaalsContact CD1-CE1 3.41Å; L267-F322 HydrophobicContact CD1-CZ 4.26Å; L267-F322 HydrophobicContact CG-CD1 4.34Å; L267-F322 HydrophobicContact CG-CE1 4.34Å; L267-F322 CarbonylContact O-C 3.55Å; L267-F322 WeakPolarHBondContact O-CA 3.4Å; S299-F322 VanDerWaalsContact CB-CZ 3.48Å; S299-F322 WeakPolarHBondContact O-CZ 3.46Å; S299-F322 WeakPolarHBondContact OG-CZ 3.16Å; R303-F322 HydrophobicContact CB-CZ 4.37Å; R303-F322 VanDerWaalsContact CZ-CE2 3.44Å
323	T	98.2	Very high	89.9	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.			trans	-126.9	153.1	-173.2	52.4	0	0	0	0	112.9	F266 L267 N268 K269 R270 H321 N330 I331 V334	F266-T323 HydrophobicContact CB-CG2 4.36Å; F266-T323 HydrophobicContact CD1-CG2 4.17Å; F266-T323 HydrophobicContact CD2-CG2 4.02Å; F266-T323 HydrophobicContact CE1-CG2 4.49Å; F266-T323 HydrophobicContact CE2-CG2 4.37Å; F266-T323 HydrophobicContact CG-CG2 3.93Å; L267-T323 PolarHBondContact O-N 3.37Å; N268-T323 CarbonylContact C-O 3.28Å; N268-T323 VanDerWaalsContact CA-O 3.3Å; N268-T323 WeakPolarHBondContact CA-O 3.21Å; N268-T323 WeakPolarHBondContact CA-OG1 3.19Å; N268-T323 WeakPolarHBondContact CB-OG1 3.33Å; N268-T323 PolarHBondContact OD1-O 3.33Å; N268-T323 PolarHBondContact OD1-OG1 3.18Å; K269-T323 PolarHBondContact N-O 3.36Å; K269-T323 VanDerWaalsContact N-O 3.1Å; R270-T323 WeakPolarHBondContact CG-O 3.37Å; R270-T323 PolarHBondContact N-O 3.4Å; H321-T323 HydrophobicContact CB-CG2 4.37Å; T323-N330 WeakPolarHBondContact CA-OD1 3.4Å; T323-I331 HydrophobicContact CG2-CD1 4.18Å; T323-V334 HydrophobicContact CG2-CB 4.28Å; T323-V334 HydrophobicContact CG2-CG1 3.98Å; T323-V334 HydrophobicContact CG2-CG2 4.07Å
324	C	98	Very high	91.4	Very high	9 Å²	9	45.6 Å²	45.6	6%	0.061	25%	0.252	C	S	.	.			trans	-124.2	103.4	160	174.1	0	0	0	0	107.3	R270 D271 T326 D327 N330	R270-C324 HydrophobicContact CG-CB 4.44Å; D271-C324 PolarHBondContact OD1-SG 2.8Å; C324-T326 PolarHBondContact O-N 3.45Å; C324-T326 PolarHBondContact SG-OG1 3.06Å; C324-D327 HydrophobicContact CB-CB 3.97Å; C324-D327 PolarHBondContact O-N 2.9Å; C324-N330 PolarHBondContact N-OD1 3.47Å
325	A	97.4	Very high	92.6	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.033	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.4	-177.2	0	0	0	0	0	113.8	T48 I49 Q52 N268	T48-A325 HydrophobicContact CG2-CB 3.7Å; T48-A325 WeakPolarHBondContact CG2-O 3.47Å; I49-A325 HydrophobicContact CG1-CB 4.14Å; Q52-A325 WeakPolarHBondContact CG-O 3.45Å; Q52-A325 PolarHBondContact NE2-O 3.26Å; N268-A325 WeakPolarHBondContact OD1-CB 3.25Å; N268-A325 PolarHBondContact OD1-N 3.2Å
326	T	96.8	Very high	93.8	Very high	21 Å²	21	40.3 Å²	40.3	13%	0.129	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	0.3	176.4	66.7	0	0	0	0	113.9	T48 Q171 R175 C324	T48-T326 HydrophobicContact CG2-CG2 4.07Å; Q171-T326 PolarHBondContact NE2-O 3.08Å; Q171-T326 PolarHBondContact OE1-O 3.15Å; R175-T326 PolarHBondContact NH2-OG1 2.97Å; C324-T326 PolarHBondContact O-N 3.45Å; C324-T326 PolarHBondContact SG-OG1 3.06Å
327	D	97.8	Very high	94.4	Very high	57 Å²	57	40.6 Å²	40.6	31%	0.305	22%	0.216	S	C	.	.			trans	-103.9	105.7	172.3	177.4	-9.3	0	0	0	108.8	C324 S329 N330 I331	C324-D327 HydrophobicContact CB-CB 3.97Å; C324-D327 PolarHBondContact O-N 2.9Å; D327-S329 VanDerWaalsContact C-N 3.28Å; D327-S329 PolarHBondContact O-N 3.31Å; D327-S329 WeakPolarHBondContact OD1-CB 3.36Å; D327-S329 PolarHBondContact OD1-N 3.31Å; D327-S329 PolarHBondContact OD1-OG 3.24Å; D327-N330 HydrophobicContact CB-CB 3.92Å; D327-N330 PolarHBondContact O-N 3.04Å; D327-N330 PolarHBondContact OD1-N 3.26Å; D327-N330 VanDerWaalsContact OD1-N 3.17Å; D327-I331 PolarHBondContact O-N 2.74Å
328	T	97.2	Very high	94.8	Very high	43 Å²	43	36.9 Å²	36.9	26%	0.264	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-35.3	-177.7	-58.2	0	0	0	0	112	Q52 I55 I56 Q332	Q52-T328 PolarHBondContact NE2-OG1 2.8Å; Q52-T328 PolarHBondContact OE1-OG1 3.37Å; I55-T328 HydrophobicContact CG2-CG2 3.97Å; I56-T328 HydrophobicContact CD1-CG2 4.19Å; I56-T328 HydrophobicContact CG1-CG2 3.73Å; T328-Q332 VanDerWaalsContact O-CB 3.24Å; T328-Q332 WeakPolarHBondContact O-CB 3.46Å; T328-Q332 PolarHBondContact O-N 2.87Å
329	S	97	Very high	94.7	Very high	80 Å²	80	35.7 Å²	35.7	56%	0.559	19%	0.19	S	C	*	.	H	α-helix	trans	-68.4	-42	179.8	72.7	0	0	0	0	111.5	D327 F333	D327-S329 VanDerWaalsContact C-N 3.28Å; D327-S329 PolarHBondContact O-N 3.31Å; D327-S329 WeakPolarHBondContact OD1-CB 3.36Å; D327-S329 PolarHBondContact OD1-N 3.31Å; D327-S329 PolarHBondContact OD1-OG 3.24Å; S329-F333 WeakPolarHBondContact O-CB 3.48Å; S329-F333 PolarHBondContact O-N 3.38Å
330	N	97.3	Very high	94.4	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.08	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-47.1	176	173.7	-105.4	0	0	0	111.7	T323 C324 D327 F333 V334	T323-N330 WeakPolarHBondContact CA-OD1 3.4Å; C324-N330 PolarHBondContact N-OD1 3.47Å; D327-N330 HydrophobicContact CB-CB 3.92Å; D327-N330 PolarHBondContact O-N 3.04Å; D327-N330 PolarHBondContact OD1-N 3.26Å; D327-N330 VanDerWaalsContact OD1-N 3.17Å; N330-F333 PolarHBondContact O-N 3.25Å; N330-V334 WeakPolarHBondContact O-CG2 3.21Å; N330-V334 PolarHBondContact O-N 3.35Å
331	I	97.1	Very high	93.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-40.2	179.4	-67.7	-59.6	0	0	0	111.7	I49 Q52 M53 I56 F266 T323 D327 V334 F335	I49-I331 HydrophobicContact CG1-CD1 4.46Å; Q52-I331 HydrophobicContact CB-CB 4.43Å; Q52-I331 HydrophobicContact CB-CG2 3.81Å; Q52-I331 HydrophobicContact CG-CB 4.36Å; Q52-I331 HydrophobicContact CG-CG1 4.26Å; Q52-I331 HydrophobicContact CG-CG2 4.22Å; M53-I331 HydrophobicContact CE-CG2 3.68Å; I56-I331 HydrophobicContact CD1-CB 4.39Å; I56-I331 HydrophobicContact CD1-CG2 3.93Å; F266-I331 HydrophobicContact CE2-CD1 4.48Å; T323-I331 HydrophobicContact CG2-CD1 4.18Å; D327-I331 PolarHBondContact O-N 2.74Å; I331-V334 PolarHBondContact O-N 2.95Å; I331-F335 WeakPolarHBondContact O-CB 3.38Å; I331-F335 PolarHBondContact O-N 3.22Å
332	Q	95.4	Very high	93	Very high	106 Å²	106	34.8 Å²	34.8	50%	0.495	19%	0.191	S	C	.	.	H	α-helix	trans	-60.1	-47.8	175.8	-174.7	172.8	10	0	0	111.4	I56 T328 D336	I56-Q332 HydrophobicContact CD1-CB 3.92Å; I56-Q332 HydrophobicContact CG1-CB 4.43Å; I56-Q332 HydrophobicContact CG2-CB 4.3Å; I56-Q332 HydrophobicContact CG2-CG 3.89Å; T328-Q332 VanDerWaalsContact O-CB 3.24Å; T328-Q332 WeakPolarHBondContact O-CB 3.46Å; T328-Q332 PolarHBondContact O-N 2.87Å; Q332-D336 VanDerWaalsContact O-CB 3.29Å; Q332-D336 WeakPolarHBondContact O-CB 3.16Å; Q332-D336 PolarHBondContact O-N 3.38Å
333	F	94.6	Very high	92.1	Very high	146 Å²	146	35.6 Å²	35.6	64%	0.64	20%	0.196	S	C	*	.	H	α-helix	trans	-61.6	-47.6	178.7	175.7	-97	0	0	0	112.6	S329 N330 D336 A337	S329-F333 WeakPolarHBondContact O-CB 3.48Å; S329-F333 PolarHBondContact O-N 3.38Å; N330-F333 PolarHBondContact O-N 3.25Å; F333-D336 PolarHBondContact O-N 2.9Å; F333-A337 PolarHBondContact O-N 3.03Å
334	V	93.4	Very high	91.2	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-41.8	-178.7	172.6	0	0	0	0	111	F266 H321 T323 N330 I331 D336 A337 V338	F266-V334 HydrophobicContact CD1-CG1 4.21Å; F266-V334 HydrophobicContact CE1-CG1 3.39Å; F266-V334 HydrophobicContact CZ-CG1 3.6Å; H321-V334 HydrophobicContact CB-CG1 3.55Å; H321-V334 HydrophobicContact CB-CG2 4.15Å; T323-V334 HydrophobicContact CG2-CB 4.28Å; T323-V334 HydrophobicContact CG2-CG1 3.98Å; T323-V334 HydrophobicContact CG2-CG2 4.07Å; N330-V334 WeakPolarHBondContact O-CG2 3.21Å; N330-V334 PolarHBondContact O-N 3.35Å; I331-V334 PolarHBondContact O-N 2.95Å; V334-D336 VanDerWaalsContact C-N 3.32Å; V334-D336 PolarHBondContact O-N 3.21Å; V334-A337 PolarHBondContact O-N 3.04Å; V334-V338 HydrophobicContact CG1-CG2 4.3Å; V334-V338 WeakPolarHBondContact O-CB 3.21Å; V334-V338 WeakPolarHBondContact O-CG2 3.19Å; V334-V338 PolarHBondContact O-N 2.96Å
335	F	91.9	Very high	90.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-33.2	180	-163.6	-95.3	0	0	0	112.4	L36 M53 H57 F188 F190 I195 M197 I221 I331 V338 T339	L36-F335 HydrophobicContact CD1-CE2 3.86Å; L36-F335 HydrophobicContact CD1-CZ 3.64Å; M53-F335 HydrophobicContact CE-CB 4.34Å; M53-F335 HydrophobicContact CE-CD1 4.39Å; M53-F335 HydrophobicContact CE-CD2 4.08Å; M53-F335 HydrophobicContact CE-CG 4Å; M53-F335 HydrophobicContact SD-CD1 3.94Å; M53-F335 HydrophobicContact SD-CD2 3.89Å; M53-F335 HydrophobicContact SD-CE1 3.84Å; M53-F335 HydrophobicContact SD-CE2 3.78Å; M53-F335 HydrophobicContact SD-CG 3.97Å; M53-F335 HydrophobicContact SD-CZ 3.76Å; H57-F335 AromaticContact NE2-CD1 3.93Å; F188-F335 AromaticContact CE2-CE1 3.84Å; F188-F335 HydrophobicContact CE2-CE1 3.84Å; F188-F335 AromaticContact CE2-CZ 3.98Å; F188-F335 HydrophobicContact CE2-CZ 3.98Å; F188-F335 HydrophobicContact CZ-CE1 4.06Å; F188-F335 AromaticContact CZ-CZ 3.72Å; F188-F335 HydrophobicContact CZ-CZ 3.72Å; F190-F335 HydrophobicContact CD1-CD1 4.05Å; F190-F335 AromaticContact CD1-CE1 3.86Å; F190-F335 HydrophobicContact CD1-CE1 3.86Å; F190-F335 HydrophobicContact CE1-CD1 4Å; F190-F335 HydrophobicContact CE1-CE1 4.26Å; I195-F335 HydrophobicContact CD1-CE1 4.01Å; I195-F335 HydrophobicContact CD1-CZ 4.07Å; M197-F335 HydrophobicContact CE-CE2 3.72Å; M197-F335 HydrophobicContact CE-CZ 4.08Å; I221-F335 HydrophobicContact CD1-CD2 4.46Å; I221-F335 HydrophobicContact CD1-CE2 3.99Å; I331-F335 WeakPolarHBondContact O-CB 3.38Å; I331-F335 PolarHBondContact O-N 3.22Å; F335-V338 PolarHBondContact O-N 3.08Å; F335-T339 WeakPolarHBondContact CE1-OG1 3.41Å; F335-T339 WeakPolarHBondContact O-CB 3.35Å; F335-T339 PolarHBondContact O-N 3.14Å; F335-T339 PolarHBondContact O-OG1 2.94Å
336	D	92.1	Very high	89	Confident	57 Å²	57	43.8 Å²	43.8	31%	0.305	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-51.6	172.6	-167.8	45.3	0	0	0	111.5	F190 K191 Q332 F333 V334 V338 T339 D340	F190-D336 HydrophobicContact CZ-CB 4.38Å; F190-D336 WeakPolarHBondContact CZ-OD1 3.5Å; K191-D336 WeakPolarHBondContact CE-OD1 3.18Å; K191-D336 IonicContact NZ-OD1 3.38Å; K191-D336 PolarHBondContact NZ-OD1 3.48Å; K191-D336 IonicContact NZ-OD2 3.25Å; Q332-D336 VanDerWaalsContact O-CB 3.29Å; Q332-D336 WeakPolarHBondContact O-CB 3.16Å; Q332-D336 PolarHBondContact O-N 3.38Å; F333-D336 PolarHBondContact O-N 2.9Å; V334-D336 VanDerWaalsContact C-N 3.32Å; V334-D336 PolarHBondContact O-N 3.21Å; D336-V338 VanDerWaalsContact C-N 3.33Å; D336-V338 PolarHBondContact O-N 3.36Å; D336-T339 PolarHBondContact O-N 3.4Å; D336-D340 PolarHBondContact O-N 3.21Å; D336-D340 VanDerWaalsContact O-N 3.13Å
337	A	88.8	Confident	87.7	Confident	36 Å²	36	46 Å²	46	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-41.8	177.6	0	0	0	0	0	112.4	F333 V334 D340 V341	F333-A337 PolarHBondContact O-N 3.03Å; V334-A337 PolarHBondContact O-N 3.04Å; A337-D340 PolarHBondContact O-N 3Å; A337-V341 WeakPolarHBondContact O-CG2 3.46Å; A337-V341 PolarHBondContact O-N 2.8Å
338	V	87.1	Confident	86.3	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-42.8	178.1	165	0	0	0	0	111.7	V264 F266 V334 F335 D336 D340 V341 I342	V264-V338 HydrophobicContact CB-CG1 4.36Å; V264-V338 HydrophobicContact CB-CG2 4.46Å; V264-V338 HydrophobicContact CG1-CB 4.42Å; V264-V338 HydrophobicContact CG1-CG1 4.09Å; V264-V338 HydrophobicContact CG1-CG2 3.44Å; V264-V338 VanDerWaalsContact CG1-CG2 3.44Å; V264-V338 HydrophobicContact CG2-CB 4.49Å; V264-V338 HydrophobicContact CG2-CG1 3.56Å; V264-V338 HydrophobicContact CG2-CG2 4.18Å; F266-V338 HydrophobicContact CE1-CG2 4.17Å; V334-V338 HydrophobicContact CG1-CG2 4.3Å; V334-V338 WeakPolarHBondContact O-CB 3.21Å; V334-V338 WeakPolarHBondContact O-CG2 3.19Å; V334-V338 PolarHBondContact O-N 2.96Å; F335-V338 PolarHBondContact O-N 3.08Å; D336-V338 VanDerWaalsContact C-N 3.33Å; D336-V338 PolarHBondContact O-N 3.36Å; V338-D340 VanDerWaalsContact C-N 3.3Å; V338-D340 PolarHBondContact O-N 3.32Å; V338-V341 WeakPolarHBondContact O-CB 3.48Å; V338-V341 PolarHBondContact O-N 2.84Å; V338-I342 HydrophobicContact CG1-CD1 3.62Å; V338-I342 HydrophobicContact CG1-CG1 4.35Å; V338-I342 VanDerWaalsContact O-CG1 3.31Å; V338-I342 WeakPolarHBondContact O-CG1 3.45Å; V338-I342 PolarHBondContact O-N 2.96Å
339	T	86.5	Confident	84.9	Confident	2 Å²	2	53 Å²	53	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-37.6	-179.6	-59.1	0	0	0	0	111.1	F190 F335 D336 V341 I342 I343	F190-T339 HydrophobicContact CD1-CG2 3.64Å; F190-T339 WeakPolarHBondContact CD1-OG1 3.22Å; F190-T339 HydrophobicContact CE1-CG2 3.82Å; F190-T339 WeakPolarHBondContact CE1-OG1 3.37Å; F335-T339 WeakPolarHBondContact CE1-OG1 3.41Å; F335-T339 WeakPolarHBondContact O-CB 3.35Å; F335-T339 PolarHBondContact O-N 3.14Å; F335-T339 PolarHBondContact O-OG1 2.94Å; D336-T339 PolarHBondContact O-N 3.4Å; T339-V341 VanDerWaalsContact C-N 3.29Å; T339-V341 PolarHBondContact O-N 3.37Å; T339-I342 PolarHBondContact O-N 3.16Å; T339-I343 HydrophobicContact CG2-CD1 3.69Å; T339-I343 HydrophobicContact CG2-CG1 4.11Å; T339-I343 WeakPolarHBondContact O-CB 3.5Å; T339-I343 VanDerWaalsContact O-CG1 3.29Å; T339-I343 WeakPolarHBondContact O-CG1 3.42Å; T339-I343 PolarHBondContact O-N 3.41Å
340	D	85.3	Confident	83	Confident	75 Å²	75	52 Å²	52	40%	0.401	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-37.3	176.8	-72.9	-14	0	0	0	112.2	K191 D336 A337 V338 K344	K191-D340 VanDerWaalsContact NZ-CG 3.26Å; K191-D340 IonicContact NZ-OD1 2.97Å; K191-D340 PolarHBondContact NZ-OD1 2.89Å; K191-D340 IonicContact NZ-OD2 2.71Å; K191-D340 PolarHBondContact NZ-OD2 2.71Å; K191-D340 VanDerWaalsContact NZ-OD2 3.16Å; D336-D340 PolarHBondContact O-N 3.21Å; D336-D340 VanDerWaalsContact O-N 3.13Å; A337-D340 PolarHBondContact O-N 3Å; V338-D340 VanDerWaalsContact C-N 3.3Å; V338-D340 PolarHBondContact O-N 3.32Å; D340-K344 VanDerWaalsContact O-CB 3.27Å; D340-K344 WeakPolarHBondContact O-CB 3.32Å; D340-K344 PolarHBondContact O-N 3.37Å
341	V	81.6	Confident	81.1	Confident	37 Å²	37	54.2 Å²	54.2	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-46.2	173.3	174.2	0	0	0	0	111.2	Y319 A337 V338 T339 K344 N345	Y319-V341 HydrophobicContact CD1-CG1 4.31Å; Y319-V341 HydrophobicContact CD1-CG2 4.41Å; Y319-V341 HydrophobicContact CD2-CG1 4.04Å; Y319-V341 HydrophobicContact CE1-CG1 3.81Å; Y319-V341 HydrophobicContact CE1-CG2 4.23Å; Y319-V341 HydrophobicContact CE2-CG1 3.52Å; Y319-V341 HydrophobicContact CG-CG1 4.41Å; Y319-V341 VanDerWaalsContact CZ-CG1 3.4Å; A337-V341 WeakPolarHBondContact O-CG2 3.46Å; A337-V341 PolarHBondContact O-N 2.8Å; V338-V341 WeakPolarHBondContact O-CB 3.48Å; V338-V341 PolarHBondContact O-N 2.84Å; T339-V341 VanDerWaalsContact C-N 3.29Å; T339-V341 PolarHBondContact O-N 3.37Å; V341-K344 PolarHBondContact O-N 2.85Å; V341-N345 PolarHBondContact O-N 3.01Å
342	I	81.4	Confident	79	Confident	8 Å²	8	59.9 Å²	59.9	4%	0.041	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-45.8	-179.7	-67.5	168	0	0	0	110.9	L36 T218 A219 V338 T339 K344 N345 N346	L36-I342 HydrophobicContact CD2-CD1 3.72Å; T218-I342 HydrophobicContact CG2-CG2 3.74Å; A219-I342 HydrophobicContact CB-CD1 3.67Å; A219-I342 HydrophobicContact CB-CG1 3.88Å; V338-I342 HydrophobicContact CG1-CD1 3.62Å; V338-I342 HydrophobicContact CG1-CG1 4.35Å; V338-I342 VanDerWaalsContact O-CG1 3.31Å; V338-I342 WeakPolarHBondContact O-CG1 3.45Å; V338-I342 PolarHBondContact O-N 2.96Å; T339-I342 PolarHBondContact O-N 3.16Å; I342-K344 VanDerWaalsContact C-N 3.33Å; I342-K344 PolarHBondContact O-N 3.41Å; I342-N345 PolarHBondContact O-N 3.47Å; I342-N346 WeakPolarHBondContact O-CB 3.4Å; I342-N346 PolarHBondContact O-N 3.44Å
343	I	80.3	Confident	76.4	Confident	45 Å²	45	65 Å²	65	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-45.7	176.3	-70.2	171.9	0	0	0	109.9	K191 L193 T339 N345 N346 L347	K191-I343 HydrophobicContact CB-CD1 4.37Å; L193-I343 HydrophobicContact CD2-CG1 4.13Å; T339-I343 HydrophobicContact CG2-CD1 3.69Å; T339-I343 HydrophobicContact CG2-CG1 4.11Å; T339-I343 WeakPolarHBondContact O-CB 3.5Å; T339-I343 VanDerWaalsContact O-CG1 3.29Å; T339-I343 WeakPolarHBondContact O-CG1 3.42Å; T339-I343 PolarHBondContact O-N 3.41Å; I343-N345 VanDerWaalsContact C-N 3.33Å; I343-N345 PolarHBondContact O-N 3.16Å; I343-N346 PolarHBondContact O-N 3.42Å; I343-L347 HydrophobicContact CG2-CD1 3.92Å; I343-L347 HydrophobicContact CG2-CG 4.35Å; I343-L347 WeakPolarHBondContact O-CB 3.4Å; I343-L347 VanDerWaalsContact O-CG 3.26Å; I343-L347 WeakPolarHBondContact O-CG 3.28Å; I343-L347 PolarHBondContact O-N 2.99Å
344	K	78.3	Confident	75.5	Confident	116 Å²	116	61 Å²	61	50%	0.504	33%	0.328	S	S	.	.	H	α-helix	trans	-61	-40.6	179.1	-174.7	179.1	-178.5	-179.9	0	112.4	D340 V341 I342 L347 K348	D340-K344 VanDerWaalsContact O-CB 3.27Å; D340-K344 WeakPolarHBondContact O-CB 3.32Å; D340-K344 PolarHBondContact O-N 3.37Å; V341-K344 PolarHBondContact O-N 2.85Å; I342-K344 VanDerWaalsContact C-N 3.33Å; I342-K344 PolarHBondContact O-N 3.41Å; K344-L347 PolarHBondContact O-N 2.78Å; K344-K348 WeakPolarHBondContact O-CG 3.4Å; K344-K348 PolarHBondContact O-N 3.29Å; K344-K348 VanDerWaalsContact O-N 3.09Å
345	N	76.1	Confident	74.6	Confident	24 Å²	24	63.9 Å²	63.9	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-70.2	-45.7	178.5	-72.6	-8.6	0	0	0	111.5	S262 V341 I342 I343 L347 K348 D349	S262-N345 PolarHBondContact OG-ND2 3.48Å; S262-N345 VanDerWaalsContact OG-ND2 3.16Å; V341-N345 PolarHBondContact O-N 3.01Å; I342-N345 PolarHBondContact O-N 3.47Å; I343-N345 VanDerWaalsContact C-N 3.33Å; I343-N345 PolarHBondContact O-N 3.16Å; N345-L347 PolarHBondContact O-N 3.34Å; N345-K348 WeakPolarHBondContact O-CB 3.32Å; N345-K348 PolarHBondContact O-N 2.71Å; N345-K348 VanDerWaalsContact O-N 3.07Å; N345-D349 PolarHBondContact O-N 2.95Å
346	N	72.4	Confident	73.6	Confident	45 Å²	45	67.5 Å²	67.5	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-55.5	-39.2	173.1	-80.6	-21.9	0	0	0	112.5	T218 I342 I343 C350	T218-N346 WeakPolarHBondContact CG2-ND2 3.47Å; T218-N346 WeakPolarHBondContact CG2-OD1 3.19Å; I342-N346 WeakPolarHBondContact O-CB 3.4Å; I342-N346 PolarHBondContact O-N 3.44Å; I343-N346 PolarHBondContact O-N 3.42Å; N346-C350 PolarHBondContact O-SG 3.1Å
347	L	70.1	Confident	72.5	Confident	68 Å²	68	68.1 Å²	68.1	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-70.1	-35.7	177.3	-72.7	175.9	0	0	0	113.3	I343 K344 N345 C350 I352	I343-L347 HydrophobicContact CG2-CD1 3.92Å; I343-L347 HydrophobicContact CG2-CG 4.35Å; I343-L347 WeakPolarHBondContact O-CB 3.4Å; I343-L347 VanDerWaalsContact O-CG 3.26Å; I343-L347 WeakPolarHBondContact O-CG 3.28Å; I343-L347 PolarHBondContact O-N 2.99Å; K344-L347 PolarHBondContact O-N 2.78Å; N345-L347 PolarHBondContact O-N 3.34Å; L347-C350 PolarHBondContact O-N 3.48Å; L347-I352 HydrophobicContact CD2-CD1 4.36Å; L347-I352 PolarHBondContact O-N 3.4Å
348	K	69.1	Low	71.5	Confident	110 Å²	110	70.1 Å²	70.1	48%	0.478	37%	0.371	S	S	.	.	H	α-helix	trans	-67	-44.9	176.1	-78.6	176.4	176.3	-179.3	0	112	K344 N345 C350 G351	K344-K348 WeakPolarHBondContact O-CG 3.4Å; K344-K348 PolarHBondContact O-N 3.29Å; K344-K348 VanDerWaalsContact O-N 3.09Å; N345-K348 WeakPolarHBondContact O-CB 3.32Å; N345-K348 PolarHBondContact O-N 2.71Å; N345-K348 VanDerWaalsContact O-N 3.07Å; K348-C350 PolarHBondContact O-N 2.94Å; K348-C350 VanDerWaalsContact O-N 3.1Å; K348-G351 PolarHBondContact O-N 2.74Å
349	D	66.7	Low	70.5	Confident	138 Å²	138	74.7 Å²	74.7	74%	0.738	40%	0.395	S	S	*	.	H	α-helix	trans	-61.6	-21.7	179.5	-65.4	-19.8	0	0	0	111.9	N345	N345-D349 PolarHBondContact O-N 2.95Å
350	C	57.2	Low	69.3	Low	57 Å²	57	79.9 Å²	79.9	39%	0.385	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-2.7	176.7	-63.5	0	0	0	0	114.8	N346 L347 K348 I352	N346-C350 PolarHBondContact O-SG 3.1Å; L347-C350 PolarHBondContact O-N 3.48Å; K348-C350 PolarHBondContact O-N 2.94Å; K348-C350 VanDerWaalsContact O-N 3.1Å; C350-I352 VanDerWaalsContact C-N 3.3Å; C350-I352 HydrophobicContact CB-CD1 4.03Å; C350-I352 HydrophobicContact CB-CG1 4.1Å; C350-I352 PolarHBondContact O-N 2.74Å
351	G	56.8	Low	68.1	Low	62 Å²	62	80.2 Å²	80.2	64%	0.639	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	22.2	-178.2	0	0	0	0	0	114.8	K348	K348-G351 PolarHBondContact O-N 2.74Å
352	I	53.2	Low	67	Low	120 Å²	120	83.8 Å²	83.8	62%	0.615	44%	0.441	S	S	*	.			trans	-85.5	1.8	177.8	-59.9	174.3	0	0	0	111.3	L347 C350	L347-I352 HydrophobicContact CD2-CD1 4.36Å; L347-I352 PolarHBondContact O-N 3.4Å; C350-I352 VanDerWaalsContact C-N 3.3Å; C350-I352 HydrophobicContact CB-CD1 4.03Å; C350-I352 HydrophobicContact CB-CG1 4.1Å; C350-I352 PolarHBondContact O-N 2.74Å
353	F	41.8	Very low	65.6	Low	213 Å²	213	90.7 Å²	90.7	93%	0.934	48%	0.477	S	S	*	.			trans	-123.3	0	176.8	-117.2	-78.5	0	0	0	113.4

Retrieved 353 of 353 residues in 197 ms (Link to these results)

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