A0A077ZG59_TRITR Loading...

60S ribosomal protein L3

The L3 protein is a component of the large subunit of cytoplasmic ribosomes.

AlphaFold DB , UniProt , Accession A0A077ZG59, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	S	89.2	Confident	95.2	Very high	175 Å²	175	123.5 Å²	123.5	100%	1.224	66%	0.658	S	S	*	*				0	136.5	0	-175.3	0	0	0	0	110.3
2	H	94.2	Very high	95.4	Very high	164 Å²	164	123.6 Å²	123.6	76%	0.759	65%	0.651	S	S	*	*			trans	-93.6	172.4	176.2	63.9	-87	0	0	0	110.6	K4	H2-K4 PolarHBondContact O-N 3.46Å
3	R	94.3	Very high	95.5	Very high	165 Å²	165	118.7 Å²	118.7	62%	0.623	63%	0.629	S	S	*	*			trans	-69.4	123	177.3	-176.5	-175.9	177.5	-169.6	-8.1	110.1	F5	R3-F5 VanDerWaalsContact C-N 3.25Å; R3-F5 WeakPolarHBondContact CD-O 3.42Å; R3-F5 VanDerWaalsContact CG-O 3.3Å; R3-F5 WeakPolarHBondContact CG-O 3.47Å; R3-F5 PolarHBondContact NE-O 3.2Å; R3-F5 PolarHBondContact O-N 2.94Å; R3-F5 VanDerWaalsContact O-N 3.11Å
4	K	96.6	Very high	95.6	Very high	177 Å²	177	114.4 Å²	114.4	77%	0.77	63%	0.627	S	S	*	*	S	Bend	trans	-49.8	-38.1	-179.1	-173.3	173.6	-178.5	172.3	0	114.9	H2	H2-K4 PolarHBondContact O-N 3.46Å
5	F	97	Very high	95.7	Very high	148 Å²	148	113.3 Å²	113.3	65%	0.649	61%	0.613	S	S	*	*	S	Bend	trans	-129.4	128.3	177.6	-60.2	-74.6	0	0	0	111.3	R3	R3-F5 VanDerWaalsContact C-N 3.25Å; R3-F5 WeakPolarHBondContact CD-O 3.42Å; R3-F5 VanDerWaalsContact CG-O 3.3Å; R3-F5 WeakPolarHBondContact CG-O 3.47Å; R3-F5 PolarHBondContact NE-O 3.2Å; R3-F5 PolarHBondContact O-N 2.94Å; R3-F5 VanDerWaalsContact O-N 3.11Å
6	S	96.1	Very high	95.8	Very high	124 Å²	124	109.6 Å²	109.6	87%	0.867	59%	0.593	S	S	*	*			trans	-68.9	144.2	173.8	-69.9	0	0	0	0	111.4
7	A	95.4	Very high	95.9	Very high	48 Å²	48	108.5 Å²	108.5	40%	0.397	59%	0.593	S	S	.	*			trans	-148.8	149.8	167.9	0	0	0	0	0	109.5
8	P	97.2	Very high	96	Very high	118 Å²	118	104 Å²	104	77%	0.766	57%	0.566	S	S	*	*			trans	-56.8	150.1	174.1	-24.3	34	0	0	0	112
9	R	95.7	Very high	96.1	Very high	123 Å²	123	105.1 Å²	105.1	46%	0.464	57%	0.565	S	S	.	*			trans	-67.4	134.9	177.3	177.1	173.4	169.2	65.2	18.5	111.3	G11 V13 T264	R9-G11 PolarHBondContact O-N 3.18Å; R9-G11 VanDerWaalsContact O-N 3.14Å; R9-V13 VanDerWaalsContact NE-CG1 3.28Å; R9-T264 PolarHBondContact NH1-O 3.07Å; R9-T264 PolarHBondContact NH2-O 2.63Å
10	H	96.9	Very high	96.2	Very high	86 Å²	86	107.9 Å²	107.9	40%	0.398	57%	0.567	S	S	.	*	S	Bend	trans	-71.8	108.7	174.3	-69.6	-68.8	0	0	0	112	W234 H235 T236	H10-W234 VanDerWaalsContact O-CE3 3.31Å; H10-H235 PolarHBondContact CE1-O 3.26Å; H10-H235 PolarHBondContact ND1-O 3.44Å; H10-H235 VanDerWaalsContact ND1-O 3.14Å; H10-T236 HydrophobicContact CB-CG2 4.19Å
11	G	95.2	Very high	96.3	Very high	31 Å²	31	103.9 Å²	103.9	32%	0.32	55%	0.548	S	S	.	.	S	Bend	trans	82.8	138.6	170.9	0	0	0	0	0	115	R9	R9-G11 PolarHBondContact O-N 3.18Å; R9-G11 VanDerWaalsContact O-N 3.14Å
12	H	96.9	Very high	96.6	Very high	124 Å²	124	105 Å²	105	57%	0.574	53%	0.531	S	S	*	.			trans	-72.1	129.6	-178.1	-172.2	-80.2	0	0	0	112.7	G14 F15	H12-G14 PolarHBondContact CE1-N 3.45Å; H12-G14 PolarHBondContact ND1-N 3.16Å; H12-F15 HydrophobicContact CB-CD2 3.94Å; H12-F15 HydrophobicContact CB-CE2 4.37Å; H12-F15 AromaticContact CG-CD2 3.93Å; H12-F15 AromaticContact ND1-CD2 3.52Å; H12-F15 AromaticContact ND1-CE2 3.84Å
13	V	96.6	Very high	96.7	Very high	60 Å²	60	103.5 Å²	103.5	36%	0.364	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-82.7	-24.5	-174.5	-69.9	0	0	0	0	114.1	R9 F15 L16	R9-V13 VanDerWaalsContact NE-CG1 3.28Å; V13-F15 PolarHBondContact O-N 2.93Å; V13-L16 HydrophobicContact CB-CD1 4.34Å; V13-L16 HydrophobicContact CG1-CD1 4.4Å; V13-L16 VanDerWaalsContact O-CB 3.26Å; V13-L16 WeakPolarHBondContact O-CB 3.28Å; V13-L16 WeakPolarHBondContact O-CG 3.48Å; V13-L16 PolarHBondContact O-N 3.34Å
14	G	97.4	Very high	96.7	Very high	58 Å²	58	99 Å²	99	60%	0.598	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-65.3	-5.9	174.1	0	0	0	0	0	114.6	H12	H12-G14 PolarHBondContact CE1-N 3.45Å; H12-G14 PolarHBondContact ND1-N 3.16Å
15	F	97.2	Very high	96.7	Very high	98 Å²	98	92.4 Å²	92.4	43%	0.43	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-100.9	10.2	171.6	-69.3	-61.2	0	0	0	113.5	H12 V13 P17	H12-F15 HydrophobicContact CB-CD2 3.94Å; H12-F15 HydrophobicContact CB-CE2 4.37Å; H12-F15 AromaticContact CG-CD2 3.93Å; H12-F15 AromaticContact ND1-CD2 3.52Å; H12-F15 AromaticContact ND1-CE2 3.84Å; V13-F15 PolarHBondContact O-N 2.93Å; F15-P17 CarbonylContact O-C 3.59Å
16	L	97.2	Very high	96.7	Very high	55 Å²	55	85.3 Å²	85.3	29%	0.288	44%	0.444	S	S	.	.			trans	-74.7	146.1	162.2	-68.3	176	0	0	0	109.5	V13 K18 W234 Y263	V13-L16 HydrophobicContact CB-CD1 4.34Å; V13-L16 HydrophobicContact CG1-CD1 4.4Å; V13-L16 VanDerWaalsContact O-CB 3.26Å; V13-L16 WeakPolarHBondContact O-CB 3.28Å; V13-L16 WeakPolarHBondContact O-CG 3.48Å; V13-L16 PolarHBondContact O-N 3.34Å; L16-K18 HydrophobicContact CD2-CG 4.24Å; L16-W234 HydrophobicContact CD2-CH2 3.79Å; L16-W234 HydrophobicContact CD2-CZ2 4.06Å; L16-W234 HydrophobicContact CG-CH2 4.4Å; L16-Y263 HydrophobicContact CD1-CD2 3.85Å; L16-Y263 HydrophobicContact CD1-CE2 4.33Å
17	P	97.4	Very high	96.7	Very high	90 Å²	90	84.1 Å²	84.1	58%	0.584	42%	0.423	S	S	*	.	S	Bend	cis	-74.5	133.9	-5.8	29.3	-34.2	0	0	0	113	F15 K19	F15-P17 CarbonylContact O-C 3.59Å; P17-K19 VanDerWaalsContact C-N 3.27Å; P17-K19 HydrophobicContact CB-CD 4.32Å; P17-K19 HydrophobicContact CB-CG 4.35Å; P17-K19 HydrophobicContact CG-CD 4.16Å; P17-K19 HydrophobicContact CG-CG 4.33Å; P17-K19 PolarHBondContact O-N 2.92Å
18	K	97	Very high	96.9	Very high	28 Å²	28	82.3 Å²	82.3	12%	0.122	41%	0.407	C	S	.	.			trans	-81.1	68.4	173.7	-74	-179.4	178.7	178.9	0	111.5	L16 R233 W234	L16-K18 HydrophobicContact CD2-CG 4.24Å; K18-R233 PolarHBondContact O-NH2 3.41Å; K18-W234 HydrophobicContact CD-CH2 3.91Å; K18-W234 HydrophobicContact CD-CZ2 3.73Å; K18-W234 HydrophobicContact CD-CZ3 4.48Å
19	K	97.8	Very high	96.9	Very high	124 Å²	124	84.2 Å²	84.2	54%	0.539	40%	0.403	S	S	.	.			trans	-116.1	164.2	178.9	67.1	-177	178.8	-170.3	0	112	P17 S21 H274	P17-K19 VanDerWaalsContact C-N 3.27Å; P17-K19 HydrophobicContact CB-CD 4.32Å; P17-K19 HydrophobicContact CB-CG 4.35Å; P17-K19 HydrophobicContact CG-CD 4.16Å; P17-K19 HydrophobicContact CG-CG 4.33Å; P17-K19 PolarHBondContact O-N 2.92Å; K19-S21 PolarHBondContact O-N 2.89Å; K19-H274 PolarHBondContact O-CD2 2.7Å
20	R	98.4	Very high	97	Very high	162 Å²	162	81.5 Å²	81.5	61%	0.611	40%	0.403	S	S	*	.			trans	-56.2	135	172.8	-71	179.2	67.2	169.9	-2	110	K22 Q270 Y273	R20-K22 PolarHBondContact O-N 3.44Å; R20-Q270 HydrophobicContact CG-CG 3.8Å; R20-Y273 CarbonylContact C-O 3.49Å; R20-Y273 HydrophobicContact CB-CD1 3.83Å; R20-Y273 HydrophobicContact CB-CE1 4.48Å; R20-Y273 HydrophobicContact CG-CD1 4.08Å
21	S	97.9	Very high	97	Very high	23 Å²	23	78.5 Å²	78.5	16%	0.161	39%	0.389	C	S	.	.			trans	-60.5	133.3	171.7	-178.6	0	0	0	0	109.4	K19 R23 Y273	K19-S21 PolarHBondContact O-N 2.89Å; S21-R23 WeakPolarHBondContact CB-O 3.39Å; S21-R23 PolarHBondContact O-N 3.14Å; S21-R23 PolarHBondContact OG-N 2.83Å; S21-R23 PolarHBondContact OG-O 2.76Å; S21-Y273 WeakPolarHBondContact CB-O 3.36Å; S21-Y273 PolarHBondContact N-O 2.81Å; S21-Y273 WeakPolarHBondContact O-CE1 3.47Å
22	K	97.1	Very high	97.1	Very high	199 Å²	199	77.9 Å²	77.9	87%	0.865	38%	0.379	S	S	*	.	S	Bend	trans	-66.4	-26.9	176	-67.9	-171.9	175.1	-172.4	0	112.5	R20	R20-K22 PolarHBondContact O-N 3.44Å
23	R	95.2	Very high	97.1	Very high	132 Å²	132	81.6 Å²	81.6	50%	0.498	39%	0.393	S	S	.	.	S	Bend	trans	-114.1	142.5	-179.8	-63.3	-177.5	-178.3	-166.9	-1.6	109.6	S21 V221	S21-R23 WeakPolarHBondContact CB-O 3.39Å; S21-R23 PolarHBondContact O-N 3.14Å; S21-R23 PolarHBondContact OG-N 2.83Å; S21-R23 PolarHBondContact OG-O 2.76Å; R23-V221 WeakPolarHBondContact O-CG2 3.47Å
24	H	94.5	Very high	97.2	Very high	71 Å²	71	81 Å²	81	33%	0.329	39%	0.388	S	S	.	.	S	Bend	trans	-70.6	-36.9	174.3	-172.2	89.4	0	0	0	112.2	V221 R337	H24-V221 VanDerWaalsContact O-CG2 3.24Å; H24-V221 WeakPolarHBondContact O-CG2 3.41Å; H24-R337 PolarHBondContact CE1-NH1 2.63Å; H24-R337 WeakPolarHBondContact NE2-CD 3.11Å
25	R	96.3	Very high	97.1	Very high	38 Å²	38	80.6 Å²	80.6	14%	0.143	37%	0.373	C	S	.	.	S	Bend	trans	-83.1	146.1	175.1	-166.9	-166.2	67.8	-138.9	5.5	111.3	K27 I179 M180 V338 T340	R25-K27 PolarHBondContact O-N 3.34Å; R25-I179 VanDerWaalsContact NH1-C 3.26Å; R25-I179 PolarHBondContact NH1-O 2.99Å; R25-M180 VanDerWaalsContact CZ-CB 3.49Å; R25-V338 HydrophobicContact CB-CG1 3.84Å; R25-V338 HydrophobicContact CG-CG1 3.89Å; R25-V338 HydrophobicContact CG-CG2 4.07Å; R25-T340 WeakPolarHBondContact CD-OG1 3.34Å; R25-T340 WeakPolarHBondContact CG-OG1 3.43Å
26	G	96.6	Very high	97.1	Very high	0 Å²	0	80 Å²	80	0%	0	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-54.3	121.1	160.3	0	0	0	0	0	111.6	T340	G26-T340 PolarHBondContact O-OG1 3.27Å
27	K	97.6	Very high	97.1	Very high	98 Å²	98	82.2 Å²	82.2	43%	0.426	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-86	129.4	167.1	-174.5	-175	178.4	-177.1	0	107.9	R25 K29 H275	R25-K27 PolarHBondContact O-N 3.34Å; K27-K29 PolarHBondContact O-N 3.42Å; K27-H275 PolarHBondContact N-NE2 3.1Å; K27-H275 PolarHBondContact O-NE2 2.97Å
28	V	98	Very high	97.1	Very high	10 Å²	10	83.1 Å²	83.1	6%	0.061	39%	0.393	C	S	.	.			trans	-69.2	111.6	164.2	-172	0	0	0	0	107.7	S30 F31 A44 M180 I219 T340 R342	V28-S30 WeakPolarHBondContact CG1-O 3.48Å; V28-F31 HydrophobicContact CB-CE1 3.92Å; V28-F31 HydrophobicContact CB-CE2 4.01Å; V28-F31 HydrophobicContact CB-CZ 3.64Å; V28-F31 HydrophobicContact CG1-CD1 3.7Å; V28-F31 HydrophobicContact CG1-CD2 3.94Å; V28-F31 HydrophobicContact CG1-CE1 3.59Å; V28-F31 HydrophobicContact CG1-CE2 3.81Å; V28-F31 HydrophobicContact CG1-CG 3.89Å; V28-F31 HydrophobicContact CG1-CZ 3.65Å; V28-F31 HydrophobicContact CG2-CE1 4.07Å; V28-F31 HydrophobicContact CG2-CZ 4.09Å; V28-A44 HydrophobicContact CG2-CB 4.48Å; V28-M180 HydrophobicContact CG2-CE 3.86Å; V28-I219 HydrophobicContact CB-CD1 4.41Å; V28-I219 HydrophobicContact CG1-CD1 4.33Å; V28-I219 HydrophobicContact CG2-CD1 4.08Å; V28-T340 HydrophobicContact CG2-CG2 3.49Å; V28-T340 VanDerWaalsContact CG2-CG2 3.49Å; V28-R342 HydrophobicContact CG1-CG 4.34Å
29	K	97.4	Very high	97.1	Very high	158 Å²	158	86.9 Å²	86.9	69%	0.687	42%	0.421	S	S	*	.			trans	-88.5	-25.6	179.2	-66	-176.7	-178.2	178	0	112.6	K27	K27-K29 PolarHBondContact O-N 3.42Å
30	S	97.8	Very high	97.1	Very high	66 Å²	66	82.6 Å²	82.6	46%	0.462	41%	0.405	S	S	.	.	S	Bend	trans	-141	133.7	178.2	-48.2	0	0	0	0	107.5	V28 R342	V28-S30 WeakPolarHBondContact CG1-O 3.48Å; S30-R342 VanDerWaalsContact O-CD 3.27Å; S30-R342 WeakPolarHBondContact O-CD 3.5Å; S30-R342 PolarHBondContact O-NH1 3.28Å
31	F	98.1	Very high	97.1	Very high	24 Å²	24	77.4 Å²	77.4	11%	0.105	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-97.6	163.8	171.4	-73.1	-85.3	0	0	0	109.4	V28 T43 A44 E181 Q183 L345	V28-F31 HydrophobicContact CB-CE1 3.92Å; V28-F31 HydrophobicContact CB-CE2 4.01Å; V28-F31 HydrophobicContact CB-CZ 3.64Å; V28-F31 HydrophobicContact CG1-CD1 3.7Å; V28-F31 HydrophobicContact CG1-CD2 3.94Å; V28-F31 HydrophobicContact CG1-CE1 3.59Å; V28-F31 HydrophobicContact CG1-CE2 3.81Å; V28-F31 HydrophobicContact CG1-CG 3.89Å; V28-F31 HydrophobicContact CG1-CZ 3.65Å; V28-F31 HydrophobicContact CG2-CE1 4.07Å; V28-F31 HydrophobicContact CG2-CZ 4.09Å; F31-T43 VanDerWaalsContact CD1-OG1 3.24Å; F31-T43 WeakPolarHBondContact CD1-OG1 3.48Å; F31-A44 HydrophobicContact CE1-CB 4.09Å; F31-E181 WeakPolarHBondContact CZ-O 3.27Å; F31-Q183 HydrophobicContact CB-CB 3.89Å; F31-Q183 HydrophobicContact CB-CG 4.43Å; F31-Q183 HydrophobicContact CD1-CB 3.69Å; F31-Q183 HydrophobicContact CD2-CB 3.86Å; F31-Q183 HydrophobicContact CE1-CB 4.12Å; F31-Q183 HydrophobicContact CE2-CB 4.29Å; F31-Q183 HydrophobicContact CG-CB 3.53Å; F31-Q183 HydrophobicContact CG-CG 4.48Å; F31-Q183 HydrophobicContact CZ-CB 4.4Å; F31-L345 VanDerWaalsContact C-CD2 3.41Å; F31-L345 WeakPolarHBondContact O-CD2 3.49Å
32	P	97.8	Very high	97.1	Very high	18 Å²	18	76.7 Å²	76.7	12%	0.117	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-53	147.8	170.9	-23.2	33.2	0	0	0	111.3	D34 T43 N185 K343 L345	P32-D34 PolarHBondContact O-N 3.29Å; P32-T43 HydrophobicContact CG-CG2 4.25Å; P32-N185 PolarHBondContact O-ND2 3.28Å; P32-K343 HydrophobicContact CG-CB 3.87Å; P32-L345 HydrophobicContact CG-CD2 4.36Å
33	K	96.5	Very high	97.2	Very high	201 Å²	201	67.2 Å²	67.2	87%	0.874	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-59.4	136.8	175.2	-170	177.9	177.8	-175.4	0	108.8	N185	K33-N185 PolarHBondContact O-ND2 3.26Å
34	D	97.2	Very high	97.4	Very high	47 Å²	47	60.9 Å²	60.9	25%	0.251	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-76.4	142.4	178.6	-170.1	22.7	0	0	0	110.5	P32 N185 G186 K192	P32-D34 PolarHBondContact O-N 3.29Å; D34-N185 VanDerWaalsContact OD1-CA 3.25Å; D34-N185 WeakPolarHBondContact OD1-CA 3.46Å; D34-N185 WeakPolarHBondContact OD1-CB 3.28Å; D34-G186 PolarHBondContact OD1-N 3.05Å; D34-K192 IonicContact OD1-NZ 2.92Å; D34-K192 PolarHBondContact OD1-NZ 3.26Å; D34-K192 IonicContact OD2-NZ 3.94Å; D34-K192 PolarHBondContact OD2-NZ 3.19Å
35	D	96.6	Very high	97.6	Very high	51 Å²	51	57.6 Å²	57.6	27%	0.273	30%	0.301	S	S	.	.			trans	-138.7	94.2	-175.6	178.2	-0.5	0	0	0	107.6	S37 K38 G186	D35-S37 PolarHBondContact O-N 3.31Å; D35-S37 VanDerWaalsContact O-N 3.09Å; D35-S37 PolarHBondContact OD1-N 2.66Å; D35-S37 PolarHBondContact OD1-OG 3.16Å; D35-K38 HydrophobicContact CB-CD 4.19Å; D35-K38 PolarHBondContact O-N 3.25Å; D35-K38 VanDerWaalsContact O-N 3.15Å; D35-K38 WeakPolarHBondContact OD2-CD 3.31Å; D35-K38 WeakPolarHBondContact OD2-CE 3.28Å; D35-K38 IonicContact OD2-NZ 3.2Å; D35-K38 PolarHBondContact OD2-NZ 3.42Å; D35-G186 WeakPolarHBondContact O-CA 3.42Å
36	P	96.7	Very high	97.7	Very high	84 Å²	84	55.8 Å²	55.8	55%	0.545	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.5	-173.8	-26	35.6	0	0	0	114.7	K38 G187	P36-K38 PolarHBondContact O-N 2.65Å; P36-G187 WeakPolarHBondContact O-CA 3.45Å; P36-G187 PolarHBondContact O-N 3Å; P36-G187 VanDerWaalsContact O-N 3.07Å
37	S	97.4	Very high	97.7	Very high	102 Å²	102	55.8 Å²	55.8	71%	0.713	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-19.6	178.5	71.2	0	0	0	0	113.6	D35	D35-S37 PolarHBondContact O-N 3.31Å; D35-S37 VanDerWaalsContact O-N 3.09Å; D35-S37 PolarHBondContact OD1-N 2.66Å; D35-S37 PolarHBondContact OD1-OG 3.16Å
38	K	97	Very high	97.8	Very high	109 Å²	109	51.2 Å²	51.2	47%	0.474	28%	0.275	S	S	.	.	S	Bend	trans	-86.3	154.3	-179.7	-72.2	176.6	-179.5	141.9	0	111.5	D35 P36 G186 G187	D35-K38 HydrophobicContact CB-CD 4.19Å; D35-K38 PolarHBondContact O-N 3.25Å; D35-K38 VanDerWaalsContact O-N 3.15Å; D35-K38 WeakPolarHBondContact OD2-CD 3.31Å; D35-K38 WeakPolarHBondContact OD2-CE 3.28Å; D35-K38 IonicContact OD2-NZ 3.2Å; D35-K38 PolarHBondContact OD2-NZ 3.42Å; P36-K38 PolarHBondContact O-N 2.65Å; K38-G186 CarbonylContact O-C 3.58Å; K38-G186 VanDerWaalsContact O-C 3.28Å; K38-G186 WeakPolarHBondContact O-CA 3.37Å; K38-G187 PolarHBondContact O-N 3.31Å
39	P	97.5	Very high	97.8	Very high	108 Å²	108	52.1 Å²	52.1	70%	0.701	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-59.9	151.6	171.5	26.6	-35.3	0	0	0	111.2	H41	P39-H41 PolarHBondContact O-N 3.47Å; P39-H41 PolarHBondContact O-ND1 3.31Å
40	V	98.1	Very high	97.8	Very high	33 Å²	33	44.7 Å²	44.7	20%	0.2	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-60.1	126.4	178.4	-175.4	0	0	0	0	110.2	V184 N185 D191 K192 W195	V40-V184 HydrophobicContact CG1-CG1 3.27Å; V40-N185 CarbonylContact C-O 3.57Å; V40-N185 WeakPolarHBondContact CA-O 2.87Å; V40-D191 HydrophobicContact CG2-CB 3.74Å; V40-K192 HydrophobicContact CG1-CG 4.45Å; V40-W195 HydrophobicContact CB-CB 4.37Å; V40-W195 HydrophobicContact CB-CG 4.16Å; V40-W195 HydrophobicContact CG1-CB 3.7Å; V40-W195 HydrophobicContact CG1-CD2 3.84Å; V40-W195 HydrophobicContact CG1-CE3 4.36Å; V40-W195 HydrophobicContact CG1-CG 3.51Å
41	H	98.1	Very high	97.8	Very high	54 Å²	54	42.2 Å²	42.2	25%	0.25	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160	-178	63.7	-79.4	0	0	0	113.2	P39 N185	P39-H41 PolarHBondContact O-N 3.47Å; P39-H41 PolarHBondContact O-ND1 3.31Å; H41-N185 PolarHBondContact N-O 2.82Å; H41-N185 PolarHBondContact ND1-O 2.84Å; H41-N185 PolarHBondContact O-N 2.98Å
42	L	98.4	Very high	97.8	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.5	172.9	-66.4	-174	0	0	0	112.2	V161 I182 V184 W195 I204 V209	L42-V161 HydrophobicContact CD2-CG2 3.6Å; L42-I182 HydrophobicContact CB-CG2 4.05Å; L42-I182 HydrophobicContact CD1-CD1 4.46Å; L42-I182 HydrophobicContact CD2-CB 4.42Å; L42-I182 HydrophobicContact CD2-CG2 3.91Å; L42-I182 HydrophobicContact CG-CG2 4.44Å; L42-V184 HydrophobicContact CD2-CG2 4.14Å; L42-W195 HydrophobicContact CD1-CH2 3.98Å; L42-W195 HydrophobicContact CD2-CH2 3.61Å; L42-W195 HydrophobicContact CD2-CZ3 3.64Å; L42-W195 HydrophobicContact CG-CH2 3.57Å; L42-W195 HydrophobicContact CG-CZ2 4.37Å; L42-W195 HydrophobicContact CG-CZ3 4.15Å; L42-I204 HydrophobicContact CD1-CD1 3.61Å; L42-I204 HydrophobicContact CD1-CG2 4.15Å; L42-V209 HydrophobicContact CB-CG1 3.98Å; L42-V209 HydrophobicContact CB-CG2 3.98Å; L42-V209 HydrophobicContact CD1-CG2 4.02Å
43	T	98.6	Very high	97.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.			trans	-113.9	-4.2	-173.5	55.7	0	0	0	0	114.6	F31 P32 Q183 N185 R342 K343	F31-T43 VanDerWaalsContact CD1-OG1 3.24Å; F31-T43 WeakPolarHBondContact CD1-OG1 3.48Å; P32-T43 HydrophobicContact CG-CG2 4.25Å; T43-Q183 WeakPolarHBondContact CG2-O 3.25Å; T43-Q183 PolarHBondContact N-O 2.59Å; T43-Q183 PolarHBondContact OG1-O 2.9Å; T43-N185 HydrophobicContact CG2-CB 3.89Å; T43-R342 CarbonylContact O-C 3.56Å; T43-R342 WeakPolarHBondContact O-CA 3.2Å; T43-K343 PolarHBondContact O-N 2.97Å
44	A	98.7	Very high	97.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	159.6	-177	0	0	0	0	0	112.2	V28 F31 M180 I182 L341	V28-A44 HydrophobicContact CG2-CB 4.48Å; F31-A44 HydrophobicContact CE1-CB 4.09Å; A44-M180 HydrophobicContact CB-CE 3.77Å; A44-I182 HydrophobicContact CB-CG1 4.35Å; A44-I182 HydrophobicContact CB-CG2 4.05Å; A44-I182 VanDerWaalsContact O-CD1 3.32Å; A44-I182 WeakPolarHBondContact O-CD1 3.46Å; A44-L341 CarbonylContact C-O 3.52Å; A44-L341 WeakPolarHBondContact CA-O 3.14Å; A44-L341 WeakPolarHBondContact CB-O 3.45Å
45	F	98.7	Very high	97.9	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	167.8	176.5	-156.7	-92	0	0	0	110.5	T80 M83 I204 I206 V209 F210 T340 L341	F45-T80 HydrophobicContact CD1-CG2 4.21Å; F45-T80 HydrophobicContact CE1-CG2 4.27Å; F45-M83 HydrophobicContact CD1-CG 4.37Å; F45-M83 HydrophobicContact CD1-SD 3.98Å; F45-M83 HydrophobicContact CD2-CG 4.28Å; F45-M83 HydrophobicContact CD2-SD 3.86Å; F45-M83 HydrophobicContact CE1-CG 3.9Å; F45-M83 HydrophobicContact CE1-SD 4.12Å; F45-M83 HydrophobicContact CE2-CB 3.96Å; F45-M83 HydrophobicContact CE2-CG 3.82Å; F45-M83 HydrophobicContact CE2-SD 4.03Å; F45-M83 HydrophobicContact CG-SD 3.84Å; F45-M83 HydrophobicContact CZ-CB 4.06Å; F45-M83 HydrophobicContact CZ-CG 3.61Å; F45-M83 HydrophobicContact CZ-SD 4.16Å; F45-I204 VanDerWaalsContact CE2-O 3.3Å; F45-I204 WeakPolarHBondContact CE2-O 3.41Å; F45-I204 WeakPolarHBondContact CZ-O 3.49Å; F45-I206 HydrophobicContact CB-CD1 3.57Å; F45-I206 HydrophobicContact CD1-CB 4.42Å; F45-I206 HydrophobicContact CD1-CD1 3.41Å; F45-I206 VanDerWaalsContact CD1-CD1 3.41Å; F45-I206 HydrophobicContact CD1-CG1 4.43Å; F45-I206 HydrophobicContact CD2-CD1 4.07Å; F45-I206 HydrophobicContact CE1-CB 4.22Å; F45-I206 HydrophobicContact CE1-CD1 4.07Å; F45-I206 HydrophobicContact CG-CD1 3.42Å; F45-I206 VanDerWaalsContact CG-CD1 3.42Å; F45-I206 HydrophobicContact CZ-CB 4.3Å; F45-V209 HydrophobicContact CD2-CB 4.49Å; F45-V209 HydrophobicContact CD2-CG2 3.94Å; F45-V209 HydrophobicContact CE2-CG2 4.49Å; F45-F210 HydrophobicContact CB-CD2 4.38Å; F45-F210 HydrophobicContact CB-CE2 3.7Å; F45-T340 CarbonylContact O-C 3.37Å; F45-T340 WeakPolarHBondContact O-CA 3.45Å; F45-L341 PolarHBondContact N-O 3.32Å; F45-L341 PolarHBondContact O-N 3Å
46	I	98.4	Very high	98	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.5	174.7	-62.3	-178.8	0	0	0	110.5	Y48 M83 T165 H178 M180 V338 I339	I46-Y48 HydrophobicContact CG2-CE2 4.4Å; I46-M83 HydrophobicContact CB-CE 4.38Å; I46-M83 HydrophobicContact CB-SD 3.84Å; I46-M83 HydrophobicContact CD1-CE 4.01Å; I46-M83 HydrophobicContact CG1-CE 4Å; I46-M83 HydrophobicContact CG1-SD 4Å; I46-M83 PolarHBondContact N-SD 3.27Å; I46-T165 HydrophobicContact CB-CG2 3.54Å; I46-T165 HydrophobicContact CD1-CG2 4Å; I46-T165 HydrophobicContact CG1-CG2 4.31Å; I46-T165 HydrophobicContact CG2-CG2 3.45Å; I46-T165 VanDerWaalsContact CG2-CG2 3.45Å; I46-H178 HydrophobicContact CD1-CB 4.1Å; I46-M180 HydrophobicContact CD1-CB 4.1Å; I46-M180 HydrophobicContact CD1-CG 3.73Å; I46-M180 HydrophobicContact CD1-SD 3.59Å; I46-M180 VanDerWaalsContact CD1-SD 3.59Å; I46-M180 HydrophobicContact CG1-CG 4.12Å; I46-M180 HydrophobicContact CG1-SD 3.33Å; I46-M180 WeakPolarHBondContact CG1-SD 3.43Å; I46-V338 HydrophobicContact CG2-CG2 3.19Å; I46-I339 WeakPolarHBondContact CA-O 2.74Å
47	G	98.1	Very high	98	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	171.8	167.6	0	0	0	0	0	112.8	E79 I339	G47-E79 CarbonylContact C-O 3.49Å; G47-E79 WeakPolarHBondContact CA-O 3.42Å; G47-I339 PolarHBondContact N-O 2.97Å; G47-I339 PolarHBondContact O-N 3.42Å
48	Y	98.1	Very high	97.9	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.3	177	-64	-87.4	0	0	0	109.6	I46 A50 L78 E79 P81 T165 M167 M170 H178 R337 V338	I46-Y48 HydrophobicContact CG2-CE2 4.4Å; Y48-A50 PolarHBondContact O-N 3.28Å; Y48-L78 CarbonylContact O-C 3.6Å; Y48-L78 VanDerWaalsContact O-CA 3.32Å; Y48-L78 WeakPolarHBondContact O-CA 3.27Å; Y48-E79 PolarHBondContact N-O 3.25Å; Y48-E79 PolarHBondContact O-N 2.94Å; Y48-P81 HydrophobicContact CD2-CG 4.21Å; Y48-P81 HydrophobicContact CE2-CG 3.96Å; Y48-T165 HydrophobicContact CE2-CG2 4.04Å; Y48-T165 WeakPolarHBondContact OH-CB 3.34Å; Y48-T165 WeakPolarHBondContact OH-CG2 3.08Å; Y48-T165 PolarHBondContact OH-OG1 3.27Å; Y48-M167 HydrophobicContact CE1-CE 4.47Å; Y48-M167 HydrophobicContact CE1-SD 3.93Å; Y48-M167 HydrophobicContact CE2-SD 4.19Å; Y48-M167 PolarHBondContact OH-SD 3.39Å; Y48-M170 HydrophobicContact CD2-CE 3.99Å; Y48-M170 HydrophobicContact CG-CE 4.24Å; Y48-H178 AromaticContact CE1-CE1 3.83Å; Y48-H178 AromaticContact CE1-ND1 3.71Å; Y48-H178 AromaticContact CZ-ND1 3.68Å; Y48-H178 PolarHBondContact OH-ND1 2.91Å; Y48-R337 WeakPolarHBondContact CA-O 3.29Å; Y48-V338 HydrophobicContact CD1-CB 4.16Å; Y48-V338 HydrophobicContact CE1-CB 3.82Å; Y48-V338 HydrophobicContact CE1-CG2 3.93Å
49	K	98.2	Very high	97.9	Very high	29 Å²	29	22.8 Å²	22.8	13%	0.126	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	110.1	-179.3	-175	171.5	177.5	-176.8	0	110.9	T76 L78 C331 G333 K335 K336 R337 I339	K49-T76 HydrophobicContact CD-CG2 4.04Å; K49-T76 HydrophobicContact CG-CG2 3.79Å; K49-L78 HydrophobicContact CB-CD2 3.75Å; K49-L78 HydrophobicContact CG-CD2 4.01Å; K49-C331 HydrophobicContact CD-CB 4.45Å; K49-C331 PolarHBondContact NZ-O 3.14Å; K49-G333 PolarHBondContact NZ-O 3.41Å; K49-K335 CarbonylContact O-C 3.42Å; K49-K335 VanDerWaalsContact O-CA 3.27Å; K49-K335 WeakPolarHBondContact O-CA 3.4Å; K49-K336 PolarHBondContact O-N 3.02Å; K49-R337 PolarHBondContact N-O 2.73Å; K49-I339 HydrophobicContact CB-CG1 4.23Å
50	A	97.4	Very high	97.7	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.008	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-59.8	178.5	0	0	0	0	0	110.8	Y48 V77 W314 Y317 V320 K335	Y48-A50 PolarHBondContact O-N 3.28Å; A50-V77 HydrophobicContact CB-CG1 4.41Å; A50-V77 PolarHBondContact N-O 3.03Å; A50-W314 HydrophobicContact CB-CD2 4.47Å; A50-W314 HydrophobicContact CB-CG 4.29Å; A50-Y317 HydrophobicContact CB-CD1 3.73Å; A50-Y317 HydrophobicContact CB-CD2 4.28Å; A50-Y317 HydrophobicContact CB-CE1 3.62Å; A50-Y317 HydrophobicContact CB-CE2 4.18Å; A50-Y317 HydrophobicContact CB-CG 4.06Å; A50-Y317 WeakPolarHBondContact O-CB 3.4Å; A50-V320 HydrophobicContact CB-CG2 3.47Å; A50-V320 VanDerWaalsContact CB-CG2 3.47Å; A50-K335 WeakPolarHBondContact O-CB 3.43Å
51	G	97.4	Very high	97.4	Very high	14 Å²	14	23 Å²	23	14%	0.144	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	-160.9	-179.4	0	0	0	0	0	111.6	T76 V77 W314	G51-T76 VanDerWaalsContact O-CG2 3.31Å; G51-T76 WeakPolarHBondContact O-CG2 3.33Å; G51-V77 PolarHBondContact O-N 2.81Å; G51-W314 VanDerWaalsContact CA-CE3 3.5Å
52	M	98.3	Very high	97.1	Very high	78 Å²	78	23.7 Å²	23.7	38%	0.384	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.7	-178	-179.4	170.6	-125.2	0	0	109.3	A74 V75 W314 G329 C330	M52-A74 HydrophobicContact CE-CB 3.97Å; M52-V75 CarbonylContact C-O 3.57Å; M52-V75 VanDerWaalsContact CA-O 3.28Å; M52-V75 WeakPolarHBondContact CA-O 3.38Å; M52-V75 VanDerWaalsContact CG-O 3.24Å; M52-V75 WeakPolarHBondContact CG-O 3.3Å; M52-W314 VanDerWaalsContact N-CZ3 3.26Å; M52-W314 WeakPolarHBondContact O-CZ3 3.12Å; M52-G329 WeakPolarHBondContact CE-O 3.45Å; M52-C330 VanDerWaalsContact CE-CA 3.45Å; M52-C330 HydrophobicContact CE-CB 4.04Å; M52-C330 VanDerWaalsContact CE-N 3.34Å
53	T	98.2	Very high	96.8	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.043	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	-171.7	172.5	-164.5	0	0	0	0	109.2	A74 V75 W314 I362 D363 K367	T53-A74 WeakPolarHBondContact O-CA 3.36Å; T53-V75 HydrophobicContact CG2-CG2 3.69Å; T53-V75 PolarHBondContact N-O 2.95Å; T53-V75 PolarHBondContact O-N 3.18Å; T53-V75 VanDerWaalsContact O-O 3.12Å; T53-W314 HydrophobicContact CG2-CH2 4.06Å; T53-I362 HydrophobicContact CG2-CG2 4.36Å; T53-D363 PolarHBondContact OG1-O 2.78Å; T53-K367 WeakPolarHBondContact OG1-CE 3.28Å; T53-K367 PolarHBondContact OG1-NZ 2.85Å
54	H	98.5	Very high	96.6	Very high	67 Å²	67	32.1 Å²	32.1	31%	0.31	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	159	169.2	64	-84.8	0	0	0	110.6	V72 E73 D363	H54-V72 HydrophobicContact CB-CG1 3.82Å; H54-E73 VanDerWaalsContact CA-O 3.32Å; H54-E73 WeakPolarHBondContact CA-O 3.36Å; H54-D363 VanDerWaalsContact CE1-CB 3.43Å; H54-D363 WeakPolarHBondContact CE1-CB 3.17Å; H54-D363 IonicContact CE1-OD1 3.42Å; H54-D363 IonicContact CE1-OD2 2.76Å; H54-D363 PolarHBondContact CE1-OD2 2.92Å; H54-D363 IonicContact ND1-OD2 2.74Å; H54-D363 PolarHBondContact ND1-OD2 3.42Å; H54-D363 IonicContact NE2-OD2 2.86Å; H54-D363 WeakPolarHBondContact O-CB 3.35Å; H54-D363 PolarHBondContact O-N 2.61Å
55	I	98.4	Very high	96.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	159.8	177	57.5	121.3	0	0	0	109.4	R57 V72 E73 V75 Y284 M326 L359 F361 I362	I55-R57 HydrophobicContact CD1-CB 3.82Å; I55-R57 HydrophobicContact CD1-CG 3.7Å; I55-V72 VanDerWaalsContact O-CA 3.28Å; I55-V72 WeakPolarHBondContact O-CA 3.32Å; I55-E73 HydrophobicContact CD1-CB 4.31Å; I55-E73 HydrophobicContact CG1-CB 4.26Å; I55-E73 WeakPolarHBondContact CG1-O 3.22Å; I55-E73 PolarHBondContact N-O 3.05Å; I55-E73 PolarHBondContact O-N 2.93Å; I55-V75 HydrophobicContact CG1-CG1 3.88Å; I55-V75 HydrophobicContact CG2-CG1 4.23Å; I55-V75 HydrophobicContact CG2-CG2 3.81Å; I55-Y284 HydrophobicContact CD1-CD2 3.72Å; I55-Y284 HydrophobicContact CD1-CE2 3.74Å; I55-Y284 HydrophobicContact CG1-CD2 4.25Å; I55-Y284 HydrophobicContact CG1-CE2 4.4Å; I55-M326 HydrophobicContact CG2-CE 4.06Å; I55-M326 HydrophobicContact CG2-SD 3.69Å; I55-L359 HydrophobicContact CB-CD2 4.28Å; I55-L359 HydrophobicContact CD1-CD2 3.44Å; I55-L359 VanDerWaalsContact CD1-CD2 3.44Å; I55-L359 HydrophobicContact CG1-CD2 4.27Å; I55-L359 HydrophobicContact CG2-CD2 4.45Å; I55-F361 CarbonylContact C-O 3.28Å; I55-F361 WeakPolarHBondContact CA-O 3.34Å; I55-F361 WeakPolarHBondContact CB-O 3.47Å; I55-I362 HydrophobicContact CG2-CB 4.47Å; I55-I362 HydrophobicContact CG2-CG1 3.99Å; I55-I362 HydrophobicContact CG2-CG2 4.45Å
56	V	98.3	Very high	96.3	Very high	24 Å²	24	44.5 Å²	44.5	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136	158.7	-174.6	0	0	0	0	108	E70 V71 V72 K360 F361	V56-E70 HydrophobicContact CG1-CB 3.81Å; V56-E70 HydrophobicContact CG1-CG 4.22Å; V56-V71 WeakPolarHBondContact CA-O 3.26Å; V56-V72 HydrophobicContact CG2-CG2 4.24Å; V56-K360 HydrophobicContact CB-CB 4.43Å; V56-K360 HydrophobicContact CG1-CB 4.32Å; V56-K360 PolarHBondContact O-N 3.47Å; V56-F361 HydrophobicContact CB-CB 3.86Å; V56-F361 HydrophobicContact CG2-CB 3.96Å; V56-F361 HydrophobicContact CG2-CD1 4.07Å; V56-F361 HydrophobicContact CG2-CG 4.46Å; V56-F361 PolarHBondContact N-O 3.06Å; V56-F361 PolarHBondContact O-N 3.48Å
57	R	96.9	Very high	96.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158	169.3	64.7	171.6	-151.9	98.9	-2.1	109.8	I55 E70 V71 E73 E355 E358 L359	I55-R57 HydrophobicContact CD1-CB 3.82Å; I55-R57 HydrophobicContact CD1-CG 3.7Å; R57-E70 WeakPolarHBondContact O-CA 3.43Å; R57-V71 HydrophobicContact CG-CG2 3.94Å; R57-V71 PolarHBondContact N-O 2.75Å; R57-V71 VanDerWaalsContact N-O 3.17Å; R57-V71 PolarHBondContact O-N 3.15Å; R57-E73 IonicContact CZ-OE2 3.9Å; R57-E73 IonicContact NE-OE2 2.8Å; R57-E73 PolarHBondContact NE-OE2 3.21Å; R57-E355 IonicContact CZ-OE1 2.87Å; R57-E355 IonicContact NH1-OE1 2.88Å; R57-E355 PolarHBondContact NH1-OE1 3.09Å; R57-E355 IonicContact NH2-OE1 2.62Å; R57-E355 PolarHBondContact NH2-OE1 2.99Å; R57-E355 IonicContact NH2-OE2 2.96Å; R57-E358 WeakPolarHBondContact CB-O 3.26Å; R57-L359 HydrophobicContact CB-CD2 4.36Å
58	E	95.6	Very high	96	Very high	51 Å²	51	52.4 Å²	52.4	24%	0.238	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142.3	165.9	-168.2	172.1	128.4	0	0	110.5	K68 K360	E58-K68 WeakPolarHBondContact OE1-CD 3.23Å; E58-K360 WeakPolarHBondContact OE2-CE 3.13Å; E58-K360 IonicContact OE2-NZ 2.57Å; E58-K360 PolarHBondContact OE2-NZ 3.03Å
59	V	95.1	Very high	95.9	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	30%	0.3	C	S	.	.			trans	-96.1	121.9	178.1	-178.2	0	0	0	0	110.7	R61 I66 K68 K69 V71	V59-R61 HydrophobicContact CG1-CB 3.95Å; V59-R61 HydrophobicContact CG1-CG 3.64Å; V59-I66 HydrophobicContact CG1-CD1 4.17Å; V59-I66 HydrophobicContact CG1-CG1 4.27Å; V59-I66 HydrophobicContact CG2-CD1 4.2Å; V59-K68 PolarHBondContact O-N 3.15Å; V59-K69 PolarHBondContact N-O 2.84Å; V59-V71 HydrophobicContact CG2-CB 4.01Å; V59-V71 HydrophobicContact CG2-CG1 3.53Å; V59-V71 HydrophobicContact CG2-CG2 3.25Å
60	D	93.4	Very high	95.9	Very high	78 Å²	78	62.4 Å²	62.4	42%	0.417	32%	0.321	S	S	.	.			trans	-102.4	87.4	173.2	-170.8	43.6	0	0	0	110.3	K68 E355	D60-K68 VanDerWaalsContact OD1-CE 3.22Å; D60-K68 WeakPolarHBondContact OD1-CE 3.11Å; D60-K68 IonicContact OD1-NZ 2.85Å; D60-K68 PolarHBondContact OD1-NZ 3.42Å; D60-E355 PolarHBondContact N-OE1 3.41Å
61	R	92.8	Very high	95.9	Very high	68 Å²	68	63.6 Å²	63.6	26%	0.257	33%	0.328	S	S	.	.			trans	-142.6	85.6	-179.6	-67.3	-174.7	-172.3	151.5	12.6	109.6	V59 S63 S64 N67 E355	V59-R61 HydrophobicContact CG1-CB 3.95Å; V59-R61 HydrophobicContact CG1-CG 3.64Å; R61-S63 PolarHBondContact O-N 2.64Å; R61-S64 WeakPolarHBondContact O-CB 3.47Å; R61-S64 PolarHBondContact O-N 2.82Å; R61-N67 PolarHBondContact N-OD1 2.86Å; R61-N67 VanDerWaalsContact O-CB 3.3Å; R61-N67 WeakPolarHBondContact O-CB 3.5Å; R61-N67 PolarHBondContact O-OD1 2.71Å; R61-E355 IonicContact CZ-OE2 3.83Å; R61-E355 VanDerWaalsContact CZ-OE2 3.26Å; R61-E355 IonicContact NE-OE1 2.79Å; R61-E355 IonicContact NE-OE2 2.77Å; R61-E355 PolarHBondContact NE-OE2 2.92Å; R61-E355 IonicContact NH2-OE1 3.18Å; R61-E355 IonicContact NH2-OE2 2.63Å; R61-E355 PolarHBondContact NH2-OE2 3.14Å
62	P	92.1	Very high	95.9	Very high	69 Å²	69	67.7 Å²	67.7	45%	0.448	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	140.4	172.7	-26.8	34.3	0	0	0	110.4	S64	P62-S64 VanDerWaalsContact C-N 3.34Å
63	S	92.2	Very high	95.9	Very high	137 Å²	137	65.5 Å²	65.5	96%	0.958	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.5	-171.9	95	0	0	0	0	117.2	R61	R61-S63 PolarHBondContact O-N 2.64Å
64	S	93.9	Very high	95.9	Very high	46 Å²	46	67.4 Å²	67.4	32%	0.322	36%	0.355	S	S	.	.			trans	-89.6	144	176.3	-162.2	0	0	0	0	112.3	R61 P62 I66 N67	R61-S64 WeakPolarHBondContact O-CB 3.47Å; R61-S64 PolarHBondContact O-N 2.82Å; P62-S64 VanDerWaalsContact C-N 3.34Å; S64-I66 PolarHBondContact O-N 3.22Å; S64-I66 VanDerWaalsContact O-N 3.11Å; S64-I66 VanDerWaalsContact OG-CG1 3.25Å; S64-I66 WeakPolarHBondContact OG-CG1 3.3Å; S64-N67 VanDerWaalsContact O-CB 3.23Å; S64-N67 WeakPolarHBondContact O-CB 3.27Å; S64-N67 PolarHBondContact O-N 3.19Å
65	K	96.5	Very high	95.9	Very high	193 Å²	193	64.2 Å²	64.2	84%	0.839	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.9	172.6	-65.8	-172.4	178.4	-173.7	0	114	K69	K65-K69 PolarHBondContact O-NZ 3.04Å
66	I	95.1	Very high	95.9	Very high	69 Å²	69	64.2 Å²	64.2	35%	0.354	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	8.1	178.4	60.2	169.5	0	0	0	112.6	V59 S64 K68 K69 V71	V59-I66 HydrophobicContact CG1-CD1 4.17Å; V59-I66 HydrophobicContact CG1-CG1 4.27Å; V59-I66 HydrophobicContact CG2-CD1 4.2Å; S64-I66 PolarHBondContact O-N 3.22Å; S64-I66 VanDerWaalsContact O-N 3.11Å; S64-I66 VanDerWaalsContact OG-CG1 3.25Å; S64-I66 WeakPolarHBondContact OG-CG1 3.3Å; I66-K68 PolarHBondContact O-N 3.29Å; I66-K69 WeakPolarHBondContact O-CB 3.21Å; I66-K69 PolarHBondContact O-N 3.26Å; I66-K69 VanDerWaalsContact O-N 3.13Å; I66-V71 HydrophobicContact CB-CG1 4.44Å; I66-V71 HydrophobicContact CD1-CG1 4.25Å
67	N	95.5	Very high	96	Very high	49 Å²	49	63.1 Å²	63.1	26%	0.262	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	134.9	175.9	-169.6	45.6	0	0	0	110.4	R61 S64 K69	R61-N67 PolarHBondContact N-OD1 2.86Å; R61-N67 VanDerWaalsContact O-CB 3.3Å; R61-N67 WeakPolarHBondContact O-CB 3.5Å; R61-N67 PolarHBondContact O-OD1 2.71Å; S64-N67 VanDerWaalsContact O-CB 3.23Å; S64-N67 WeakPolarHBondContact O-CB 3.27Å; S64-N67 PolarHBondContact O-N 3.19Å; N67-K69 PolarHBondContact O-N 2.85Å; N67-K69 VanDerWaalsContact O-N 3.12Å
68	K	94.7	Very high	96	Very high	117 Å²	117	63.1 Å²	63.1	51%	0.509	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	25.2	-176.6	-53.4	-63.5	176.3	-173.3	0	113.7	E58 V59 D60 I66	E58-K68 WeakPolarHBondContact OE1-CD 3.23Å; V59-K68 PolarHBondContact O-N 3.15Å; D60-K68 VanDerWaalsContact OD1-CE 3.22Å; D60-K68 WeakPolarHBondContact OD1-CE 3.11Å; D60-K68 IonicContact OD1-NZ 2.85Å; D60-K68 PolarHBondContact OD1-NZ 3.42Å; I66-K68 PolarHBondContact O-N 3.29Å
69	K	96.4	Very high	96.1	Very high	124 Å²	124	60.9 Å²	60.9	54%	0.539	32%	0.323	S	S	.	.			trans	-111.6	150.5	171.8	-63.6	-173.9	-176.8	164.2	0	110.2	V59 K65 I66 N67	V59-K69 PolarHBondContact N-O 2.84Å; K65-K69 PolarHBondContact O-NZ 3.04Å; I66-K69 WeakPolarHBondContact O-CB 3.21Å; I66-K69 PolarHBondContact O-N 3.26Å; I66-K69 VanDerWaalsContact O-N 3.13Å; N67-K69 PolarHBondContact O-N 2.85Å; N67-K69 VanDerWaalsContact O-N 3.12Å
70	E	96.9	Very high	96.3	Very high	117 Å²	117	60.8 Å²	60.8	55%	0.547	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.2	174.3	-63.4	-172.4	174.9	0	0	110.7	V56 R57 K360	V56-E70 HydrophobicContact CG1-CB 3.81Å; V56-E70 HydrophobicContact CG1-CG 4.22Å; R57-E70 WeakPolarHBondContact O-CA 3.43Å; E70-K360 HydrophobicContact CG-CD 4.07Å; E70-K360 WeakPolarHBondContact OE1-CD 3.31Å; E70-K360 IonicContact OE1-NZ 3.72Å; E70-K360 PolarHBondContact OE1-NZ 3.19Å
71	V	97.6	Very high	96.5	Very high	26 Å²	26	57.1 Å²	57.1	16%	0.158	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.1	175.3	-62.2	0	0	0	0	110	V56 R57 V59 I66 E73	V56-V71 WeakPolarHBondContact CA-O 3.26Å; R57-V71 HydrophobicContact CG-CG2 3.94Å; R57-V71 PolarHBondContact N-O 2.75Å; R57-V71 VanDerWaalsContact N-O 3.17Å; R57-V71 PolarHBondContact O-N 3.15Å; V59-V71 HydrophobicContact CG2-CB 4.01Å; V59-V71 HydrophobicContact CG2-CG1 3.53Å; V59-V71 HydrophobicContact CG2-CG2 3.25Å; I66-V71 HydrophobicContact CB-CG1 4.44Å; I66-V71 HydrophobicContact CD1-CG1 4.25Å; V71-E73 HydrophobicContact CG2-CG 3.98Å
72	V	98.2	Very high	96.7	Very high	100 Å²	100	55 Å²	55	61%	0.606	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.4	169.1	-179.8	0	0	0	0	108.8	H54 I55 V56	H54-V72 HydrophobicContact CB-CG1 3.82Å; I55-V72 VanDerWaalsContact O-CA 3.28Å; I55-V72 WeakPolarHBondContact O-CA 3.32Å; V56-V72 HydrophobicContact CG2-CG2 4.24Å
73	E	98.2	Very high	97	Very high	32 Å²	32	51.9 Å²	51.9	15%	0.15	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.5	176.6	-73.4	-175.9	143.7	0	0	111.2	H54 I55 R57 V71 Y284 K328	H54-E73 VanDerWaalsContact CA-O 3.32Å; H54-E73 WeakPolarHBondContact CA-O 3.36Å; I55-E73 HydrophobicContact CD1-CB 4.31Å; I55-E73 HydrophobicContact CG1-CB 4.26Å; I55-E73 WeakPolarHBondContact CG1-O 3.22Å; I55-E73 PolarHBondContact N-O 3.05Å; I55-E73 PolarHBondContact O-N 2.93Å; R57-E73 IonicContact CZ-OE2 3.9Å; R57-E73 IonicContact NE-OE2 2.8Å; R57-E73 PolarHBondContact NE-OE2 3.21Å; V71-E73 HydrophobicContact CG2-CG 3.98Å; E73-Y284 HydrophobicContact CB-CE2 4.42Å; E73-Y284 VanDerWaalsContact OE2-CE2 3.24Å; E73-Y284 WeakPolarHBondContact OE2-CE2 3.11Å; E73-Y284 VanDerWaalsContact OE2-CZ 3.23Å; E73-Y284 PolarHBondContact OE2-OH 2.96Å; E73-K328 WeakPolarHBondContact OE1-CE 3.22Å; E73-K328 IonicContact OE1-NZ 3.28Å; E73-K328 PolarHBondContact OE1-NZ 3.09Å; E73-K328 IonicContact OE2-NZ 2.64Å
74	A	98.5	Very high	97.3	Very high	48 Å²	48	46.1 Å²	46.1	40%	0.397	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	139.2	173.7	0	0	0	0	0	110.4	M52 T53 G329	M52-A74 HydrophobicContact CE-CB 3.97Å; T53-A74 WeakPolarHBondContact O-CA 3.36Å; A74-G329 WeakPolarHBondContact O-CA 3.5Å; A74-G329 PolarHBondContact O-N 2.95Å
75	V	98.7	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141.4	-179.2	-67.1	0	0	0	0	111.4	M52 T53 I55 Y284 M326 V327	M52-V75 CarbonylContact C-O 3.57Å; M52-V75 VanDerWaalsContact CA-O 3.28Å; M52-V75 WeakPolarHBondContact CA-O 3.38Å; M52-V75 VanDerWaalsContact CG-O 3.24Å; M52-V75 WeakPolarHBondContact CG-O 3.3Å; T53-V75 HydrophobicContact CG2-CG2 3.69Å; T53-V75 PolarHBondContact N-O 2.95Å; T53-V75 PolarHBondContact O-N 3.18Å; T53-V75 VanDerWaalsContact O-O 3.12Å; I55-V75 HydrophobicContact CG1-CG1 3.88Å; I55-V75 HydrophobicContact CG2-CG1 4.23Å; I55-V75 HydrophobicContact CG2-CG2 3.81Å; V75-Y284 HydrophobicContact CG1-CD2 3.69Å; V75-Y284 HydrophobicContact CG1-CE2 4.13Å; V75-M326 HydrophobicContact CB-CG 3.57Å; V75-M326 HydrophobicContact CB-SD 4.03Å; V75-M326 HydrophobicContact CG1-CG 3.9Å; V75-M326 HydrophobicContact CG1-SD 3.96Å; V75-M326 HydrophobicContact CG2-CE 4.24Å; V75-M326 HydrophobicContact CG2-CG 3.76Å; V75-M326 HydrophobicContact CG2-SD 3.77Å; V75-V327 CarbonylContact C-O 3.57Å; V75-V327 WeakPolarHBondContact CA-O 3.19Å
76	T	98.7	Very high	97.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133	171.3	-56.9	0	0	0	0	109.7	K49 G51 L78 V327 G329 C331	K49-T76 HydrophobicContact CD-CG2 4.04Å; K49-T76 HydrophobicContact CG-CG2 3.79Å; G51-T76 VanDerWaalsContact O-CG2 3.31Å; G51-T76 WeakPolarHBondContact O-CG2 3.33Å; T76-L78 HydrophobicContact CG2-CD2 3.83Å; T76-V327 PolarHBondContact N-O 3Å; T76-V327 PolarHBondContact O-N 2.95Å; T76-G329 PolarHBondContact N-O 2.57Å; T76-G329 PolarHBondContact OG1-O 2.98Å; T76-C331 HydrophobicContact CG2-CB 3.81Å; T76-C331 PolarHBondContact OG1-N 2.74Å
77	V	98.4	Very high	97.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.6	173	179.8	0	0	0	0	109.5	A50 G51 I308 W314 V320 F324	A50-V77 HydrophobicContact CB-CG1 4.41Å; A50-V77 PolarHBondContact N-O 3.03Å; G51-V77 PolarHBondContact O-N 2.81Å; V77-I308 HydrophobicContact CG1-CG1 4.12Å; V77-I308 HydrophobicContact CG2-CD1 4.11Å; V77-I308 HydrophobicContact CG2-CG1 3.96Å; V77-W314 HydrophobicContact CB-CH2 4.14Å; V77-W314 HydrophobicContact CB-CZ2 3.83Å; V77-W314 HydrophobicContact CG1-CZ2 4.25Å; V77-W314 HydrophobicContact CG2-CH2 3.72Å; V77-W314 HydrophobicContact CG2-CZ2 3.59Å; V77-V320 HydrophobicContact CG1-CG2 4.32Å; V77-F324 HydrophobicContact CG1-CB 4.09Å; V77-F324 HydrophobicContact CG1-CD2 3.97Å; V77-F324 HydrophobicContact CG1-CG 4.19Å
78	L	98.4	Very high	97.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.5	176.6	-54.3	-178.9	0	0	0	108.8	Y48 K49 T76 F324 V325 V327 C331 I339 L341	Y48-L78 CarbonylContact O-C 3.6Å; Y48-L78 VanDerWaalsContact O-CA 3.32Å; Y48-L78 WeakPolarHBondContact O-CA 3.27Å; K49-L78 HydrophobicContact CB-CD2 3.75Å; K49-L78 HydrophobicContact CG-CD2 4.01Å; T76-L78 HydrophobicContact CG2-CD2 3.83Å; L78-F324 CarbonylContact O-C 3.6Å; L78-F324 WeakPolarHBondContact O-CA 3.48Å; L78-F324 WeakPolarHBondContact O-CB 3.27Å; L78-V325 PolarHBondContact N-O 3.37Å; L78-V325 PolarHBondContact O-N 3.38Å; L78-V327 HydrophobicContact CD1-CG1 4.24Å; L78-V327 HydrophobicContact CD1-CG2 4.26Å; L78-V327 HydrophobicContact CG-CG2 4.46Å; L78-C331 HydrophobicContact CD2-CB 4.44Å; L78-I339 HydrophobicContact CD2-CG1 4.25Å; L78-L341 HydrophobicContact CD1-CD1 4.35Å; L78-L341 HydrophobicContact CD1-CD2 3.69Å
79	E	97.9	Very high	98	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.019	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	128.4	173.8	-173.5	171.3	-160.5	0	0	109.6	G47 Y48 P81 M170 Y317 V320 N321 Q322	G47-E79 CarbonylContact C-O 3.49Å; G47-E79 WeakPolarHBondContact CA-O 3.42Å; Y48-E79 PolarHBondContact N-O 3.25Å; Y48-E79 PolarHBondContact O-N 2.94Å; E79-P81 WeakPolarHBondContact O-CD 3.39Å; E79-M170 HydrophobicContact CB-CE 4.01Å; E79-M170 VanDerWaalsContact CD-SD 3.58Å; E79-M170 HydrophobicContact CG-CE 3.65Å; E79-M170 HydrophobicContact CG-SD 3.88Å; E79-M170 WeakPolarHBondContact OE2-CE 3.43Å; E79-Y317 WeakPolarHBondContact CB-OH 3.45Å; E79-Y317 WeakPolarHBondContact OE2-CE1 3.06Å; E79-Y317 VanDerWaalsContact OE2-CZ 3.24Å; E79-Y317 PolarHBondContact OE2-OH 2.82Å; E79-V320 HydrophobicContact CB-CG1 4.1Å; E79-V320 HydrophobicContact CB-CG2 4.35Å; E79-V320 HydrophobicContact CG-CG1 3.95Å; E79-N321 PolarHBondContact OE1-N 3.1Å; E79-Q322 HydrophobicContact CG-CB 3.84Å; E79-Q322 PolarHBondContact OE1-N 3.25Å
80	T	98.2	Very high	98.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.105	C	C	.	.			trans	-125.5	75	-170.1	45.6	0	0	0	0	109.2	F45 I206 D323 F324 V325 L341	F45-T80 HydrophobicContact CD1-CG2 4.21Å; F45-T80 HydrophobicContact CE1-CG2 4.27Å; T80-I206 HydrophobicContact CG2-CB 4.5Å; T80-I206 HydrophobicContact CG2-CD1 4.17Å; T80-I206 HydrophobicContact CG2-CG1 4.19Å; T80-I206 WeakPolarHBondContact OG1-CG2 3.33Å; T80-D323 CarbonylContact C-O 3.6Å; T80-D323 WeakPolarHBondContact CA-O 3.46Å; T80-D323 PolarHBondContact N-O 3.11Å; T80-D323 VanDerWaalsContact OG1-C 3.32Å; T80-D323 PolarHBondContact OG1-O 2.85Å; T80-F324 WeakPolarHBondContact OG1-CA 3.36Å; T80-V325 HydrophobicContact CG2-CG2 4.1Å; T80-L341 HydrophobicContact CG2-CD1 4.47Å
81	P	97	Very high	98.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-55.3	146.6	170.6	26.5	-35.1	0	0	0	109.5	Y48 E79 M83 L169 M170 Q322	Y48-P81 HydrophobicContact CD2-CG 4.21Å; Y48-P81 HydrophobicContact CE2-CG 3.96Å; E79-P81 WeakPolarHBondContact O-CD 3.39Å; P81-M83 PolarHBondContact O-N 2.92Å; P81-L169 HydrophobicContact CB-CD1 4.38Å; P81-M170 HydrophobicContact CB-CG 4.38Å; P81-M170 HydrophobicContact CB-SD 3.94Å; P81-M170 HydrophobicContact CG-CG 3.96Å; P81-M170 HydrophobicContact CG-SD 3.62Å; P81-Q322 HydrophobicContact CB-CB 4.37Å; P81-Q322 HydrophobicContact CB-CG 4.12Å
82	P	97.7	Very high	98.2	Very high	25 Å²	25	14.6 Å²	14.6	16%	0.162	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-54.6	142.8	178.5	22.6	-33.2	0	0	0	111.1	Q166 L169 I204	P82-Q166 WeakPolarHBondContact O-CG 3.42Å; P82-L169 HydrophobicContact CG-CD1 3.98Å; P82-I204 CarbonylContact C-O 3.54Å; P82-I204 WeakPolarHBondContact CA-O 3.11Å
83	M	98.4	Very high	98.1	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.015	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.8	175.5	-71.2	-175.4	65.5	0	0	110	F45 I46 P81 A163 H164 T165 M180 I182 S203 I204	F45-M83 HydrophobicContact CD1-CG 4.37Å; F45-M83 HydrophobicContact CD1-SD 3.98Å; F45-M83 HydrophobicContact CD2-CG 4.28Å; F45-M83 HydrophobicContact CD2-SD 3.86Å; F45-M83 HydrophobicContact CE1-CG 3.9Å; F45-M83 HydrophobicContact CE1-SD 4.12Å; F45-M83 HydrophobicContact CE2-CB 3.96Å; F45-M83 HydrophobicContact CE2-CG 3.82Å; F45-M83 HydrophobicContact CE2-SD 4.03Å; F45-M83 HydrophobicContact CG-SD 3.84Å; F45-M83 HydrophobicContact CZ-CB 4.06Å; F45-M83 HydrophobicContact CZ-CG 3.61Å; F45-M83 HydrophobicContact CZ-SD 4.16Å; I46-M83 HydrophobicContact CB-CE 4.38Å; I46-M83 HydrophobicContact CB-SD 3.84Å; I46-M83 HydrophobicContact CD1-CE 4.01Å; I46-M83 HydrophobicContact CG1-CE 4Å; I46-M83 HydrophobicContact CG1-SD 4Å; I46-M83 PolarHBondContact N-SD 3.27Å; P81-M83 PolarHBondContact O-N 2.92Å; M83-A163 HydrophobicContact CB-CB 4.48Å; M83-A163 HydrophobicContact CE-CB 3.64Å; M83-H164 CarbonylContact C-O 3.57Å; M83-H164 VanDerWaalsContact CA-O 3.27Å; M83-H164 WeakPolarHBondContact CA-O 3.49Å; M83-T165 HydrophobicContact CG-CG2 4.31Å; M83-M180 HydrophobicContact CE-CG 3.91Å; M83-M180 HydrophobicContact CE-SD 4.33Å; M83-I182 HydrophobicContact CE-CD1 3.98Å; M83-I182 HydrophobicContact SD-CD1 4.45Å; M83-S203 CarbonylContact O-C 3.6Å; M83-I204 PolarHBondContact N-O 2.96Å; M83-I204 PolarHBondContact O-N 2.85Å
84	V	98.3	Very high	98.1	Very high	16 Å²	16	15.4 Å²	15.4	10%	0.097	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.3	176.2	-173.8	0	0	0	0	109	V86 A163 H164 Q166	V84-V86 HydrophobicContact CG1-CG1 4.08Å; V84-A163 CarbonylContact O-C 3.52Å; V84-A163 WeakPolarHBondContact O-CA 3.34Å; V84-H164 PolarHBondContact N-O 2.81Å; V84-H164 PolarHBondContact O-N 2.52Å; V84-Q166 HydrophobicContact CG2-CG 3.83Å
85	I	98.3	Very high	98.1	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	127	169.9	-69.3	169	0	0	0	108.5	V161 A163 W195 H199 F200 E201 K202 I204	I85-V161 HydrophobicContact CD1-CB 4.06Å; I85-V161 HydrophobicContact CD1-CG1 4.08Å; I85-V161 HydrophobicContact CD1-CG2 3.91Å; I85-V161 HydrophobicContact CG1-CB 4.11Å; I85-V161 HydrophobicContact CG1-CG2 4.04Å; I85-V161 HydrophobicContact CG2-CB 3.92Å; I85-V161 HydrophobicContact CG2-CG1 4.11Å; I85-A163 HydrophobicContact CG1-CB 4.08Å; I85-W195 HydrophobicContact CD1-CH2 3.96Å; I85-W195 HydrophobicContact CD1-CZ3 3.88Å; I85-H199 WeakPolarHBondContact CB-O 3.43Å; I85-H199 HydrophobicContact CD1-CB 3.81Å; I85-F200 HydrophobicContact CG2-CD1 3.92Å; I85-F200 HydrophobicContact CG2-CE1 4.33Å; I85-E201 WeakPolarHBondContact O-CA 3.49Å; I85-E201 PolarHBondContact O-N 3.26Å; I85-K202 PolarHBondContact N-O 2.83Å; I85-I204 HydrophobicContact CD1-CD1 3.28Å; I85-I204 HydrophobicContact CD1-CG1 4.41Å; I85-I204 HydrophobicContact CG1-CD1 4.02Å
86	V	97.5	Very high	98	Very high	1 Å²	1	32 Å²	32	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	5.8	-176.5	-68.9	0	0	0	0	113	V84 W105 A106 L109 I162 H164	V84-V86 HydrophobicContact CG1-CG1 4.08Å; V86-W105 HydrophobicContact CG2-CE3 4.19Å; V86-W105 HydrophobicContact CG2-CZ3 3.86Å; V86-W105 WeakPolarHBondContact O-CA 3.49Å; V86-A106 PolarHBondContact O-N 2.92Å; V86-L109 HydrophobicContact CB-CG 4.19Å; V86-L109 HydrophobicContact CG1-CG 4.37Å; V86-I162 HydrophobicContact CG2-CG2 4.12Å; V86-I162 WeakPolarHBondContact CG2-O 2.99Å; V86-I162 PolarHBondContact N-O 2.94Å; V86-H164 WeakPolarHBondContact CG1-CD2 3.47Å; V86-H164 WeakPolarHBondContact CG1-NE2 3.01Å
87	G	97.8	Very high	97.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.4	174	177	0	0	0	0	0	113	I104 V161 I162 F200	G87-I104 CarbonylContact C-O 3.13Å; G87-I104 WeakPolarHBondContact CA-O 3.35Å; G87-V161 CarbonylContact O-C 3.56Å; G87-V161 WeakPolarHBondContact O-CA 3.38Å; G87-I162 PolarHBondContact N-O 3.48Å; G87-I162 PolarHBondContact O-N 3.37Å; G87-F200 VanDerWaalsContact C-CE1 3.46Å
88	V	98.3	Very high	97.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145.1	174.7	69.2	0	0	0	0	109.2	T103 I104 F149 I152 V159 R160 A196 F200	V88-T103 CarbonylContact O-C 3.47Å; V88-T103 WeakPolarHBondContact O-CA 3.1Å; V88-I104 HydrophobicContact CG1-CB 3.98Å; V88-I104 HydrophobicContact CG1-CD1 4.28Å; V88-I104 HydrophobicContact CG1-CG1 4.47Å; V88-I104 PolarHBondContact N-O 3.33Å; V88-I104 PolarHBondContact O-N 2.85Å; V88-F149 HydrophobicContact CG1-CD1 4.47Å; V88-F149 HydrophobicContact CG1-CE1 3.81Å; V88-I152 HydrophobicContact CG1-CD1 4.13Å; V88-V159 HydrophobicContact CG2-CG1 3.48Å; V88-V159 VanDerWaalsContact CG2-CG1 3.48Å; V88-R160 CarbonylContact C-O 3.59Å; V88-R160 WeakPolarHBondContact CA-O 3.4Å; V88-R160 WeakPolarHBondContact CG2-O 3.44Å; V88-A196 HydrophobicContact CB-CB 4.14Å; V88-A196 HydrophobicContact CG2-CB 3.78Å; V88-F200 HydrophobicContact CB-CE1 4.1Å; V88-F200 HydrophobicContact CB-CZ 4.2Å; V88-F200 HydrophobicContact CG1-CE1 4.31Å; V88-F200 HydrophobicContact CG1-CZ 3.91Å
89	I	98.4	Very high	97.8	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.051	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127	174.2	-175.5	169.4	0	0	0	109.4	Y91 A100 K102 T103 R160 I162 E181	I89-Y91 HydrophobicContact CB-CE2 4.45Å; I89-Y91 HydrophobicContact CD1-CE2 3.95Å; I89-Y91 HydrophobicContact CG1-CD2 4.34Å; I89-Y91 HydrophobicContact CG1-CE2 3.93Å; I89-Y91 HydrophobicContact CG2-CD2 4.37Å; I89-Y91 HydrophobicContact CG2-CE2 3.73Å; I89-A100 HydrophobicContact CD1-CB 3.79Å; I89-A100 HydrophobicContact CG1-CB 4.29Å; I89-K102 WeakPolarHBondContact CA-O 3.46Å; I89-T103 HydrophobicContact CB-CG2 4.43Å; I89-T103 WeakPolarHBondContact CD1-OG1 3.37Å; I89-T103 WeakPolarHBondContact CG1-OG1 3.39Å; I89-R160 HydrophobicContact CG2-CB 3.73Å; I89-R160 WeakPolarHBondContact CG2-O 3.09Å; I89-R160 PolarHBondContact N-O 3.34Å; I89-R160 PolarHBondContact O-N 3.13Å; I89-I162 HydrophobicContact CG2-CG1 4.38Å; I89-E181 HydrophobicContact CG2-CG 4.04Å
90	G	98.5	Very high	97.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.8	172.7	0	0	0	0	0	111	L101 K102 C156	G90-L101 PolarHBondContact O-N 3.16Å; G90-K102 PolarHBondContact N-O 3.34Å; G90-C156 WeakPolarHBondContact CA-SG 3.32Å
91	Y	98.6	Very high	97.7	Very high	31 Å²	31	48 Å²	48	12%	0.122	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.6	173.3	-74.9	-91.4	0	0	0	110.5	I89 L98 R99 A100 C156 K157 V158 R160 E181	I89-Y91 HydrophobicContact CB-CE2 4.45Å; I89-Y91 HydrophobicContact CD1-CE2 3.95Å; I89-Y91 HydrophobicContact CG1-CD2 4.34Å; I89-Y91 HydrophobicContact CG1-CE2 3.93Å; I89-Y91 HydrophobicContact CG2-CD2 4.37Å; I89-Y91 HydrophobicContact CG2-CE2 3.73Å; Y91-L98 HydrophobicContact CD1-CB 4.1Å; Y91-R99 CarbonylContact C-O 3.4Å; Y91-R99 VanDerWaalsContact CA-O 3.3Å; Y91-R99 WeakPolarHBondContact CA-O 3.45Å; Y91-A100 HydrophobicContact CD1-CB 4.27Å; Y91-A100 HydrophobicContact CE1-CB 3.94Å; Y91-C156 CarbonylContact O-C 3.54Å; Y91-C156 WeakPolarHBondContact O-CA 3.24Å; Y91-C156 WeakPolarHBondContact O-CB 3.48Å; Y91-K157 PolarHBondContact O-N 2.92Å; Y91-V158 PolarHBondContact N-O 3.16Å; Y91-V158 PolarHBondContact O-N 3.33Å; Y91-R160 HydrophobicContact CD2-CG 4.14Å; Y91-R160 HydrophobicContact CE2-CG 4.03Å; Y91-E181 WeakPolarHBondContact CE2-OE2 3.08Å; Y91-E181 PolarHBondContact OH-OE2 2.84Å
92	I	98.1	Very high	97.8	Very high	36 Å²	36	51.1 Å²	51.1	19%	0.185	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	139.3	171.2	-175	167.7	0	0	0	109.6	T94 L98 R99 L101 Y155	I92-T94 HydrophobicContact CG2-CG2 4.08Å; I92-L98 WeakPolarHBondContact O-CA 3.45Å; I92-R99 HydrophobicContact CG2-CB 4.08Å; I92-R99 WeakPolarHBondContact CG2-O 3.05Å; I92-R99 PolarHBondContact N-O 2.99Å; I92-R99 PolarHBondContact O-N 3.48Å; I92-L101 HydrophobicContact CB-CB 4.42Å; I92-L101 HydrophobicContact CG2-CB 4.19Å; I92-L101 HydrophobicContact CG2-CD1 4.39Å; I92-Y155 WeakPolarHBondContact CG1-O 3.36Å
93	E	97.2	Very high	97.8	Very high	111 Å²	111	52.5 Å²	52.5	52%	0.519	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126	170.8	-171.4	171.9	-127.2	0	0	109.2	L98 K157	E93-L98 HydrophobicContact CB-CD2 4.22Å; E93-K157 HydrophobicContact CB-CB 4.36Å; E93-K157 HydrophobicContact CB-CD 4.07Å; E93-K157 HydrophobicContact CG-CD 4.44Å; E93-K157 IonicContact OE1-NZ 2.69Å; E93-K157 PolarHBondContact OE1-NZ 3.05Å; E93-K157 WeakPolarHBondContact OE2-CD 3.48Å; E93-K157 WeakPolarHBondContact OE2-CE 3.43Å; E93-K157 IonicContact OE2-NZ 3.19Å; E93-K157 PolarHBondContact OE2-NZ 2.88Å
94	T	97.6	Very high	97.7	Very high	38 Å²	38	52.8 Å²	52.8	23%	0.233	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	162.6	176	74.6	0	0	0	0	108.7	I92 R96 G97 R99	I92-T94 HydrophobicContact CG2-CG2 4.08Å; T94-R96 PolarHBondContact O-N 3.31Å; T94-R96 PolarHBondContact OG1-N 3.31Å; T94-G97 WeakPolarHBondContact CB-O 3.4Å; T94-G97 PolarHBondContact N-O 2.83Å; T94-G97 PolarHBondContact O-N 2.51Å; T94-G97 PolarHBondContact OG1-O 2.77Å; T94-R99 HydrophobicContact CG2-CB 4.06Å
95	P	97.5	Very high	97.7	Very high	147 Å²	147	54.3 Å²	54.3	96%	0.955	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-20	174.5	-26.9	35.6	0	0	0	114.3
96	R	96.7	Very high	97.6	Very high	249 Å²	249	54.2 Å²	54.2	94%	0.94	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	8.1	177.1	-59.5	-176.3	-177.6	175.6	1.3	113.4	T94	T94-R96 PolarHBondContact O-N 3.31Å; T94-R96 PolarHBondContact OG1-N 3.31Å
97	G	96.3	Very high	97.5	Very high	36 Å²	36	56.4 Å²	56.4	37%	0.371	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	105.2	-165.3	-175.7	0	0	0	0	0	113.5	T94	T94-G97 WeakPolarHBondContact CB-O 3.4Å; T94-G97 PolarHBondContact N-O 2.83Å; T94-G97 PolarHBondContact O-N 2.51Å; T94-G97 PolarHBondContact OG1-O 2.77Å
98	L	97.2	Very high	97.4	Very high	82 Å²	82	61.8 Å²	61.8	43%	0.429	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.4	-178.9	-65.5	174.1	0	0	0	111.3	Y91 I92 E93 V158	Y91-L98 HydrophobicContact CD1-CB 4.1Å; I92-L98 WeakPolarHBondContact O-CA 3.45Å; E93-L98 HydrophobicContact CB-CD2 4.22Å; L98-V158 HydrophobicContact CD1-CB 4.48Å; L98-V158 HydrophobicContact CD1-CG2 4.05Å; L98-V158 HydrophobicContact CD2-CG2 4.17Å
99	R	97.9	Very high	97.2	Very high	130 Å²	130	62.6 Å²	62.6	49%	0.491	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136	173.7	-175.3	175.6	62.4	81.2	-5.9	109.8	Y91 I92 T94 L101	Y91-R99 CarbonylContact C-O 3.4Å; Y91-R99 VanDerWaalsContact CA-O 3.3Å; Y91-R99 WeakPolarHBondContact CA-O 3.45Å; I92-R99 HydrophobicContact CG2-CB 4.08Å; I92-R99 WeakPolarHBondContact CG2-O 3.05Å; I92-R99 PolarHBondContact N-O 2.99Å; I92-R99 PolarHBondContact O-N 3.48Å; T94-R99 HydrophobicContact CG2-CB 4.06Å; R99-L101 PolarHBondContact O-N 3.09Å
100	A	97.9	Very high	97	Very high	45 Å²	45	64.1 Å²	64.1	37%	0.372	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	123.8	171.2	0	0	0	0	0	109.5	I89 Y91	I89-A100 HydrophobicContact CD1-CB 3.79Å; I89-A100 HydrophobicContact CG1-CB 4.29Å; Y91-A100 HydrophobicContact CD1-CB 4.27Å; Y91-A100 HydrophobicContact CE1-CB 3.94Å
101	L	97.5	Very high	96.8	Very high	46 Å²	46	67.1 Å²	67.1	24%	0.241	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-59.2	-179.7	-175.7	66	0	0	0	111	G90 I92 R99 Y155 C156	G90-L101 PolarHBondContact O-N 3.16Å; I92-L101 HydrophobicContact CB-CB 4.42Å; I92-L101 HydrophobicContact CG2-CB 4.19Å; I92-L101 HydrophobicContact CG2-CD1 4.39Å; R99-L101 PolarHBondContact O-N 3.09Å; L101-Y155 HydrophobicContact CD2-CD2 4.15Å; L101-Y155 HydrophobicContact CD2-CG 4.3Å; L101-C156 VanDerWaalsContact CD2-SG 3.57Å
102	K	97.4	Very high	96.6	Very high	66 Å²	66	66 Å²	66	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	143.6	-178.3	-75.7	-63.3	-170.7	144.8	0	110.7	I89 G90 D148 I152	I89-K102 WeakPolarHBondContact CA-O 3.46Å; G90-K102 PolarHBondContact N-O 3.34Å; K102-D148 WeakPolarHBondContact CE-OD1 3.4Å; K102-D148 IonicContact NZ-OD1 4Å; K102-D148 PolarHBondContact NZ-OD1 3.22Å; K102-D148 IonicContact NZ-OD2 2.71Å; K102-D148 PolarHBondContact NZ-OD2 3.49Å; K102-I152 HydrophobicContact CB-CD1 4.19Å; K102-I152 HydrophobicContact CB-CG1 3.93Å
103	T	97.6	Very high	96.5	Very high	55 Å²	55	64.2 Å²	64.2	34%	0.337	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.6	174.1	-55.9	0	0	0	0	108	V88 I89 W105 I162	V88-T103 CarbonylContact O-C 3.47Å; V88-T103 WeakPolarHBondContact O-CA 3.1Å; I89-T103 HydrophobicContact CB-CG2 4.43Å; I89-T103 WeakPolarHBondContact CD1-OG1 3.37Å; I89-T103 WeakPolarHBondContact CG1-OG1 3.39Å; T103-W105 HydrophobicContact CG2-CZ2 4.26Å; T103-I162 HydrophobicContact CG2-CD1 3.55Å
104	I	97.3	Very high	96.5	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.7	178	-54.6	168.3	0	0	0	106.8	G87 V88 W136 I145 D148 F149 I152 F200	G87-I104 CarbonylContact C-O 3.13Å; G87-I104 WeakPolarHBondContact CA-O 3.35Å; V88-I104 HydrophobicContact CG1-CB 3.98Å; V88-I104 HydrophobicContact CG1-CD1 4.28Å; V88-I104 HydrophobicContact CG1-CG1 4.47Å; V88-I104 PolarHBondContact N-O 3.33Å; V88-I104 PolarHBondContact O-N 2.85Å; I104-W136 HydrophobicContact CG2-CZ2 4.17Å; I104-I145 HydrophobicContact CG2-CG2 3.97Å; I104-D148 HydrophobicContact CD1-CB 3.95Å; I104-D148 HydrophobicContact CG1-CB 4.05Å; I104-F149 HydrophobicContact CB-CZ 4.49Å; I104-F149 HydrophobicContact CD1-CB 4.16Å; I104-F149 HydrophobicContact CD1-CD1 3.5Å; I104-F149 VanDerWaalsContact CD1-CD1 3.5Å; I104-F149 HydrophobicContact CD1-CD2 3.71Å; I104-F149 HydrophobicContact CD1-CE1 3.77Å; I104-F149 HydrophobicContact CD1-CE2 3.94Å; I104-F149 HydrophobicContact CD1-CG 3.48Å; I104-F149 VanDerWaalsContact CD1-CG 3.48Å; I104-F149 HydrophobicContact CD1-CZ 3.98Å; I104-F149 HydrophobicContact CG2-CE2 3.93Å; I104-F149 HydrophobicContact CG2-CZ 3.91Å; I104-I152 HydrophobicContact CD1-CD1 3.74Å; I104-I152 HydrophobicContact CG1-CD1 4.21Å; I104-F200 HydrophobicContact CG2-CE2 4.23Å; I104-F200 HydrophobicContact CG2-CZ 4.4Å
105	W	97.4	Very high	96.5	Very high	48 Å²	48	61 Å²	61	18%	0.182	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	147.7	178.5	-66.2	92.6	0	0	0	109.8	V86 T103 L109 F117 F129 W136 I162	V86-W105 HydrophobicContact CG2-CE3 4.19Å; V86-W105 HydrophobicContact CG2-CZ3 3.86Å; V86-W105 WeakPolarHBondContact O-CA 3.49Å; T103-W105 HydrophobicContact CG2-CZ2 4.26Å; W105-L109 HydrophobicContact CE3-CD2 3.91Å; W105-L109 HydrophobicContact CZ3-CD2 4.27Å; W105-F117 AromaticContact CH2-CZ 3.96Å; W105-F117 HydrophobicContact CH2-CZ 3.96Å; W105-F117 HydrophobicContact CZ2-CZ 4.42Å; W105-F129 HydrophobicContact CB-CD1 4.34Å; W105-F129 HydrophobicContact CB-CE1 4.19Å; W105-F129 AromaticContact CD1-CE1 3.72Å; W105-F129 HydrophobicContact CD2-CD1 4.34Å; W105-F129 AromaticContact CD2-CE1 3.41Å; W105-F129 HydrophobicContact CD2-CE1 3.41Å; W105-F129 VanDerWaalsContact CD2-CE1 3.41Å; W105-F129 AromaticContact CD2-CZ 3.94Å; W105-F129 HydrophobicContact CD2-CZ 3.94Å; W105-F129 AromaticContact CE2-CE1 3.57Å; W105-F129 AromaticContact CE2-CZ 3.83Å; W105-F129 AromaticContact CE3-CE1 3.94Å; W105-F129 HydrophobicContact CE3-CE1 3.94Å; W105-F129 HydrophobicContact CE3-CZ 4.16Å; W105-F129 HydrophobicContact CG-CD1 4.13Å; W105-F129 AromaticContact CG-CE1 3.52Å; W105-F129 HydrophobicContact CG-CE1 3.52Å; W105-F129 HydrophobicContact CG-CZ 4.48Å; W105-F129 HydrophobicContact CH2-CZ 4.21Å; W105-F129 HydrophobicContact CZ2-CE1 4.2Å; W105-F129 AromaticContact CZ2-CZ 3.98Å; W105-F129 HydrophobicContact CZ2-CZ 3.98Å; W105-F129 HydrophobicContact CZ3-CZ 4.29Å; W105-F129 AromaticContact NE1-CE1 3.73Å; W105-W136 WeakPolarHBondContact O-CZ2 3.26Å; W105-W136 PolarHBondContact O-NE1 3.47Å; W105-I162 HydrophobicContact CH2-CD1 3.7Å; W105-I162 HydrophobicContact CH2-CG2 3.79Å; W105-I162 HydrophobicContact CZ2-CD1 3.77Å; W105-I162 HydrophobicContact CZ3-CB 4.34Å; W105-I162 HydrophobicContact CZ3-CD1 4.11Å; W105-I162 HydrophobicContact CZ3-CG2 3.72Å
106	A	96.3	Very high	96.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.274	C	S	.	.			trans	-61.3	166.4	173.1	0	0	0	0	0	112.3	V86 L109 F200 E201	V86-A106 PolarHBondContact O-N 2.92Å; A106-L109 HydrophobicContact CB-CD1 4.42Å; A106-L109 VanDerWaalsContact O-CD1 3.27Å; A106-L109 WeakPolarHBondContact O-CD1 3.32Å; A106-F200 HydrophobicContact CB-CB 4.16Å; A106-F200 HydrophobicContact CB-CD2 3.99Å; A106-F200 HydrophobicContact CB-CG 4.11Å; A106-E201 HydrophobicContact CB-CG 3.64Å
107	E	95.6	Very high	96.4	Very high	46 Å²	46	50.6 Å²	50.6	22%	0.215	25%	0.25	C	C	.	.	S	Bend	trans	-69.4	-50.2	-179.5	-178.2	170.7	178.4	0	0	110.4	S133 W136 Q137 E201	E107-S133 WeakPolarHBondContact O-CB 3.34Å; E107-S133 PolarHBondContact O-OG 2.99Å; E107-W136 VanDerWaalsContact CA-CD1 3.47Å; E107-W136 HydrophobicContact CB-CB 3.9Å; E107-W136 HydrophobicContact CB-CD2 4.2Å; E107-W136 HydrophobicContact CB-CG 3.68Å; E107-W136 HydrophobicContact CG-CB 3.71Å; E107-W136 HydrophobicContact CG-CG 4.02Å; E107-Q137 WeakPolarHBondContact OE1-CG 3.48Å; E107-Q137 PolarHBondContact OE1-NE2 3.1Å; E107-E201 WeakPolarHBondContact CA-OE1 3.09Å; E107-E201 PolarHBondContact N-OE1 2.83Å
108	H	95.3	Very high	96.4	Very high	113 Å²	113	51.2 Å²	51.2	52%	0.523	24%	0.241	S	C	.	.			trans	-105.7	111.8	-175.9	-55.5	-59.9	0	0	0	111.5	E201	H108-E201 IonicContact CD2-OE1 3.29Å; H108-E201 IonicContact CD2-OE2 2.66Å; H108-E201 PolarHBondContact CD2-OE2 2.85Å; H108-E201 VanDerWaalsContact CD2-OE2 3.29Å; H108-E201 IonicContact CG-OE2 3.87Å; H108-E201 PolarHBondContact N-OE1 2.89Å
109	L	94.7	Very high	96.3	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.094	27%	0.265	C	S	.	.			trans	-103.6	126.7	171.1	-83.4	72.7	0	0	0	110.4	V86 W105 A106 R114 F129	V86-L109 HydrophobicContact CB-CG 4.19Å; V86-L109 HydrophobicContact CG1-CG 4.37Å; W105-L109 HydrophobicContact CE3-CD2 3.91Å; W105-L109 HydrophobicContact CZ3-CD2 4.27Å; A106-L109 HydrophobicContact CB-CD1 4.42Å; A106-L109 VanDerWaalsContact O-CD1 3.27Å; A106-L109 WeakPolarHBondContact O-CD1 3.32Å; L109-R114 HydrophobicContact CB-CG 3.93Å; L109-R114 VanDerWaalsContact O-CD 3.27Å; L109-R114 WeakPolarHBondContact O-CD 3.41Å; L109-F129 HydrophobicContact CD2-CB 4.42Å; L109-F129 HydrophobicContact CD2-CD1 3.82Å; L109-F129 HydrophobicContact CD2-CD2 3.67Å; L109-F129 HydrophobicContact CD2-CE1 3.96Å; L109-F129 HydrophobicContact CD2-CE2 3.83Å; L109-F129 HydrophobicContact CD2-CG 3.67Å; L109-F129 HydrophobicContact CD2-CZ 3.96Å
110	S	94.6	Very high	96.3	Very high	42 Å²	42	54.9 Å²	54.9	29%	0.294	26%	0.261	S	S	.	.			trans	-59.2	152.7	177.3	70.9	0	0	0	0	112.5	D112 C113 R114 H164	S110-D112 VanDerWaalsContact C-N 3.3Å; S110-D112 WeakPolarHBondContact CB-OD1 3.5Å; S110-D112 PolarHBondContact O-N 2.76Å; S110-D112 PolarHBondContact OG-OD1 2.73Å; S110-C113 WeakPolarHBondContact O-CB 3.49Å; S110-C113 PolarHBondContact O-N 2.82Å; S110-C113 VanDerWaalsContact O-N 3.16Å; S110-C113 VanDerWaalsContact OG-CB 3.32Å; S110-C113 WeakPolarHBondContact OG-CB 3.47Å; S110-C113 PolarHBondContact OG-N 3.19Å; S110-R114 WeakPolarHBondContact O-CG 3.41Å; S110-R114 PolarHBondContact O-N 3.1Å; S110-H164 PolarHBondContact OG-CE1 3.41Å; S110-H164 PolarHBondContact OG-NE2 2.83Å
111	E	94.4	Very high	96.2	Very high	63 Å²	63	53.7 Å²	53.7	29%	0.294	25%	0.246	S	C	.	.	H	α-helix	trans	-57.7	-40.7	179.7	-168.4	-152.6	148.3	0	0	112.7	C113 R114 R115 W121 K168	E111-C113 VanDerWaalsContact C-N 3.33Å; E111-C113 PolarHBondContact O-N 3.26Å; E111-R114 PolarHBondContact O-N 3.35Å; E111-R115 WeakPolarHBondContact O-CB 3.37Å; E111-R115 VanDerWaalsContact O-CG 3.3Å; E111-R115 WeakPolarHBondContact O-CG 3.46Å; E111-R115 PolarHBondContact O-N 2.7Å; E111-R115 IonicContact OE1-CZ 3.83Å; E111-R115 IonicContact OE1-NE 2.66Å; E111-R115 PolarHBondContact OE1-NE 3.34Å; E111-R115 IonicContact OE1-NH2 3.79Å; E111-R115 PolarHBondContact OE1-NH2 2.92Å; E111-W121 HydrophobicContact CG-CH2 3.87Å; E111-W121 HydrophobicContact CG-CZ2 3.32Å; E111-W121 PolarHBondContact OE1-NE1 2.93Å; E111-K168 IonicContact OE2-NZ 3.25Å; E111-K168 PolarHBondContact OE2-NZ 3.11Å
112	D	94.4	Very high	96	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.032	26%	0.264	C	S	.	.	H	α-helix	trans	-68.4	-32.1	179.6	64.2	-26.6	0	0	0	112.6	S110 H164 Q166 M167 K175 A177	S110-D112 VanDerWaalsContact C-N 3.3Å; S110-D112 WeakPolarHBondContact CB-OD1 3.5Å; S110-D112 PolarHBondContact O-N 2.76Å; S110-D112 PolarHBondContact OG-OD1 2.73Å; D112-H164 IonicContact OD1-CE1 2.85Å; D112-Q166 WeakPolarHBondContact OD2-CA 3.46Å; D112-M167 PolarHBondContact OD2-N 2.52Å; D112-K175 WeakPolarHBondContact CB-O 3.18Å; D112-A177 VanDerWaalsContact C-CB 3.47Å; D112-A177 HydrophobicContact CB-CB 4.1Å; D112-A177 VanDerWaalsContact O-CB 3.26Å; D112-A177 WeakPolarHBondContact O-CB 3.2Å; D112-A177 PolarHBondContact O-N 3.2Å
113	C	96.3	Very high	96	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-51.3	167.5	-174.4	0	0	0	0	111	S110 E111 R115 R116 H164 I179	S110-C113 WeakPolarHBondContact O-CB 3.49Å; S110-C113 PolarHBondContact O-N 2.82Å; S110-C113 VanDerWaalsContact O-N 3.16Å; S110-C113 VanDerWaalsContact OG-CB 3.32Å; S110-C113 WeakPolarHBondContact OG-CB 3.47Å; S110-C113 PolarHBondContact OG-N 3.19Å; E111-C113 VanDerWaalsContact C-N 3.33Å; E111-C113 PolarHBondContact O-N 3.26Å; C113-R115 VanDerWaalsContact C-N 3.27Å; C113-R115 PolarHBondContact O-N 2.8Å; C113-R116 WeakPolarHBondContact O-CA 3.3Å; C113-R116 WeakPolarHBondContact O-CB 3.47Å; C113-R116 PolarHBondContact O-N 3.27Å; C113-H164 VanDerWaalsContact SG-CD2 3.59Å; C113-I179 VanDerWaalsContact SG-CD1 3.57Å
114	R	96.6	Very high	95.9	Very high	54 Å²	54	63.9 Å²	63.9	20%	0.204	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-33.6	179.4	-65.7	173.3	70.1	-149	0.8	112.5	L109 S110 E111 R116 F117 Y118 W121 K126 A128	L109-R114 HydrophobicContact CB-CG 3.93Å; L109-R114 VanDerWaalsContact O-CD 3.27Å; L109-R114 WeakPolarHBondContact O-CD 3.41Å; S110-R114 WeakPolarHBondContact O-CG 3.41Å; S110-R114 PolarHBondContact O-N 3.1Å; E111-R114 PolarHBondContact O-N 3.35Å; R114-R116 PolarHBondContact O-N 3.39Å; R114-R116 VanDerWaalsContact O-N 3.11Å; R114-F117 PolarHBondContact O-N 3.42Å; R114-F117 VanDerWaalsContact O-N 3.1Å; R114-Y118 WeakPolarHBondContact O-CD2 3.17Å; R114-W121 HydrophobicContact CB-CH2 3.97Å; R114-W121 HydrophobicContact CB-CZ3 3.83Å; R114-K126 PolarHBondContact NH2-O 2.95Å; R114-A128 PolarHBondContact NE-O 3.39Å; R114-A128 PolarHBondContact NH2-O 2.83Å
115	R	97	Very high	95.8	Very high	28 Å²	28	72.1 Å²	72.1	11%	0.106	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-55.3	-25.5	170.5	-79.6	174.7	-179.9	-100.3	5.5	112.4	E111 C113 F117 Y118 W121 H122 K176	E111-R115 WeakPolarHBondContact O-CB 3.37Å; E111-R115 VanDerWaalsContact O-CG 3.3Å; E111-R115 WeakPolarHBondContact O-CG 3.46Å; E111-R115 PolarHBondContact O-N 2.7Å; E111-R115 IonicContact OE1-CZ 3.83Å; E111-R115 IonicContact OE1-NE 2.66Å; E111-R115 PolarHBondContact OE1-NE 3.34Å; E111-R115 IonicContact OE1-NH2 3.79Å; E111-R115 PolarHBondContact OE1-NH2 2.92Å; C113-R115 VanDerWaalsContact C-N 3.27Å; C113-R115 PolarHBondContact O-N 2.8Å; R115-F117 PolarHBondContact O-N 3.42Å; R115-Y118 PolarHBondContact O-N 3.14Å; R115-W121 HydrophobicContact CB-CD2 4.49Å; R115-W121 HydrophobicContact CB-CE3 4.18Å; R115-W121 HydrophobicContact CG-CB 4.1Å; R115-W121 HydrophobicContact CG-CD2 3.38Å; R115-W121 HydrophobicContact CG-CE3 3.48Å; R115-W121 VanDerWaalsContact CG-CE3 3.48Å; R115-W121 HydrophobicContact CG-CG 3.67Å; R115-W121 HydrophobicContact CG-CZ2 4.48Å; R115-W121 HydrophobicContact CG-CZ3 4.06Å; R115-W121 VanDerWaalsContact NH1-CD1 3.31Å; R115-H122 PolarHBondContact NH1-NE2 2.92Å; R115-H122 VanDerWaalsContact NH1-NE2 3.19Å; R115-K176 HydrophobicContact CB-CB 4.39Å; R115-K176 HydrophobicContact CB-CG 4.19Å; R115-K176 WeakPolarHBondContact O-CE 3.42Å; R115-K176 PolarHBondContact O-NZ 2.9Å
116	R	95.9	Very high	95.8	Very high	80 Å²	80	74.4 Å²	74.4	30%	0.302	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-55.1	-37.2	176.2	-167.8	48.3	59.7	-179.3	5.1	112.3	C113 R114 K176 A177 H178 I179	C113-R116 WeakPolarHBondContact O-CA 3.3Å; C113-R116 WeakPolarHBondContact O-CB 3.47Å; C113-R116 PolarHBondContact O-N 3.27Å; R114-R116 PolarHBondContact O-N 3.39Å; R114-R116 VanDerWaalsContact O-N 3.11Å; R116-K176 PolarHBondContact NH2-O 3.06Å; R116-K176 VanDerWaalsContact O-CE 3.23Å; R116-K176 WeakPolarHBondContact O-CE 3.48Å; R116-K176 PolarHBondContact O-NZ 2.63Å; R116-A177 PolarHBondContact NE-O 3.1Å; R116-A177 VanDerWaalsContact NH2-C 3.27Å; R116-A177 PolarHBondContact NH2-O 3.5Å; R116-H178 PolarHBondContact NH2-CD2 3.06Å; R116-H178 VanDerWaalsContact NH2-CD2 3.35Å; R116-I179 HydrophobicContact CB-CD1 3.45Å; R116-I179 VanDerWaalsContact CB-CD1 3.45Å; R116-I179 HydrophobicContact CB-CG1 3.98Å; R116-I179 HydrophobicContact CG-CB 4.43Å; R116-I179 HydrophobicContact CG-CD1 3.61Å; R116-I179 HydrophobicContact CG-CG1 3.87Å
117	F	96.7	Very high	95.8	Very high	97 Å²	97	81 Å²	81	43%	0.425	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-85.7	-5.5	-173.6	-57.6	-90	0	0	0	114.2	W105 R114 R115 A128 F129 I179	W105-F117 AromaticContact CH2-CZ 3.96Å; W105-F117 HydrophobicContact CH2-CZ 3.96Å; W105-F117 HydrophobicContact CZ2-CZ 4.42Å; R114-F117 PolarHBondContact O-N 3.42Å; R114-F117 VanDerWaalsContact O-N 3.1Å; R115-F117 PolarHBondContact O-N 3.42Å; F117-A128 HydrophobicContact CB-CB 4.36Å; F117-F129 HydrophobicContact CD1-CE2 4.08Å; F117-F129 HydrophobicContact CD1-CZ 4.46Å; F117-F129 HydrophobicContact CD2-CD2 4.46Å; F117-F129 AromaticContact CD2-CE2 3.63Å; F117-F129 HydrophobicContact CD2-CE2 3.63Å; F117-F129 AromaticContact CE1-CE2 3.79Å; F117-F129 HydrophobicContact CE1-CE2 3.79Å; F117-F129 AromaticContact CE1-CZ 3.8Å; F117-F129 HydrophobicContact CE1-CZ 3.8Å; F117-F129 HydrophobicContact CE2-CD2 4.38Å; F117-F129 AromaticContact CE2-CE2 3.33Å; F117-F129 HydrophobicContact CE2-CE2 3.33Å; F117-F129 AromaticContact CE2-CZ 3.87Å; F117-F129 HydrophobicContact CE2-CZ 3.87Å; F117-F129 AromaticContact CG-CE2 3.99Å; F117-F129 HydrophobicContact CG-CE2 3.99Å; F117-F129 AromaticContact CZ-CE2 3.41Å; F117-F129 HydrophobicContact CZ-CE2 3.41Å; F117-F129 VanDerWaalsContact CZ-CE2 3.41Å; F117-F129 AromaticContact CZ-CZ 3.46Å; F117-F129 HydrophobicContact CZ-CZ 3.46Å; F117-F129 VanDerWaalsContact CZ-CZ 3.46Å; F117-I179 HydrophobicContact CE2-CD1 3.64Å; F117-I179 HydrophobicContact CZ-CD1 3.92Å
118	Y	97	Very high	95.7	Very high	48 Å²	48	79.5 Å²	79.5	19%	0.188	35%	0.354	C	S	.	.			trans	-111.5	141.9	174.6	-66.3	-81.4	0	0	0	111.3	R114 R115 W121 S124 K127 A128 K176	R114-Y118 WeakPolarHBondContact O-CD2 3.17Å; R115-Y118 PolarHBondContact O-N 3.14Å; Y118-W121 AromaticContact CD2-CE3 3.43Å; Y118-W121 HydrophobicContact CD2-CE3 3.43Å; Y118-W121 VanDerWaalsContact CD2-CE3 3.43Å; Y118-W121 AromaticContact CD2-CZ3 3.58Å; Y118-W121 HydrophobicContact CD2-CZ3 3.58Å; Y118-W121 HydrophobicContact CE2-CE3 4.02Å; Y118-W121 AromaticContact CE2-CZ3 3.74Å; Y118-W121 HydrophobicContact CE2-CZ3 3.74Å; Y118-W121 HydrophobicContact CG-CE3 4.11Å; Y118-S124 VanDerWaalsContact CD1-OG 3.28Å; Y118-S124 WeakPolarHBondContact CD1-OG 3.4Å; Y118-S124 VanDerWaalsContact CE1-CB 3.46Å; Y118-S124 VanDerWaalsContact CE1-OG 3.31Å; Y118-S124 WeakPolarHBondContact CE1-OG 3.38Å; Y118-K127 PolarHBondContact OH-N 2.61Å; Y118-A128 HydrophobicContact CE2-CB 3.5Å; Y118-A128 VanDerWaalsContact CE2-CB 3.5Å; Y118-A128 PolarHBondContact OH-N 3.35Å; Y118-K176 PolarHBondContact O-NZ 2.99Å
119	K	95.6	Very high	95.7	Very high	214 Å²	214	75.9 Å²	75.9	93%	0.93	34%	0.337	S	S	*	.	S	Bend	trans	-78.5	-47.2	164.8	-63.8	-63.9	-174.5	172	0	110.1
120	N	96.1	Very high	95.7	Very high	76 Å²	76	77.8 Å²	77.8	41%	0.406	35%	0.349	S	S	.	.	S	Bend	trans	-117.5	109.3	172.1	-169.2	-21.6	0	0	0	109.5	H122 R123 S124	N120-H122 PolarHBondContact OD1-N 2.67Å; N120-R123 WeakPolarHBondContact ND2-CD 3.38Å; N120-R123 WeakPolarHBondContact ND2-CG 3.44Å; N120-R123 PolarHBondContact OD1-N 2.8Å; N120-S124 WeakPolarHBondContact O-CB 3.32Å
121	W	96	Very high	95.6	Very high	19 Å²	19	84.3 Å²	84.3	7%	0.072	37%	0.372	C	S	.	.	S	Bend	trans	-76.2	-37.3	-179.5	174.1	-96.7	0	0	0	112.9	E111 R114 R115 Y118 S124 K126	E111-W121 HydrophobicContact CG-CH2 3.87Å; E111-W121 HydrophobicContact CG-CZ2 3.32Å; E111-W121 PolarHBondContact OE1-NE1 2.93Å; R114-W121 HydrophobicContact CB-CH2 3.97Å; R114-W121 HydrophobicContact CB-CZ3 3.83Å; R115-W121 HydrophobicContact CB-CD2 4.49Å; R115-W121 HydrophobicContact CB-CE3 4.18Å; R115-W121 HydrophobicContact CG-CB 4.1Å; R115-W121 HydrophobicContact CG-CD2 3.38Å; R115-W121 HydrophobicContact CG-CE3 3.48Å; R115-W121 VanDerWaalsContact CG-CE3 3.48Å; R115-W121 HydrophobicContact CG-CG 3.67Å; R115-W121 HydrophobicContact CG-CZ2 4.48Å; R115-W121 HydrophobicContact CG-CZ3 4.06Å; R115-W121 VanDerWaalsContact NH1-CD1 3.31Å; Y118-W121 AromaticContact CD2-CE3 3.43Å; Y118-W121 HydrophobicContact CD2-CE3 3.43Å; Y118-W121 VanDerWaalsContact CD2-CE3 3.43Å; Y118-W121 AromaticContact CD2-CZ3 3.58Å; Y118-W121 HydrophobicContact CD2-CZ3 3.58Å; Y118-W121 HydrophobicContact CE2-CE3 4.02Å; Y118-W121 AromaticContact CE2-CZ3 3.74Å; Y118-W121 HydrophobicContact CE2-CZ3 3.74Å; Y118-W121 HydrophobicContact CG-CE3 4.11Å; W121-S124 PolarHBondContact O-N 2.96Å; W121-S124 PolarHBondContact O-OG 2.96Å; W121-K126 HydrophobicContact CD2-CG 4.28Å; W121-K126 HydrophobicContact CE3-CG 4.47Å; W121-K126 HydrophobicContact CH2-CB 4.11Å; W121-K126 HydrophobicContact CH2-CG 4.08Å; W121-K126 HydrophobicContact CZ2-CB 4.27Å; W121-K126 HydrophobicContact CZ2-CD 3.83Å; W121-K126 HydrophobicContact CZ2-CG 3.82Å; W121-K126 HydrophobicContact CZ3-CB 4.5Å; W121-K126 HydrophobicContact CZ3-CG 4.4Å
122	H	94.8	Very high	95.5	Very high	131 Å²	131	83.1 Å²	83.1	61%	0.606	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-28.6	-170.7	-70.1	-88.3	0	0	0	112.3	R115 N120	R115-H122 PolarHBondContact NH1-NE2 2.92Å; R115-H122 VanDerWaalsContact NH1-NE2 3.19Å; N120-H122 PolarHBondContact OD1-N 2.67Å
123	R	96.1	Very high	95.4	Very high	225 Å²	225	84.2 Å²	84.2	85%	0.849	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.6	174.1	-64	-169.1	-179.2	-179.4	-3.1	114.3	N120	N120-R123 WeakPolarHBondContact ND2-CD 3.38Å; N120-R123 WeakPolarHBondContact ND2-CG 3.44Å; N120-R123 PolarHBondContact OD1-N 2.8Å
124	S	95.7	Very high	95.3	Very high	26 Å²	26	91.1 Å²	91.1	18%	0.182	41%	0.409	C	S	.	.	S	Bend	trans	-92.7	157.6	-178.7	81.3	0	0	0	0	111.7	Y118 N120 W121 K126	Y118-S124 VanDerWaalsContact CD1-OG 3.28Å; Y118-S124 WeakPolarHBondContact CD1-OG 3.4Å; Y118-S124 VanDerWaalsContact CE1-CB 3.46Å; Y118-S124 VanDerWaalsContact CE1-OG 3.31Å; Y118-S124 WeakPolarHBondContact CE1-OG 3.38Å; N120-S124 WeakPolarHBondContact O-CB 3.32Å; W121-S124 PolarHBondContact O-N 2.96Å; W121-S124 PolarHBondContact O-OG 2.96Å; S124-K126 PolarHBondContact O-N 3.19Å; S124-K126 VanDerWaalsContact O-N 3.16Å; S124-K126 PolarHBondContact OG-N 3.43Å
125	K	96.6	Very high	95.2	Very high	181 Å²	181	92.9 Å²	92.9	79%	0.787	42%	0.418	S	S	*	.			trans	-71.7	2	171	-60.6	-176.1	179	-178.1	0	113.2	K127	K125-K127 VanDerWaalsContact C-N 3.28Å; K125-K127 HydrophobicContact CB-CD 4.48Å; K125-K127 HydrophobicContact CB-CG 4.06Å; K125-K127 PolarHBondContact O-N 2.92Å; K125-K127 VanDerWaalsContact O-N 3.14Å
126	K	96	Very high	95.1	Very high	96 Å²	96	93.7 Å²	93.7	42%	0.417	42%	0.421	S	S	.	.			trans	48	43.3	178.6	-54	164.5	-168.3	165.7	0	113.3	R114 W121 S124	R114-K126 PolarHBondContact NH2-O 2.95Å; W121-K126 HydrophobicContact CD2-CG 4.28Å; W121-K126 HydrophobicContact CE3-CG 4.47Å; W121-K126 HydrophobicContact CH2-CB 4.11Å; W121-K126 HydrophobicContact CH2-CG 4.08Å; W121-K126 HydrophobicContact CZ2-CB 4.27Å; W121-K126 HydrophobicContact CZ2-CD 3.83Å; W121-K126 HydrophobicContact CZ2-CG 3.82Å; W121-K126 HydrophobicContact CZ3-CB 4.5Å; W121-K126 HydrophobicContact CZ3-CG 4.4Å; S124-K126 PolarHBondContact O-N 3.19Å; S124-K126 VanDerWaalsContact O-N 3.16Å; S124-K126 PolarHBondContact OG-N 3.43Å
127	K	96	Very high	95	Very high	139 Å²	139	96 Å²	96	60%	0.604	44%	0.436	S	S	*	.			trans	-90	8.1	-178.6	-65.8	-165.2	175.2	-171.1	0	115.4	Y118 K125 F129 T130	Y118-K127 PolarHBondContact OH-N 2.61Å; K125-K127 VanDerWaalsContact C-N 3.28Å; K125-K127 HydrophobicContact CB-CD 4.48Å; K125-K127 HydrophobicContact CB-CG 4.06Å; K125-K127 PolarHBondContact O-N 2.92Å; K125-K127 VanDerWaalsContact O-N 3.14Å; K127-F129 PolarHBondContact O-N 3.43Å; K127-T130 WeakPolarHBondContact O-CG2 3.23Å; K127-T130 PolarHBondContact O-N 2.89Å; K127-T130 PolarHBondContact O-OG1 2.89Å
128	A	94.8	Very high	94.9	Very high	14 Å²	14	95 Å²	95	12%	0.116	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	135.3	-175.9	0	0	0	0	0	109.7	R114 F117 Y118 T130	R114-A128 PolarHBondContact NE-O 3.39Å; R114-A128 PolarHBondContact NH2-O 2.83Å; F117-A128 HydrophobicContact CB-CB 4.36Å; Y118-A128 HydrophobicContact CE2-CB 3.5Å; Y118-A128 VanDerWaalsContact CE2-CB 3.5Å; Y118-A128 PolarHBondContact OH-N 3.35Å; A128-T130 PolarHBondContact O-N 2.77Å; A128-T130 VanDerWaalsContact O-N 3.1Å
129	F	95.4	Very high	94.8	Very high	36 Å²	36	97.4 Å²	97.4	16%	0.158	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-1.7	-177.8	-63.6	-87.3	0	0	0	117	W105 L109 F117 K127 K131 S132 S133	W105-F129 HydrophobicContact CB-CD1 4.34Å; W105-F129 HydrophobicContact CB-CE1 4.19Å; W105-F129 AromaticContact CD1-CE1 3.72Å; W105-F129 HydrophobicContact CD2-CD1 4.34Å; W105-F129 AromaticContact CD2-CE1 3.41Å; W105-F129 HydrophobicContact CD2-CE1 3.41Å; W105-F129 VanDerWaalsContact CD2-CE1 3.41Å; W105-F129 AromaticContact CD2-CZ 3.94Å; W105-F129 HydrophobicContact CD2-CZ 3.94Å; W105-F129 AromaticContact CE2-CE1 3.57Å; W105-F129 AromaticContact CE2-CZ 3.83Å; W105-F129 AromaticContact CE3-CE1 3.94Å; W105-F129 HydrophobicContact CE3-CE1 3.94Å; W105-F129 HydrophobicContact CE3-CZ 4.16Å; W105-F129 HydrophobicContact CG-CD1 4.13Å; W105-F129 AromaticContact CG-CE1 3.52Å; W105-F129 HydrophobicContact CG-CE1 3.52Å; W105-F129 HydrophobicContact CG-CZ 4.48Å; W105-F129 HydrophobicContact CH2-CZ 4.21Å; W105-F129 HydrophobicContact CZ2-CE1 4.2Å; W105-F129 AromaticContact CZ2-CZ 3.98Å; W105-F129 HydrophobicContact CZ2-CZ 3.98Å; W105-F129 HydrophobicContact CZ3-CZ 4.29Å; W105-F129 AromaticContact NE1-CE1 3.73Å; L109-F129 HydrophobicContact CD2-CB 4.42Å; L109-F129 HydrophobicContact CD2-CD1 3.82Å; L109-F129 HydrophobicContact CD2-CD2 3.67Å; L109-F129 HydrophobicContact CD2-CE1 3.96Å; L109-F129 HydrophobicContact CD2-CE2 3.83Å; L109-F129 HydrophobicContact CD2-CG 3.67Å; L109-F129 HydrophobicContact CD2-CZ 3.96Å; F117-F129 HydrophobicContact CD1-CE2 4.08Å; F117-F129 HydrophobicContact CD1-CZ 4.46Å; F117-F129 HydrophobicContact CD2-CD2 4.46Å; F117-F129 AromaticContact CD2-CE2 3.63Å; F117-F129 HydrophobicContact CD2-CE2 3.63Å; F117-F129 AromaticContact CE1-CE2 3.79Å; F117-F129 HydrophobicContact CE1-CE2 3.79Å; F117-F129 AromaticContact CE1-CZ 3.8Å; F117-F129 HydrophobicContact CE1-CZ 3.8Å; F117-F129 HydrophobicContact CE2-CD2 4.38Å; F117-F129 AromaticContact CE2-CE2 3.33Å; F117-F129 HydrophobicContact CE2-CE2 3.33Å; F117-F129 AromaticContact CE2-CZ 3.87Å; F117-F129 HydrophobicContact CE2-CZ 3.87Å; F117-F129 AromaticContact CG-CE2 3.99Å; F117-F129 HydrophobicContact CG-CE2 3.99Å; F117-F129 AromaticContact CZ-CE2 3.41Å; F117-F129 HydrophobicContact CZ-CE2 3.41Å; F117-F129 VanDerWaalsContact CZ-CE2 3.41Å; F117-F129 AromaticContact CZ-CZ 3.46Å; F117-F129 HydrophobicContact CZ-CZ 3.46Å; F117-F129 VanDerWaalsContact CZ-CZ 3.46Å; K127-F129 PolarHBondContact O-N 3.43Å; F129-K131 PolarHBondContact O-N 2.91Å; F129-S132 WeakPolarHBondContact O-CB 3.5Å; F129-S132 PolarHBondContact O-N 3.47Å; F129-S133 PolarHBondContact O-N 3.13Å; F129-S133 PolarHBondContact O-OG 3.34Å
130	T	93.1	Very high	94.8	Very high	59 Å²	59	93.1 Å²	93.1	36%	0.362	44%	0.443	S	S	.	.	H	α-helix	trans	-54.8	-46.8	-179.2	52.2	0	0	0	0	113.5	K127 A128 K134	K127-T130 WeakPolarHBondContact O-CG2 3.23Å; K127-T130 PolarHBondContact O-N 2.89Å; K127-T130 PolarHBondContact O-OG1 2.89Å; A128-T130 PolarHBondContact O-N 2.77Å; A128-T130 VanDerWaalsContact O-N 3.1Å; T130-K134 WeakPolarHBondContact O-CG 3.5Å; T130-K134 PolarHBondContact O-N 2.87Å
131	K	93.1	Very high	94.8	Very high	178 Å²	178	89.6 Å²	89.6	77%	0.774	43%	0.425	S	S	*	.	H	α-helix	trans	-69.1	-35	175.4	-64.6	-171.8	177.6	-171	0	112.9	F129 K135	F129-K131 PolarHBondContact O-N 2.91Å; K131-K135 PolarHBondContact O-N 3.22Å
132	S	92.1	Very high	94.8	Very high	39 Å²	39	94.4 Å²	94.4	27%	0.273	45%	0.446	S	S	.	.	H	α-helix	trans	-69.2	-42.5	-179.8	-166.8	0	0	0	0	111.5	F129 K134 K135	F129-S132 WeakPolarHBondContact O-CB 3.5Å; F129-S132 PolarHBondContact O-N 3.47Å; S132-K134 VanDerWaalsContact C-N 3.34Å; S132-K135 WeakPolarHBondContact O-CB 3.2Å; S132-K135 PolarHBondContact O-N 3.37Å
133	S	92.9	Very high	94.9	Very high	28 Å²	28	94.9 Å²	94.9	20%	0.196	45%	0.446	C	S	.	.	H	α-helix	trans	-62.2	-42	175.6	-60.1	0	0	0	0	111.1	E107 F129 K135 W136	E107-S133 WeakPolarHBondContact O-CB 3.34Å; E107-S133 PolarHBondContact O-OG 2.99Å; F129-S133 PolarHBondContact O-N 3.13Å; F129-S133 PolarHBondContact O-OG 3.34Å; S133-K135 PolarHBondContact O-N 3.12Å; S133-W136 WeakPolarHBondContact O-CB 3.48Å; S133-W136 PolarHBondContact O-N 2.88Å
134	K	94.1	Very high	94.9	Very high	146 Å²	146	88.7 Å²	88.7	64%	0.635	43%	0.427	S	S	*	.	H	α-helix	trans	-59.3	-27.7	176.7	-74.9	-175.3	176.4	-158.9	0	114.1	T130 S132 W136 Q137 D138	T130-K134 WeakPolarHBondContact O-CG 3.5Å; T130-K134 PolarHBondContact O-N 2.87Å; S132-K134 VanDerWaalsContact C-N 3.34Å; K134-W136 PolarHBondContact O-N 2.61Å; K134-Q137 PolarHBondContact O-N 2.84Å; K134-D138 PolarHBondContact O-N 2.83Å
135	K	94.3	Very high	95	Very high	91 Å²	91	88.3 Å²	88.3	40%	0.396	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.4	175.9	-68.2	-165.5	173.1	-158.1	0	113.2	K131 S132 S133 Q137 G141 K142 E144 I145	K131-K135 PolarHBondContact O-N 3.22Å; S132-K135 WeakPolarHBondContact O-CB 3.2Å; S132-K135 PolarHBondContact O-N 3.37Å; S133-K135 PolarHBondContact O-N 3.12Å; K135-Q137 PolarHBondContact O-N 3.4Å; K135-G141 CarbonylContact O-C 3.56Å; K135-G141 VanDerWaalsContact O-CA 3.28Å; K135-G141 WeakPolarHBondContact O-CA 3.45Å; K135-K142 PolarHBondContact O-N 2.91Å; K135-K142 VanDerWaalsContact O-N 3.15Å; K135-E144 IonicContact NZ-OE2 2.92Å; K135-E144 PolarHBondContact NZ-OE2 2.86Å; K135-I145 HydrophobicContact CB-CD1 4.05Å
136	W	94.9	Very high	95	Very high	45 Å²	45	81.6 Å²	81.6	17%	0.17	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.7	175.8	-70.8	95.6	0	0	0	112.9	I104 W105 E107 S133 K134 K142 I145 F149 F200	I104-W136 HydrophobicContact CG2-CZ2 4.17Å; W105-W136 WeakPolarHBondContact O-CZ2 3.26Å; W105-W136 PolarHBondContact O-NE1 3.47Å; E107-W136 VanDerWaalsContact CA-CD1 3.47Å; E107-W136 HydrophobicContact CB-CB 3.9Å; E107-W136 HydrophobicContact CB-CD2 4.2Å; E107-W136 HydrophobicContact CB-CG 3.68Å; E107-W136 HydrophobicContact CG-CB 3.71Å; E107-W136 HydrophobicContact CG-CG 4.02Å; S133-W136 WeakPolarHBondContact O-CB 3.48Å; S133-W136 PolarHBondContact O-N 2.88Å; K134-W136 PolarHBondContact O-N 2.61Å; W136-K142 WeakPolarHBondContact O-CE 3.48Å; W136-I145 HydrophobicContact CD2-CD1 3.61Å; W136-I145 HydrophobicContact CE3-CD1 4.03Å; W136-I145 HydrophobicContact CG-CD1 3.9Å; W136-I145 HydrophobicContact CH2-CG2 3.6Å; W136-I145 HydrophobicContact CZ2-CD1 4.13Å; W136-I145 HydrophobicContact CZ2-CG2 3.88Å; W136-I145 HydrophobicContact CZ3-CD1 4.45Å; W136-I145 HydrophobicContact CZ3-CG2 3.99Å; W136-F149 HydrophobicContact CH2-CE2 4.21Å; W136-F200 HydrophobicContact CH2-CD2 4.32Å; W136-F200 HydrophobicContact CH2-CE2 4.17Å; W136-F200 HydrophobicContact CZ2-CD2 4.33Å; W136-F200 HydrophobicContact CZ2-CE2 4.05Å
137	Q	93.9	Very high	95	Very high	128 Å²	128	80.5 Å²	80.5	60%	0.598	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-31.1	-178.9	-62.3	175.3	-4.6	0	0	111.6	E107 K134 K135	E107-Q137 WeakPolarHBondContact OE1-CG 3.48Å; E107-Q137 PolarHBondContact OE1-NE2 3.1Å; K134-Q137 PolarHBondContact O-N 2.84Å; K135-Q137 PolarHBondContact O-N 3.4Å
138	D	94.4	Very high	95.1	Very high	75 Å²	75	75.4 Å²	75.4	40%	0.401	38%	0.379	S	S	.	.	S	Bend	trans	-80.3	131.6	178.2	174.1	53	0	0	0	112.5	K134 L140 G141 K142	K134-D138 PolarHBondContact O-N 2.83Å; D138-L140 VanDerWaalsContact C-N 3.34Å; D138-L140 PolarHBondContact O-N 2.77Å; D138-L140 WeakPolarHBondContact OD2-CB 3.44Å; D138-L140 PolarHBondContact OD2-N 3.16Å; D138-G141 PolarHBondContact O-N 3.04Å; D138-G141 VanDerWaalsContact O-N 3.16Å; D138-G141 PolarHBondContact OD2-N 2.93Å; D138-K142 PolarHBondContact O-N 3.3Å
139	P	95.5	Very high	95.2	Very high	100 Å²	100	75.1 Å²	75.1	65%	0.649	38%	0.375	S	S	*	.	H	α-helix	trans	-56.5	-40.6	178.6	-27.8	35.7	0	0	0	114.4	K142 K143	P139-K142 PolarHBondContact O-N 2.75Å; P139-K143 PolarHBondContact O-N 3.37Å; P139-K143 VanDerWaalsContact O-N 3.15Å
140	L	95.8	Very high	95.3	Very high	124 Å²	124	77.8 Å²	77.8	65%	0.649	39%	0.391	S	S	*	.	H	α-helix	trans	-67.2	-42.9	176.9	-65.2	173.3	0	0	0	110.7	D138 K142 K143 E144	D138-L140 VanDerWaalsContact C-N 3.34Å; D138-L140 PolarHBondContact O-N 2.77Å; D138-L140 WeakPolarHBondContact OD2-CB 3.44Å; D138-L140 PolarHBondContact OD2-N 3.16Å; L140-K142 PolarHBondContact O-N 3.03Å; L140-K143 WeakPolarHBondContact O-CB 3.19Å; L140-K143 PolarHBondContact O-N 2.91Å; L140-E144 PolarHBondContact O-N 3.41Å
141	G	95.7	Very high	95.6	Very high	2 Å²	2	78.9 Å²	78.9	2%	0.021	39%	0.391	C	S	.	.	H	α-helix	trans	-57.7	-43.1	173.2	0	0	0	0	0	113.9	K135 D138 K143 E144 I145	K135-G141 CarbonylContact O-C 3.56Å; K135-G141 VanDerWaalsContact O-CA 3.28Å; K135-G141 WeakPolarHBondContact O-CA 3.45Å; D138-G141 PolarHBondContact O-N 3.04Å; D138-G141 VanDerWaalsContact O-N 3.16Å; D138-G141 PolarHBondContact OD2-N 2.93Å; G141-K143 VanDerWaalsContact C-N 3.34Å; G141-K143 PolarHBondContact O-N 2.77Å; G141-E144 WeakPolarHBondContact O-CB 3.29Å; G141-E144 PolarHBondContact O-N 3.05Å; G141-I145 WeakPolarHBondContact O-CD1 3.27Å; G141-I145 VanDerWaalsContact O-CG1 3.28Å; G141-I145 WeakPolarHBondContact O-CG1 3.35Å; G141-I145 PolarHBondContact O-N 2.99Å
142	K	96	Very high	95.8	Very high	119 Å²	119	70.4 Å²	70.4	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-41.9	174.6	-72.5	-179.2	-178.4	178.4	0	111.8	K135 W136 D138 P139 L140 I145 A146	K135-K142 PolarHBondContact O-N 2.91Å; K135-K142 VanDerWaalsContact O-N 3.15Å; W136-K142 WeakPolarHBondContact O-CE 3.48Å; D138-K142 PolarHBondContact O-N 3.3Å; P139-K142 PolarHBondContact O-N 2.75Å; L140-K142 PolarHBondContact O-N 3.03Å; K142-I145 PolarHBondContact O-N 2.88Å; K142-A146 PolarHBondContact O-N 3.44Å
143	K	96.8	Very high	96.1	Very high	141 Å²	141	71 Å²	71	61%	0.613	35%	0.354	S	S	*	.	H	α-helix	trans	-63.9	-42.2	175.9	-171	177.1	-177.1	176.9	0	111.7	P139 L140 G141 I145 A146 N147	P139-K143 PolarHBondContact O-N 3.37Å; P139-K143 VanDerWaalsContact O-N 3.15Å; L140-K143 WeakPolarHBondContact O-CB 3.19Å; L140-K143 PolarHBondContact O-N 2.91Å; G141-K143 VanDerWaalsContact C-N 3.34Å; G141-K143 PolarHBondContact O-N 2.77Å; K143-I145 VanDerWaalsContact C-N 3.34Å; K143-I145 PolarHBondContact O-N 2.97Å; K143-A146 PolarHBondContact O-N 2.73Å; K143-N147 WeakPolarHBondContact O-CB 3.49Å; K143-N147 PolarHBondContact O-N 3.44Å; K143-N147 PolarHBondContact O-ND2 3.14Å
144	E	96.2	Very high	96.3	Very high	95 Å²	95	76.9 Å²	76.9	44%	0.444	38%	0.376	S	S	.	.	H	α-helix	trans	-60.7	-42.4	174	-72.8	-173.1	168.3	0	0	112.5	K135 L140 G141 N147 D148	K135-E144 IonicContact NZ-OE2 2.92Å; K135-E144 PolarHBondContact NZ-OE2 2.86Å; L140-E144 PolarHBondContact O-N 3.41Å; G141-E144 WeakPolarHBondContact O-CB 3.29Å; G141-E144 PolarHBondContact O-N 3.05Å; E144-N147 PolarHBondContact O-N 2.9Å; E144-D148 PolarHBondContact O-N 3.47Å
145	I	96.6	Very high	96.5	Very high	18 Å²	18	75.6 Å²	75.6	9%	0.092	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-45.6	178.1	-70.3	161.5	0	0	0	110.6	I104 K135 W136 G141 K142 K143 D148 F149	I104-I145 HydrophobicContact CG2-CG2 3.97Å; K135-I145 HydrophobicContact CB-CD1 4.05Å; W136-I145 HydrophobicContact CD2-CD1 3.61Å; W136-I145 HydrophobicContact CE3-CD1 4.03Å; W136-I145 HydrophobicContact CG-CD1 3.9Å; W136-I145 HydrophobicContact CH2-CG2 3.6Å; W136-I145 HydrophobicContact CZ2-CD1 4.13Å; W136-I145 HydrophobicContact CZ2-CG2 3.88Å; W136-I145 HydrophobicContact CZ3-CD1 4.45Å; W136-I145 HydrophobicContact CZ3-CG2 3.99Å; G141-I145 WeakPolarHBondContact O-CD1 3.27Å; G141-I145 VanDerWaalsContact O-CG1 3.28Å; G141-I145 WeakPolarHBondContact O-CG1 3.35Å; G141-I145 PolarHBondContact O-N 2.99Å; K142-I145 PolarHBondContact O-N 2.88Å; K143-I145 VanDerWaalsContact C-N 3.34Å; K143-I145 PolarHBondContact O-N 2.97Å; I145-D148 PolarHBondContact O-N 3.39Å; I145-F149 HydrophobicContact CG2-CD2 3.84Å; I145-F149 HydrophobicContact CG2-CE2 3.59Å; I145-F149 VanDerWaalsContact O-CD2 3.26Å; I145-F149 WeakPolarHBondContact O-CD2 3.37Å; I145-F149 PolarHBondContact O-N 3.05Å
146	A	96.5	Very high	96.6	Very high	41 Å²	41	71.5 Å²	71.5	34%	0.339	35%	0.351	S	S	.	.	H	α-helix	trans	-58.5	-48.8	175.1	0	0	0	0	0	111.5	K142 K143 D148 F149 D150	K142-A146 PolarHBondContact O-N 3.44Å; K143-A146 PolarHBondContact O-N 2.73Å; A146-D148 PolarHBondContact O-N 2.65Å; A146-F149 WeakPolarHBondContact O-CA 3.29Å; A146-F149 WeakPolarHBondContact O-CB 3.49Å; A146-F149 PolarHBondContact O-N 3.39Å; A146-D150 PolarHBondContact O-N 3.34Å
147	N	97.3	Very high	96.7	Very high	73 Å²	73	74.6 Å²	74.6	39%	0.39	37%	0.365	S	S	.	.	H	α-helix	trans	-58	-35.2	175.8	-70.3	-21.4	0	0	0	112.7	K143 E144 K151	K143-N147 WeakPolarHBondContact O-CB 3.49Å; K143-N147 PolarHBondContact O-N 3.44Å; K143-N147 PolarHBondContact O-ND2 3.14Å; E144-N147 PolarHBondContact O-N 2.9Å; N147-K151 VanDerWaalsContact O-CG 3.3Å; N147-K151 WeakPolarHBondContact O-CG 3.28Å; N147-K151 PolarHBondContact O-N 3.01Å
148	D	97.3	Very high	96.9	Very high	31 Å²	31	69.4 Å²	69.4	17%	0.166	34%	0.342	C	S	.	.	H	α-helix	trans	-73	-33.8	176.7	-83.5	-4.1	0	0	0	112	K102 I104 E144 I145 A146 K151 I152	K102-D148 WeakPolarHBondContact CE-OD1 3.4Å; K102-D148 IonicContact NZ-OD1 4Å; K102-D148 PolarHBondContact NZ-OD1 3.22Å; K102-D148 IonicContact NZ-OD2 2.71Å; K102-D148 PolarHBondContact NZ-OD2 3.49Å; I104-D148 HydrophobicContact CD1-CB 3.95Å; I104-D148 HydrophobicContact CG1-CB 4.05Å; E144-D148 PolarHBondContact O-N 3.47Å; I145-D148 PolarHBondContact O-N 3.39Å; A146-D148 PolarHBondContact O-N 2.65Å; D148-K151 PolarHBondContact O-N 3.48Å; D148-K151 IonicContact OD1-NZ 3.26Å; D148-I152 WeakPolarHBondContact O-CG1 3.43Å; D148-I152 PolarHBondContact O-N 3.46Å; D148-I152 VanDerWaalsContact O-N 3.16Å
149	F	97.7	Very high	97.1	Very high	9 Å²	9	65.8 Å²	65.8	4%	0.039	32%	0.323	C	S	.	.	H	α-helix	trans	-62.6	-46.2	169.2	-81.6	-69.4	0	0	0	111	V88 I104 W136 I145 A146 K151 I152 I153 V193 R197 F200	V88-F149 HydrophobicContact CG1-CD1 4.47Å; V88-F149 HydrophobicContact CG1-CE1 3.81Å; I104-F149 HydrophobicContact CB-CZ 4.49Å; I104-F149 HydrophobicContact CD1-CB 4.16Å; I104-F149 HydrophobicContact CD1-CD1 3.5Å; I104-F149 VanDerWaalsContact CD1-CD1 3.5Å; I104-F149 HydrophobicContact CD1-CD2 3.71Å; I104-F149 HydrophobicContact CD1-CE1 3.77Å; I104-F149 HydrophobicContact CD1-CE2 3.94Å; I104-F149 HydrophobicContact CD1-CG 3.48Å; I104-F149 VanDerWaalsContact CD1-CG 3.48Å; I104-F149 HydrophobicContact CD1-CZ 3.98Å; I104-F149 HydrophobicContact CG2-CE2 3.93Å; I104-F149 HydrophobicContact CG2-CZ 3.91Å; W136-F149 HydrophobicContact CH2-CE2 4.21Å; I145-F149 HydrophobicContact CG2-CD2 3.84Å; I145-F149 HydrophobicContact CG2-CE2 3.59Å; I145-F149 VanDerWaalsContact O-CD2 3.26Å; I145-F149 WeakPolarHBondContact O-CD2 3.37Å; I145-F149 PolarHBondContact O-N 3.05Å; A146-F149 WeakPolarHBondContact O-CA 3.29Å; A146-F149 WeakPolarHBondContact O-CB 3.49Å; A146-F149 PolarHBondContact O-N 3.39Å; F149-K151 VanDerWaalsContact C-N 3.29Å; F149-K151 PolarHBondContact O-N 2.74Å; F149-I152 WeakPolarHBondContact O-CA 3.4Å; F149-I152 WeakPolarHBondContact O-CB 3.41Å; F149-I152 PolarHBondContact O-N 3.19Å; F149-I153 WeakPolarHBondContact O-CG1 3.3Å; F149-I153 PolarHBondContact O-N 3.12Å; F149-V193 HydrophobicContact CD1-CG1 3.55Å; F149-V193 HydrophobicContact CE1-CG1 4.18Å; F149-R197 HydrophobicContact CE1-CB 4.07Å; F149-R197 HydrophobicContact CE1-CG 4.42Å; F149-R197 HydrophobicContact CZ-CB 4.11Å; F149-R197 HydrophobicContact CZ-CG 4.01Å; F149-F200 HydrophobicContact CE1-CZ 4.44Å; F149-F200 AromaticContact CZ-CE2 3.87Å; F149-F200 HydrophobicContact CZ-CE2 3.87Å; F149-F200 HydrophobicContact CZ-CZ 4.02Å
150	D	97.8	Very high	97.2	Very high	92 Å²	92	62.9 Å²	62.9	49%	0.492	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-38.2	179	-62.8	-28.1	0	0	0	111.9	A146 I152 I153 K154	A146-D150 PolarHBondContact O-N 3.34Å; D150-I152 VanDerWaalsContact C-N 3.34Å; D150-I152 PolarHBondContact O-N 3.16Å; D150-I153 PolarHBondContact O-N 2.75Å; D150-K154 VanDerWaalsContact O-CB 3.27Å; D150-K154 WeakPolarHBondContact O-CB 3.36Å; D150-K154 PolarHBondContact O-N 3.44Å
151	K	97.8	Very high	97.4	Very high	82 Å²	82	57 Å²	57	36%	0.357	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-38.2	172.6	-74.8	169.1	-170.1	164.1	0	112.5	N147 D148 F149 Y155	N147-K151 VanDerWaalsContact O-CG 3.3Å; N147-K151 WeakPolarHBondContact O-CG 3.28Å; N147-K151 PolarHBondContact O-N 3.01Å; D148-K151 PolarHBondContact O-N 3.48Å; D148-K151 IonicContact OD1-NZ 3.26Å; F149-K151 VanDerWaalsContact C-N 3.29Å; F149-K151 PolarHBondContact O-N 2.74Å; K151-Y155 HydrophobicContact CB-CD2 4.29Å; K151-Y155 HydrophobicContact CG-CE2 4.36Å; K151-Y155 WeakPolarHBondContact O-CB 3.47Å; K151-Y155 WeakPolarHBondContact O-CD2 3.17Å; K151-Y155 PolarHBondContact O-N 3.31Å; K151-Y155 VanDerWaalsContact O-N 3.09Å
152	I	98.2	Very high	97.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-48.4	175.7	-66.3	172.6	0	0	0	109.2	V88 K102 I104 D148 F149 D150 K154 C156 V159 V193	V88-I152 HydrophobicContact CG1-CD1 4.13Å; K102-I152 HydrophobicContact CB-CD1 4.19Å; K102-I152 HydrophobicContact CB-CG1 3.93Å; I104-I152 HydrophobicContact CD1-CD1 3.74Å; I104-I152 HydrophobicContact CG1-CD1 4.21Å; D148-I152 WeakPolarHBondContact O-CG1 3.43Å; D148-I152 PolarHBondContact O-N 3.46Å; D148-I152 VanDerWaalsContact O-N 3.16Å; F149-I152 WeakPolarHBondContact O-CA 3.4Å; F149-I152 WeakPolarHBondContact O-CB 3.41Å; F149-I152 PolarHBondContact O-N 3.19Å; D150-I152 VanDerWaalsContact C-N 3.34Å; D150-I152 PolarHBondContact O-N 3.16Å; I152-K154 VanDerWaalsContact C-N 3.34Å; I152-K154 PolarHBondContact O-N 2.96Å; I152-C156 HydrophobicContact CG2-CB 4.05Å; I152-C156 WeakPolarHBondContact O-CB 3.45Å; I152-C156 PolarHBondContact O-N 2.79Å; I152-V159 HydrophobicContact CG2-CG2 4.18Å; I152-V193 HydrophobicContact CB-CG2 4.41Å; I152-V193 HydrophobicContact CG2-CG2 3.59Å
153	I	98	Very high	97.6	Very high	51 Å²	51	51.9 Å²	51.9	26%	0.262	25%	0.246	S	C	.	.	H	α-helix	trans	-57.4	-47.4	178.8	-69.7	170.6	0	0	0	111.2	F149 D150 V190 V193	F149-I153 WeakPolarHBondContact O-CG1 3.3Å; F149-I153 PolarHBondContact O-N 3.12Å; D150-I153 PolarHBondContact O-N 2.75Å; I153-V190 HydrophobicContact CG2-CG2 3.64Å; I153-V193 HydrophobicContact CD1-CB 4.36Å; I153-V193 HydrophobicContact CD1-CG1 4.06Å; I153-V193 HydrophobicContact CG1-CB 3.9Å; I153-V193 HydrophobicContact CG1-CG1 3.9Å; I153-V193 HydrophobicContact CG1-CG2 3.89Å
154	K	97.8	Very high	97.7	Very high	152 Å²	152	45.2 Å²	45.2	66%	0.661	22%	0.217	S	C	*	.	H	α-helix	trans	-70.9	-40.8	-174.7	-175.2	172	179.9	179	0	113.8	D150 I152	D150-K154 VanDerWaalsContact O-CB 3.27Å; D150-K154 WeakPolarHBondContact O-CB 3.36Å; D150-K154 PolarHBondContact O-N 3.44Å; I152-K154 VanDerWaalsContact C-N 3.34Å; I152-K154 PolarHBondContact O-N 2.96Å
155	Y	97.5	Very high	97.7	Very high	118 Å²	118	40.7 Å²	40.7	46%	0.463	20%	0.196	S	C	.	.	H	α-helix	trans	-115.5	-18.1	-165.6	-60.1	-64.2	0	0	0	114.8	I92 L101 K151	I92-Y155 WeakPolarHBondContact CG1-O 3.36Å; L101-Y155 HydrophobicContact CD2-CD2 4.15Å; L101-Y155 HydrophobicContact CD2-CG 4.3Å; K151-Y155 HydrophobicContact CB-CD2 4.29Å; K151-Y155 HydrophobicContact CG-CE2 4.36Å; K151-Y155 WeakPolarHBondContact O-CB 3.47Å; K151-Y155 WeakPolarHBondContact O-CD2 3.17Å; K151-Y155 PolarHBondContact O-N 3.31Å; K151-Y155 VanDerWaalsContact O-N 3.09Å
156	C	97.5	Very high	97.7	Very high	6 Å²	6	41.8 Å²	41.8	4%	0.041	20%	0.201	C	C	.	.			trans	-92.4	136	-173.2	-62.1	0	0	0	0	111.8	G90 Y91 L101 I152 V189	G90-C156 WeakPolarHBondContact CA-SG 3.32Å; Y91-C156 CarbonylContact O-C 3.54Å; Y91-C156 WeakPolarHBondContact O-CA 3.24Å; Y91-C156 WeakPolarHBondContact O-CB 3.48Å; L101-C156 VanDerWaalsContact CD2-SG 3.57Å; I152-C156 HydrophobicContact CG2-CB 4.05Å; I152-C156 WeakPolarHBondContact O-CB 3.45Å; I152-C156 PolarHBondContact O-N 2.79Å; C156-V189 WeakPolarHBondContact O-CG1 3.33Å
157	K	96.1	Very high	97.6	Very high	109 Å²	109	40 Å²	40	47%	0.474	19%	0.185	S	C	.	.	S	Bend	trans	-90.2	-29	173.1	-171.3	173.3	-174.8	177.8	0	112.2	Y91 E93	Y91-K157 PolarHBondContact O-N 2.92Å; E93-K157 HydrophobicContact CB-CB 4.36Å; E93-K157 HydrophobicContact CB-CD 4.07Å; E93-K157 HydrophobicContact CG-CD 4.44Å; E93-K157 IonicContact OE1-NZ 2.69Å; E93-K157 PolarHBondContact OE1-NZ 3.05Å; E93-K157 WeakPolarHBondContact OE2-CD 3.48Å; E93-K157 WeakPolarHBondContact OE2-CE 3.43Å; E93-K157 IonicContact OE2-NZ 3.19Å; E93-K157 PolarHBondContact OE2-NZ 2.88Å
158	V	98.1	Very high	97.4	Very high	19 Å²	19	42.7 Å²	42.7	12%	0.115	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126	-177	175.5	0	0	0	0	109.8	Y91 L98 R160 Q183	Y91-V158 PolarHBondContact N-O 3.16Å; Y91-V158 PolarHBondContact O-N 3.33Å; L98-V158 HydrophobicContact CD1-CB 4.48Å; L98-V158 HydrophobicContact CD1-CG2 4.05Å; L98-V158 HydrophobicContact CD2-CG2 4.17Å; V158-R160 HydrophobicContact CG1-CG 4.15Å; V158-Q183 HydrophobicContact CG1-CG 3.85Å
159	V	98.5	Very high	97.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.6	175.9	-177.9	0	0	0	0	108.8	V88 I152 V184 V189 K192 V193	V88-V159 HydrophobicContact CG2-CG1 3.48Å; V88-V159 VanDerWaalsContact CG2-CG1 3.48Å; I152-V159 HydrophobicContact CG2-CG2 4.18Å; V159-V184 PolarHBondContact O-N 3.24Å; V159-V189 HydrophobicContact CG2-CG1 4Å; V159-K192 HydrophobicContact CB-CB 4.05Å; V159-K192 HydrophobicContact CG1-CB 4.34Å; V159-K192 HydrophobicContact CG2-CB 4.15Å; V159-V193 HydrophobicContact CG1-CG2 4.28Å; V159-V193 HydrophobicContact CG2-CG2 3.86Å
160	R	98.7	Very high	96.8	Very high	39 Å²	39	44.1 Å²	44.1	15%	0.147	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.3	172.6	-48.7	-163.5	169.5	145	1.7	110.5	V88 I89 Y91 V158 E181 I182 Q183	V88-R160 CarbonylContact C-O 3.59Å; V88-R160 WeakPolarHBondContact CA-O 3.4Å; V88-R160 WeakPolarHBondContact CG2-O 3.44Å; I89-R160 HydrophobicContact CG2-CB 3.73Å; I89-R160 WeakPolarHBondContact CG2-O 3.09Å; I89-R160 PolarHBondContact N-O 3.34Å; I89-R160 PolarHBondContact O-N 3.13Å; Y91-R160 HydrophobicContact CD2-CG 4.14Å; Y91-R160 HydrophobicContact CE2-CG 4.03Å; V158-R160 HydrophobicContact CG1-CG 4.15Å; R160-E181 HydrophobicContact CB-CB 4.14Å; R160-E181 IonicContact NH1-OE2 3.51Å; R160-I182 CarbonylContact C-O 3.43Å; R160-I182 WeakPolarHBondContact CA-O 3.45Å; R160-I182 WeakPolarHBondContact CB-O 3.3Å; R160-Q183 HydrophobicContact CG-CB 4.15Å; R160-Q183 HydrophobicContact CG-CG 4.28Å
161	V	98.6	Very high	96.3	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	144	168.2	-67.1	0	0	0	0	110.1	L42 I85 G87 E181 I182 V184 W195 A196	L42-V161 HydrophobicContact CD2-CG2 3.6Å; I85-V161 HydrophobicContact CD1-CB 4.06Å; I85-V161 HydrophobicContact CD1-CG1 4.08Å; I85-V161 HydrophobicContact CD1-CG2 3.91Å; I85-V161 HydrophobicContact CG1-CB 4.11Å; I85-V161 HydrophobicContact CG1-CG2 4.04Å; I85-V161 HydrophobicContact CG2-CB 3.92Å; I85-V161 HydrophobicContact CG2-CG1 4.11Å; G87-V161 CarbonylContact O-C 3.56Å; G87-V161 WeakPolarHBondContact O-CA 3.38Å; V161-E181 CarbonylContact O-C 3.54Å; V161-E181 VanDerWaalsContact O-CA 3.23Å; V161-E181 WeakPolarHBondContact O-CA 3.09Å; V161-I182 HydrophobicContact CG2-CB 4.02Å; V161-I182 PolarHBondContact N-O 2.75Å; V161-I182 PolarHBondContact O-N 2.75Å; V161-V184 HydrophobicContact CG1-CG2 3.77Å; V161-V184 HydrophobicContact CG2-CG2 4.28Å; V161-W195 HydrophobicContact CG1-CZ3 4.19Å; V161-A196 HydrophobicContact CG1-CB 3.57Å
162	I	98.4	Very high	95.9	Very high	12 Å²	12	47.6 Å²	47.6	6%	0.062	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	112.3	169.9	-57.7	177.1	0	0	0	106.9	V86 G87 I89 T103 W105 I179 E181	V86-I162 HydrophobicContact CG2-CG2 4.12Å; V86-I162 WeakPolarHBondContact CG2-O 2.99Å; V86-I162 PolarHBondContact N-O 2.94Å; G87-I162 PolarHBondContact N-O 3.48Å; G87-I162 PolarHBondContact O-N 3.37Å; I89-I162 HydrophobicContact CG2-CG1 4.38Å; T103-I162 HydrophobicContact CG2-CD1 3.55Å; W105-I162 HydrophobicContact CH2-CD1 3.7Å; W105-I162 HydrophobicContact CH2-CG2 3.79Å; W105-I162 HydrophobicContact CZ2-CD1 3.77Å; W105-I162 HydrophobicContact CZ3-CB 4.34Å; W105-I162 HydrophobicContact CZ3-CD1 4.11Å; W105-I162 HydrophobicContact CZ3-CG2 3.72Å; I162-I179 HydrophobicContact CG2-CG2 3.39Å; I162-E181 HydrophobicContact CG1-CG 4.21Å
163	A	98.4	Very high	95.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	149.6	-179.1	0	0	0	0	0	111.3	M83 V84 I85 I179 M180 I182	M83-A163 HydrophobicContact CB-CB 4.48Å; M83-A163 HydrophobicContact CE-CB 3.64Å; V84-A163 CarbonylContact O-C 3.52Å; V84-A163 WeakPolarHBondContact O-CA 3.34Å; I85-A163 HydrophobicContact CG1-CB 4.08Å; A163-I179 CarbonylContact O-C 3.49Å; A163-I179 WeakPolarHBondContact O-CA 3.3Å; A163-M180 PolarHBondContact N-O 2.68Å; A163-M180 PolarHBondContact O-N 3.26Å; A163-M180 VanDerWaalsContact O-O 3.1Å; A163-I182 HydrophobicContact CB-CD1 3.81Å
164	H	98	Very high	95.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.3	176.8	75.2	82.4	0	0	0	112.7	M83 V84 V86 S110 D112 C113 A177 H178 I179	M83-H164 CarbonylContact C-O 3.57Å; M83-H164 VanDerWaalsContact CA-O 3.27Å; M83-H164 WeakPolarHBondContact CA-O 3.49Å; V84-H164 PolarHBondContact N-O 2.81Å; V84-H164 PolarHBondContact O-N 2.52Å; V86-H164 WeakPolarHBondContact CG1-CD2 3.47Å; V86-H164 WeakPolarHBondContact CG1-NE2 3.01Å; S110-H164 PolarHBondContact OG-CE1 3.41Å; S110-H164 PolarHBondContact OG-NE2 2.83Å; D112-H164 IonicContact OD1-CE1 2.85Å; C113-H164 VanDerWaalsContact SG-CD2 3.59Å; H164-A177 HydrophobicContact CB-CB 4.07Å; H164-H178 VanDerWaalsContact CA-O 3.29Å; H164-H178 WeakPolarHBondContact CA-O 3.25Å; H164-I179 HydrophobicContact CB-CB 4.45Å; H164-I179 HydrophobicContact CB-CG1 3.86Å
165	T	97.6	Very high	95.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	147.8	172.2	59.6	0	0	0	0	111	I46 Y48 M83 M167 A177 H178	I46-T165 HydrophobicContact CB-CG2 3.54Å; I46-T165 HydrophobicContact CD1-CG2 4Å; I46-T165 HydrophobicContact CG1-CG2 4.31Å; I46-T165 HydrophobicContact CG2-CG2 3.45Å; I46-T165 VanDerWaalsContact CG2-CG2 3.45Å; Y48-T165 HydrophobicContact CE2-CG2 4.04Å; Y48-T165 WeakPolarHBondContact OH-CB 3.34Å; Y48-T165 WeakPolarHBondContact OH-CG2 3.08Å; Y48-T165 PolarHBondContact OH-OG1 3.27Å; M83-T165 HydrophobicContact CG-CG2 4.31Å; T165-M167 PolarHBondContact O-N 2.85Å; T165-A177 WeakPolarHBondContact O-CB 3.36Å; T165-H178 HydrophobicContact CG2-CB 4.34Å; T165-H178 PolarHBondContact N-O 2.85Å; T165-H178 VanDerWaalsContact N-O 3.16Å; T165-H178 PolarHBondContact OG1-N 2.87Å
166	Q	95.4	Very high	95.3	Very high	41 Å²	41	48.3 Å²	48.3	19%	0.192	24%	0.235	C	C	.	.			trans	-89.6	97.6	172.1	-60.8	-176.3	19	0	0	111	P82 V84 D112 K168 L169 S203	P82-Q166 WeakPolarHBondContact O-CG 3.42Å; V84-Q166 HydrophobicContact CG2-CG 3.83Å; D112-Q166 WeakPolarHBondContact OD2-CA 3.46Å; Q166-K168 VanDerWaalsContact C-N 3.3Å; Q166-K168 PolarHBondContact O-N 3.19Å; Q166-L169 HydrophobicContact CB-CD1 3.92Å; Q166-L169 HydrophobicContact CB-CG 3.98Å; Q166-S203 PolarHBondContact NE2-OG 3.05Å
167	M	94.5	Very high	95.3	Very high	4 Å²	4	48 Å²	48	2%	0.02	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-75.2	-21.5	-175.5	-73.5	-60.6	-54.9	0	0	113.3	Y48 D112 T165 L169 M170 H172 Q174 K176	Y48-M167 HydrophobicContact CE1-CE 4.47Å; Y48-M167 HydrophobicContact CE1-SD 3.93Å; Y48-M167 HydrophobicContact CE2-SD 4.19Å; Y48-M167 PolarHBondContact OH-SD 3.39Å; D112-M167 PolarHBondContact OD2-N 2.52Å; T165-M167 PolarHBondContact O-N 2.85Å; M167-L169 VanDerWaalsContact C-N 3.26Å; M167-L169 PolarHBondContact O-N 3.02Å; M167-M170 HydrophobicContact CE-CB 4.47Å; M167-M170 WeakPolarHBondContact O-CB 3.01Å; M167-M170 PolarHBondContact O-N 2.83Å; M167-M170 VanDerWaalsContact O-N 3.14Å; M167-H172 HydrophobicContact CE-CB 4.23Å; M167-Q174 WeakPolarHBondContact CB-O 3.39Å; M167-Q174 HydrophobicContact CE-CB 4.12Å; M167-Q174 HydrophobicContact CE-CG 4.26Å; M167-Q174 WeakPolarHBondContact CE-O 3.34Å; M167-K176 WeakPolarHBondContact CG-O 2.95Å
168	K	92.7	Very high	95.4	Very high	130 Å²	130	43.4 Å²	43.4	57%	0.565	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65.5	-29.3	178.7	-65.1	-175.3	177.3	-171.4	0	112.6	E111 Q166 M170	E111-K168 IonicContact OE2-NZ 3.25Å; E111-K168 PolarHBondContact OE2-NZ 3.11Å; Q166-K168 VanDerWaalsContact C-N 3.3Å; Q166-K168 PolarHBondContact O-N 3.19Å; K168-M170 PolarHBondContact O-N 2.95Å
169	L	92.9	Very high	95.3	Very high	63 Å²	63	43.9 Å²	43.9	33%	0.33	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-70.6	-21.9	175.6	-60.6	-174.4	0	0	0	112.6	P81 P82 Q166 M167 Q322	P81-L169 HydrophobicContact CB-CD1 4.38Å; P82-L169 HydrophobicContact CG-CD1 3.98Å; Q166-L169 HydrophobicContact CB-CD1 3.92Å; Q166-L169 HydrophobicContact CB-CG 3.98Å; M167-L169 VanDerWaalsContact C-N 3.26Å; M167-L169 PolarHBondContact O-N 3.02Å; L169-Q322 HydrophobicContact CB-CG 4.23Å
170	M	91.1	Very high	95.3	Very high	6 Å²	6	44 Å²	44	3%	0.03	22%	0.216	C	C	.	.	S	Bend	trans	-94.5	131.8	-178.3	-53.6	-67.2	-66.7	0	0	109.1	Y48 E79 P81 M167 K168 H172 Y317 Q322	Y48-M170 HydrophobicContact CD2-CE 3.99Å; Y48-M170 HydrophobicContact CG-CE 4.24Å; E79-M170 HydrophobicContact CB-CE 4.01Å; E79-M170 VanDerWaalsContact CD-SD 3.58Å; E79-M170 HydrophobicContact CG-CE 3.65Å; E79-M170 HydrophobicContact CG-SD 3.88Å; E79-M170 WeakPolarHBondContact OE2-CE 3.43Å; P81-M170 HydrophobicContact CB-CG 4.38Å; P81-M170 HydrophobicContact CB-SD 3.94Å; P81-M170 HydrophobicContact CG-CG 3.96Å; P81-M170 HydrophobicContact CG-SD 3.62Å; M167-M170 HydrophobicContact CE-CB 4.47Å; M167-M170 WeakPolarHBondContact O-CB 3.01Å; M167-M170 PolarHBondContact O-N 2.83Å; M167-M170 VanDerWaalsContact O-N 3.14Å; K168-M170 PolarHBondContact O-N 2.95Å; M170-H172 PolarHBondContact O-N 2.75Å; M170-Y317 WeakPolarHBondContact CE-OH 3.28Å; M170-Q322 HydrophobicContact SD-CG 4.05Å
171	R	86.4	Confident	95.3	Very high	215 Å²	215	45.2 Å²	45.2	81%	0.811	22%	0.223	S	C	*	.			trans	-79.2	43.6	177.4	-62	-174.5	179.2	-172.1	0.5	112.7
172	H	89.2	Confident	95.3	Very high	32 Å²	32	45.3 Å²	45.3	15%	0.148	22%	0.223	C	C	.	.	S	Bend	trans	-100	151.3	176	-64	-46.5	0	0	0	110.5	M167 M170 Q174 Y317	M167-H172 HydrophobicContact CE-CB 4.23Å; M170-H172 PolarHBondContact O-N 2.75Å; H172-Q174 PolarHBondContact O-N 3.18Å; H172-Q174 VanDerWaalsContact O-N 3.1Å; H172-Y317 AromaticContact CE1-CD2 3.75Å; H172-Y317 AromaticContact CE1-CE2 3.34Å; H172-Y317 WeakPolarHBondContact CE1-CE2 3.44Å; H172-Y317 AromaticContact CE1-CZ 3.54Å; H172-Y317 AromaticContact NE2-CE2 3.39Å; H172-Y317 WeakPolarHBondContact NE2-CE2 3.14Å; H172-Y317 AromaticContact NE2-CZ 3.38Å; H172-Y317 PolarHBondContact NE2-OH 3.36Å
173	G	92.3	Very high	95.3	Very high	85 Å²	85	45.6 Å²	45.6	88%	0.876	23%	0.225	S	C	*	.	S	Bend	trans	-64.2	-15.6	177.3	0	0	0	0	0	114.9	K175	G173-K175 PolarHBondContact O-N 2.85Å
174	Q	94.6	Very high	95.3	Very high	74 Å²	74	45.6 Å²	45.6	35%	0.346	22%	0.224	S	C	.	.			trans	-82.7	115.8	178.2	175.4	177	-21.2	0	0	111.2	M167 H172 K176 H178	M167-Q174 WeakPolarHBondContact CB-O 3.39Å; M167-Q174 HydrophobicContact CE-CB 4.12Å; M167-Q174 HydrophobicContact CE-CG 4.26Å; M167-Q174 WeakPolarHBondContact CE-O 3.34Å; H172-Q174 PolarHBondContact O-N 3.18Å; H172-Q174 VanDerWaalsContact O-N 3.1Å; Q174-K176 HydrophobicContact CG-CB 4.19Å; Q174-K176 PolarHBondContact NE2-O 3.23Å; Q174-H178 PolarHBondContact NE2-CE1 3.26Å; Q174-H178 PolarHBondContact NE2-NE2 3.38Å
175	K	95.5	Very high	95.3	Very high	126 Å²	126	45.7 Å²	45.7	55%	0.548	23%	0.225	S	C	.	.			trans	-89.4	-3.1	174.6	-57.3	-176.3	179.9	-176.8	0	114.8	D112 G173	D112-K175 WeakPolarHBondContact CB-O 3.18Å; G173-K175 PolarHBondContact O-N 2.85Å
176	K	96.4	Very high	95.3	Very high	51 Å²	51	45.7 Å²	45.7	22%	0.222	23%	0.225	C	C	.	.			trans	-95.7	114.1	-169.9	-174.2	176.5	-174.6	158.6	0	111.3	R115 R116 Y118 M167 Q174	R115-K176 HydrophobicContact CB-CB 4.39Å; R115-K176 HydrophobicContact CB-CG 4.19Å; R115-K176 WeakPolarHBondContact O-CE 3.42Å; R115-K176 PolarHBondContact O-NZ 2.9Å; R116-K176 PolarHBondContact NH2-O 3.06Å; R116-K176 VanDerWaalsContact O-CE 3.23Å; R116-K176 WeakPolarHBondContact O-CE 3.48Å; R116-K176 PolarHBondContact O-NZ 2.63Å; Y118-K176 PolarHBondContact O-NZ 2.99Å; M167-K176 WeakPolarHBondContact CG-O 2.95Å; Q174-K176 HydrophobicContact CG-CB 4.19Å; Q174-K176 PolarHBondContact NE2-O 3.23Å
177	A	97.4	Very high	95.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.			trans	-62.7	141	-177.9	0	0	0	0	0	113.3	D112 R116 H164 T165	D112-A177 VanDerWaalsContact C-CB 3.47Å; D112-A177 HydrophobicContact CB-CB 4.1Å; D112-A177 VanDerWaalsContact O-CB 3.26Å; D112-A177 WeakPolarHBondContact O-CB 3.2Å; D112-A177 PolarHBondContact O-N 3.2Å; R116-A177 PolarHBondContact NE-O 3.1Å; R116-A177 VanDerWaalsContact NH2-C 3.27Å; R116-A177 PolarHBondContact NH2-O 3.5Å; H164-A177 HydrophobicContact CB-CB 4.07Å; T165-A177 WeakPolarHBondContact O-CB 3.36Å
178	H	98	Very high	95.6	Very high	13 Å²	13	46.5 Å²	46.5	6%	0.06	24%	0.237	C	C	.	.			trans	-84.6	114.9	171.7	-66.4	99.9	0	0	0	109.9	I46 Y48 R116 H164 T165 Q174 V338	I46-H178 HydrophobicContact CD1-CB 4.1Å; Y48-H178 AromaticContact CE1-CE1 3.83Å; Y48-H178 AromaticContact CE1-ND1 3.71Å; Y48-H178 AromaticContact CZ-ND1 3.68Å; Y48-H178 PolarHBondContact OH-ND1 2.91Å; R116-H178 PolarHBondContact NH2-CD2 3.06Å; R116-H178 VanDerWaalsContact NH2-CD2 3.35Å; H164-H178 VanDerWaalsContact CA-O 3.29Å; H164-H178 WeakPolarHBondContact CA-O 3.25Å; T165-H178 HydrophobicContact CG2-CB 4.34Å; T165-H178 PolarHBondContact N-O 2.85Å; T165-H178 VanDerWaalsContact N-O 3.16Å; T165-H178 PolarHBondContact OG1-N 2.87Å; Q174-H178 PolarHBondContact NE2-CE1 3.26Å; Q174-H178 PolarHBondContact NE2-NE2 3.38Å; H178-V338 HydrophobicContact CB-CG2 4.45Å
179	I	97.4	Very high	95.8	Very high	28 Å²	28	42 Å²	42	14%	0.144	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.6	-179.2	-56.6	-177	0	0	0	110.8	R25 C113 R116 F117 I162 A163 H164	R25-I179 VanDerWaalsContact NH1-C 3.26Å; R25-I179 PolarHBondContact NH1-O 2.99Å; C113-I179 VanDerWaalsContact SG-CD1 3.57Å; R116-I179 HydrophobicContact CB-CD1 3.45Å; R116-I179 VanDerWaalsContact CB-CD1 3.45Å; R116-I179 HydrophobicContact CB-CG1 3.98Å; R116-I179 HydrophobicContact CG-CB 4.43Å; R116-I179 HydrophobicContact CG-CD1 3.61Å; R116-I179 HydrophobicContact CG-CG1 3.87Å; F117-I179 HydrophobicContact CE2-CD1 3.64Å; F117-I179 HydrophobicContact CZ-CD1 3.92Å; I162-I179 HydrophobicContact CG2-CG2 3.39Å; A163-I179 CarbonylContact O-C 3.49Å; A163-I179 WeakPolarHBondContact O-CA 3.3Å; H164-I179 HydrophobicContact CB-CB 4.45Å; H164-I179 HydrophobicContact CB-CG1 3.86Å
180	M	97.8	Very high	96.1	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.02	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	155.2	171.7	72.2	175	-73.9	0	0	112.6	R25 V28 A44 I46 M83 A163 I182 T340	R25-M180 VanDerWaalsContact CZ-CB 3.49Å; V28-M180 HydrophobicContact CG2-CE 3.86Å; A44-M180 HydrophobicContact CB-CE 3.77Å; I46-M180 HydrophobicContact CD1-CB 4.1Å; I46-M180 HydrophobicContact CD1-CG 3.73Å; I46-M180 HydrophobicContact CD1-SD 3.59Å; I46-M180 VanDerWaalsContact CD1-SD 3.59Å; I46-M180 HydrophobicContact CG1-CG 4.12Å; I46-M180 HydrophobicContact CG1-SD 3.33Å; I46-M180 WeakPolarHBondContact CG1-SD 3.43Å; M83-M180 HydrophobicContact CE-CG 3.91Å; M83-M180 HydrophobicContact CE-SD 4.33Å; A163-M180 PolarHBondContact N-O 2.68Å; A163-M180 PolarHBondContact O-N 3.26Å; A163-M180 VanDerWaalsContact O-O 3.1Å; M180-I182 HydrophobicContact CE-CG1 3.73Å; M180-I182 HydrophobicContact CG-CD1 4.41Å; M180-I182 HydrophobicContact CG-CG1 3.92Å; M180-I182 HydrophobicContact SD-CG1 4.02Å; M180-T340 HydrophobicContact CE-CG2 3.74Å; M180-T340 HydrophobicContact SD-CG2 3.96Å
181	E	98.3	Very high	96.4	Very high	64 Å²	64	45.1 Å²	45.1	30%	0.299	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	136.4	161.5	-67.2	160.6	-132.1	0	0	109	F31 I89 Y91 R160 V161 I162	F31-E181 WeakPolarHBondContact CZ-O 3.27Å; I89-E181 HydrophobicContact CG2-CG 4.04Å; Y91-E181 WeakPolarHBondContact CE2-OE2 3.08Å; Y91-E181 PolarHBondContact OH-OE2 2.84Å; R160-E181 HydrophobicContact CB-CB 4.14Å; R160-E181 IonicContact NH1-OE2 3.51Å; V161-E181 CarbonylContact O-C 3.54Å; V161-E181 VanDerWaalsContact O-CA 3.23Å; V161-E181 WeakPolarHBondContact O-CA 3.09Å; I162-E181 HydrophobicContact CG1-CG 4.21Å
182	I	98.6	Very high	97	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.3	171.6	-58.1	161.8	0	0	0	107	L42 A44 M83 R160 V161 A163 M180	L42-I182 HydrophobicContact CB-CG2 4.05Å; L42-I182 HydrophobicContact CD1-CD1 4.46Å; L42-I182 HydrophobicContact CD2-CB 4.42Å; L42-I182 HydrophobicContact CD2-CG2 3.91Å; L42-I182 HydrophobicContact CG-CG2 4.44Å; A44-I182 HydrophobicContact CB-CG1 4.35Å; A44-I182 HydrophobicContact CB-CG2 4.05Å; A44-I182 VanDerWaalsContact O-CD1 3.32Å; A44-I182 WeakPolarHBondContact O-CD1 3.46Å; M83-I182 HydrophobicContact CE-CD1 3.98Å; M83-I182 HydrophobicContact SD-CD1 4.45Å; R160-I182 CarbonylContact C-O 3.43Å; R160-I182 WeakPolarHBondContact CA-O 3.45Å; R160-I182 WeakPolarHBondContact CB-O 3.3Å; V161-I182 HydrophobicContact CG2-CB 4.02Å; V161-I182 PolarHBondContact N-O 2.75Å; V161-I182 PolarHBondContact O-N 2.75Å; A163-I182 HydrophobicContact CB-CD1 3.81Å; M180-I182 HydrophobicContact CE-CG1 3.73Å; M180-I182 HydrophobicContact CG-CD1 4.41Å; M180-I182 HydrophobicContact CG-CG1 3.92Å; M180-I182 HydrophobicContact SD-CG1 4.02Å
183	Q	98.6	Very high	97.4	Very high	19 Å²	19	33.6 Å²	33.6	9%	0.089	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	132	176.9	-168.2	172.6	-59.8	0	0	110.3	F31 T43 V158 R160 N185	F31-Q183 HydrophobicContact CB-CB 3.89Å; F31-Q183 HydrophobicContact CB-CG 4.43Å; F31-Q183 HydrophobicContact CD1-CB 3.69Å; F31-Q183 HydrophobicContact CD2-CB 3.86Å; F31-Q183 HydrophobicContact CE1-CB 4.12Å; F31-Q183 HydrophobicContact CE2-CB 4.29Å; F31-Q183 HydrophobicContact CG-CB 3.53Å; F31-Q183 HydrophobicContact CG-CG 4.48Å; F31-Q183 HydrophobicContact CZ-CB 4.4Å; T43-Q183 WeakPolarHBondContact CG2-O 3.25Å; T43-Q183 PolarHBondContact N-O 2.59Å; T43-Q183 PolarHBondContact OG1-O 2.9Å; V158-Q183 HydrophobicContact CG1-CG 3.85Å; R160-Q183 HydrophobicContact CG-CB 4.15Å; R160-Q183 HydrophobicContact CG-CG 4.28Å; Q183-N185 WeakPolarHBondContact CG-OD1 3.2Å; Q183-N185 PolarHBondContact NE2-OD1 3.42Å
184	V	98.6	Very high	97.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.3	172.5	-170.7	0	0	0	0	106.9	V40 L42 V159 V161 K192 W195	V40-V184 HydrophobicContact CG1-CG1 3.27Å; L42-V184 HydrophobicContact CD2-CG2 4.14Å; V159-V184 PolarHBondContact O-N 3.24Å; V161-V184 HydrophobicContact CG1-CG2 3.77Å; V161-V184 HydrophobicContact CG2-CG2 4.28Å; V184-K192 HydrophobicContact CB-CB 4.4Å; V184-K192 HydrophobicContact CB-CG 4.37Å; V184-K192 HydrophobicContact CG1-CB 4.09Å; V184-K192 HydrophobicContact CG1-CG 3.93Å; V184-W195 HydrophobicContact CG1-CE3 4.17Å; V184-W195 HydrophobicContact CG2-CE3 4.37Å; V184-W195 HydrophobicContact CG2-CZ3 4.33Å
185	N	98.3	Very high	97.8	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	162.5	177.7	-77.6	12.5	0	0	0	109.7	P32 K33 D34 V40 H41 T43 Q183	P32-N185 PolarHBondContact O-ND2 3.28Å; K33-N185 PolarHBondContact O-ND2 3.26Å; D34-N185 VanDerWaalsContact OD1-CA 3.25Å; D34-N185 WeakPolarHBondContact OD1-CA 3.46Å; D34-N185 WeakPolarHBondContact OD1-CB 3.28Å; V40-N185 CarbonylContact C-O 3.57Å; V40-N185 WeakPolarHBondContact CA-O 2.87Å; H41-N185 PolarHBondContact N-O 2.82Å; H41-N185 PolarHBondContact ND1-O 2.84Å; H41-N185 PolarHBondContact O-N 2.98Å; T43-N185 HydrophobicContact CG2-CB 3.89Å; Q183-N185 WeakPolarHBondContact CG-OD1 3.2Å; Q183-N185 PolarHBondContact NE2-OD1 3.42Å
186	G	98.1	Very high	97.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	83.6	147.3	-179	0	0	0	0	0	113.1	D34 D35 K38 K192	D34-G186 PolarHBondContact OD1-N 3.05Å; D35-G186 WeakPolarHBondContact O-CA 3.42Å; K38-G186 CarbonylContact O-C 3.58Å; K38-G186 VanDerWaalsContact O-C 3.28Å; K38-G186 WeakPolarHBondContact O-CA 3.37Å; G186-K192 WeakPolarHBondContact O-CE 3.1Å; G186-K192 WeakPolarHBondContact O-CG 3.36Å
187	G	97.7	Very high	97.9	Very high	9 Å²	9	29.6 Å²	29.6	9%	0.093	15%	0.15	C	C	.	.	S	Bend	trans	69.8	178.1	-174.5	0	0	0	0	0	114.4	P36 K38 K192	P36-G187 WeakPolarHBondContact O-CA 3.45Å; P36-G187 PolarHBondContact O-N 3Å; P36-G187 VanDerWaalsContact O-N 3.07Å; K38-G187 PolarHBondContact O-N 3.31Å; G187-K192 WeakPolarHBondContact O-CE 3.18Å; G187-K192 PolarHBondContact O-NZ 2.71Å
188	S	97.6	Very high	97.9	Very high	53 Å²	53	34.1 Å²	34.1	37%	0.371	18%	0.175	S	C	.	.			trans	-69.2	171.8	172	74.5	0	0	0	0	111.4	V190 D191 K192	S188-V190 VanDerWaalsContact C-N 3.25Å; S188-V190 PolarHBondContact O-N 3.09Å; S188-V190 PolarHBondContact OG-N 2.92Å; S188-D191 VanDerWaalsContact CB-OD2 3.28Å; S188-D191 WeakPolarHBondContact CB-OD2 3.4Å; S188-D191 PolarHBondContact N-OD2 2.86Å; S188-D191 PolarHBondContact O-N 2.86Å; S188-D191 PolarHBondContact OG-N 3.13Å; S188-D191 PolarHBondContact OG-OD2 3.1Å; S188-K192 VanDerWaalsContact O-CG 3.3Å; S188-K192 WeakPolarHBondContact O-CG 3.22Å; S188-K192 PolarHBondContact O-N 3.38Å; S188-K192 VanDerWaalsContact O-N 3.14Å
189	V	97.7	Very high	97.9	Very high	35 Å²	35	35.9 Å²	35.9	21%	0.212	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-37.4	173.8	178	0	0	0	0	110.9	C156 V159 K192 V193	C156-V189 WeakPolarHBondContact O-CG1 3.33Å; V159-V189 HydrophobicContact CG2-CG1 4Å; V189-K192 PolarHBondContact O-N 3.39Å; V189-V193 HydrophobicContact CG1-CG2 4.36Å; V189-V193 VanDerWaalsContact O-CG2 3.32Å; V189-V193 WeakPolarHBondContact O-CG2 3.43Å; V189-V193 PolarHBondContact O-N 2.85Å
190	V	97.7	Very high	97.8	Very high	61 Å²	61	35.7 Å²	35.7	37%	0.37	18%	0.181	S	C	.	.	H	α-helix	trans	-59.5	-49.9	177	180	0	0	0	0	110	I153 S188 K192 V193 N194	I153-V190 HydrophobicContact CG2-CG2 3.64Å; S188-V190 VanDerWaalsContact C-N 3.25Å; S188-V190 PolarHBondContact O-N 3.09Å; S188-V190 PolarHBondContact OG-N 2.92Å; V190-K192 VanDerWaalsContact C-N 3.3Å; V190-K192 PolarHBondContact O-N 3.11Å; V190-V193 PolarHBondContact O-N 3.47Å; V190-V193 VanDerWaalsContact O-N 3.13Å; V190-N194 WeakPolarHBondContact CG1-ND2 3.24Å; V190-N194 WeakPolarHBondContact O-CB 3.45Å; V190-N194 PolarHBondContact O-N 2.86Å
191	D	98	Very high	97.7	Very high	74 Å²	74	39 Å²	39	40%	0.396	20%	0.197	S	C	.	.	H	α-helix	trans	-59.9	-42.3	-179.7	-53.7	-40.1	0	0	0	111.4	V40 S188 V193 W195	V40-D191 HydrophobicContact CG2-CB 3.74Å; S188-D191 VanDerWaalsContact CB-OD2 3.28Å; S188-D191 WeakPolarHBondContact CB-OD2 3.4Å; S188-D191 PolarHBondContact N-OD2 2.86Å; S188-D191 PolarHBondContact O-N 2.86Å; S188-D191 PolarHBondContact OG-N 3.13Å; S188-D191 PolarHBondContact OG-OD2 3.1Å; D191-V193 PolarHBondContact O-N 3.31Å; D191-W195 WeakPolarHBondContact O-CB 3.39Å; D191-W195 PolarHBondContact O-N 2.88Å
192	K	98.6	Very high	97.7	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-41	177.3	-68.4	165.3	-171	153.5	0	112.3	D34 V40 V159 V184 G186 G187 S188 V189 V190 A196	D34-K192 IonicContact OD1-NZ 2.92Å; D34-K192 PolarHBondContact OD1-NZ 3.26Å; D34-K192 IonicContact OD2-NZ 3.94Å; D34-K192 PolarHBondContact OD2-NZ 3.19Å; V40-K192 HydrophobicContact CG1-CG 4.45Å; V159-K192 HydrophobicContact CB-CB 4.05Å; V159-K192 HydrophobicContact CG1-CB 4.34Å; V159-K192 HydrophobicContact CG2-CB 4.15Å; V184-K192 HydrophobicContact CB-CB 4.4Å; V184-K192 HydrophobicContact CB-CG 4.37Å; V184-K192 HydrophobicContact CG1-CB 4.09Å; V184-K192 HydrophobicContact CG1-CG 3.93Å; G186-K192 WeakPolarHBondContact O-CE 3.1Å; G186-K192 WeakPolarHBondContact O-CG 3.36Å; G187-K192 WeakPolarHBondContact O-CE 3.18Å; G187-K192 PolarHBondContact O-NZ 2.71Å; S188-K192 VanDerWaalsContact O-CG 3.3Å; S188-K192 WeakPolarHBondContact O-CG 3.22Å; S188-K192 PolarHBondContact O-N 3.38Å; S188-K192 VanDerWaalsContact O-N 3.14Å; V189-K192 PolarHBondContact O-N 3.39Å; V190-K192 VanDerWaalsContact C-N 3.3Å; V190-K192 PolarHBondContact O-N 3.11Å; K192-A196 VanDerWaalsContact O-CB 3.26Å; K192-A196 WeakPolarHBondContact O-CB 3.15Å; K192-A196 PolarHBondContact O-N 3.01Å
193	V	98.1	Very high	97.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-70.6	-45.5	-180	173	0	0	0	0	110.8	F149 I152 I153 V159 V189 V190 D191 A196 R197	F149-V193 HydrophobicContact CD1-CG1 3.55Å; F149-V193 HydrophobicContact CE1-CG1 4.18Å; I152-V193 HydrophobicContact CB-CG2 4.41Å; I152-V193 HydrophobicContact CG2-CG2 3.59Å; I153-V193 HydrophobicContact CD1-CB 4.36Å; I153-V193 HydrophobicContact CD1-CG1 4.06Å; I153-V193 HydrophobicContact CG1-CB 3.9Å; I153-V193 HydrophobicContact CG1-CG1 3.9Å; I153-V193 HydrophobicContact CG1-CG2 3.89Å; V159-V193 HydrophobicContact CG1-CG2 4.28Å; V159-V193 HydrophobicContact CG2-CG2 3.86Å; V189-V193 HydrophobicContact CG1-CG2 4.36Å; V189-V193 VanDerWaalsContact O-CG2 3.32Å; V189-V193 WeakPolarHBondContact O-CG2 3.43Å; V189-V193 PolarHBondContact O-N 2.85Å; V190-V193 PolarHBondContact O-N 3.47Å; V190-V193 VanDerWaalsContact O-N 3.13Å; D191-V193 PolarHBondContact O-N 3.31Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 2.87Å; V193-R197 PolarHBondContact O-N 3.05Å
194	N	97.7	Very high	97.5	Very high	68 Å²	68	43.9 Å²	43.9	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-48.7	177	-70.8	-15.1	0	0	0	110.7	V190 A196 R197 D198	V190-N194 WeakPolarHBondContact CG1-ND2 3.24Å; V190-N194 WeakPolarHBondContact O-CB 3.45Å; V190-N194 PolarHBondContact O-N 2.86Å; N194-A196 VanDerWaalsContact C-N 3.29Å; N194-A196 PolarHBondContact O-N 3.18Å; N194-R197 WeakPolarHBondContact O-CB 3.41Å; N194-R197 PolarHBondContact O-N 3.41Å; N194-R197 VanDerWaalsContact O-N 3.1Å; N194-D198 VanDerWaalsContact O-CG 3.27Å; N194-D198 PolarHBondContact O-N 2.79Å
195	W	98.1	Very high	97.5	Very high	51 Å²	51	44.9 Å²	44.9	19%	0.193	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-44.7	174.3	-175	95.6	0	0	0	111.7	V40 L42 I85 V161 V184 D191 R197 D198 H199 I204	V40-W195 HydrophobicContact CB-CB 4.37Å; V40-W195 HydrophobicContact CB-CG 4.16Å; V40-W195 HydrophobicContact CG1-CB 3.7Å; V40-W195 HydrophobicContact CG1-CD2 3.84Å; V40-W195 HydrophobicContact CG1-CE3 4.36Å; V40-W195 HydrophobicContact CG1-CG 3.51Å; L42-W195 HydrophobicContact CD1-CH2 3.98Å; L42-W195 HydrophobicContact CD2-CH2 3.61Å; L42-W195 HydrophobicContact CD2-CZ3 3.64Å; L42-W195 HydrophobicContact CG-CH2 3.57Å; L42-W195 HydrophobicContact CG-CZ2 4.37Å; L42-W195 HydrophobicContact CG-CZ3 4.15Å; I85-W195 HydrophobicContact CD1-CH2 3.96Å; I85-W195 HydrophobicContact CD1-CZ3 3.88Å; V161-W195 HydrophobicContact CG1-CZ3 4.19Å; V184-W195 HydrophobicContact CG1-CE3 4.17Å; V184-W195 HydrophobicContact CG2-CE3 4.37Å; V184-W195 HydrophobicContact CG2-CZ3 4.33Å; D191-W195 WeakPolarHBondContact O-CB 3.39Å; D191-W195 PolarHBondContact O-N 2.88Å; W195-R197 PolarHBondContact O-N 2.85Å; W195-D198 PolarHBondContact O-N 2.91Å; W195-H199 AromaticContact CD1-CE1 3.58Å; W195-H199 AromaticContact CD1-ND1 3.92Å; W195-H199 AromaticContact CD2-CE1 3.87Å; W195-H199 AromaticContact CD2-ND1 3.62Å; W195-H199 AromaticContact CE2-CE1 3.33Å; W195-H199 AromaticContact CE2-CG 3.99Å; W195-H199 AromaticContact CE2-ND1 3.49Å; W195-H199 AromaticContact CE2-NE2 3.72Å; W195-H199 AromaticContact CG-CE1 3.99Å; W195-H199 AromaticContact CG-ND1 3.87Å; W195-H199 HydrophobicContact CH2-CB 4.44Å; W195-H199 AromaticContact CZ2-CD2 3.77Å; W195-H199 AromaticContact CZ2-CE1 3.76Å; W195-H199 AromaticContact CZ2-CG 3.91Å; W195-H199 AromaticContact CZ2-ND1 3.89Å; W195-H199 AromaticContact CZ2-NE2 3.68Å; W195-H199 HydrophobicContact CZ3-CB 4.43Å; W195-H199 AromaticContact NE1-CE1 3.16Å; W195-H199 PolarHBondContact NE1-CE1 3.12Å; W195-H199 AromaticContact NE1-ND1 3.72Å; W195-H199 AromaticContact NE1-NE2 3.73Å; W195-H199 WeakPolarHBondContact O-CB 3.24Å; W195-H199 PolarHBondContact O-N 2.86Å; W195-H199 VanDerWaalsContact O-N 3.12Å; W195-H199 PolarHBondContact O-ND1 3.15Å; W195-I204 HydrophobicContact CH2-CD1 3.8Å; W195-I204 HydrophobicContact CZ2-CD1 4.37Å
196	A	97.8	Very high	97.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-42.6	177.9	0	0	0	0	0	112.2	V88 V161 K192 V193 N194 H199 F200	V88-A196 HydrophobicContact CB-CB 4.14Å; V88-A196 HydrophobicContact CG2-CB 3.78Å; V161-A196 HydrophobicContact CG1-CB 3.57Å; K192-A196 VanDerWaalsContact O-CB 3.26Å; K192-A196 WeakPolarHBondContact O-CB 3.15Å; K192-A196 PolarHBondContact O-N 3.01Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 2.87Å; N194-A196 VanDerWaalsContact C-N 3.29Å; N194-A196 PolarHBondContact O-N 3.18Å; A196-H199 PolarHBondContact O-N 3.37Å; A196-F200 WeakPolarHBondContact O-CD1 3.46Å; A196-F200 WeakPolarHBondContact O-CE1 3.44Å; A196-F200 PolarHBondContact O-N 2.87Å
197	R	96	Very high	97.4	Very high	132 Å²	132	47.8 Å²	47.8	50%	0.498	25%	0.247	S	C	.	.	H	α-helix	trans	-62.6	-47.1	176.8	-179.4	-179.6	177.5	177.8	-1.4	111.2	F149 V193 N194 W195 H199 F200	F149-R197 HydrophobicContact CE1-CB 4.07Å; F149-R197 HydrophobicContact CE1-CG 4.42Å; F149-R197 HydrophobicContact CZ-CB 4.11Å; F149-R197 HydrophobicContact CZ-CG 4.01Å; V193-R197 PolarHBondContact O-N 3.05Å; N194-R197 WeakPolarHBondContact O-CB 3.41Å; N194-R197 PolarHBondContact O-N 3.41Å; N194-R197 VanDerWaalsContact O-N 3.1Å; W195-R197 PolarHBondContact O-N 2.85Å; R197-H199 PolarHBondContact O-N 2.8Å; R197-F200 WeakPolarHBondContact O-CB 3.48Å; R197-F200 PolarHBondContact O-N 2.82Å; R197-F200 VanDerWaalsContact O-N 3.11Å
198	D	97.1	Very high	97.4	Very high	96 Å²	96	54.6 Å²	54.6	51%	0.513	27%	0.274	S	S	.	.	H	α-helix	trans	-65.8	-21.9	-179.1	-65.6	-20.2	0	0	0	112.8	N194 W195 K202	N194-D198 VanDerWaalsContact O-CG 3.27Å; N194-D198 PolarHBondContact O-N 2.79Å; W195-D198 PolarHBondContact O-N 2.91Å; D198-K202 VanDerWaalsContact O-CD 3.29Å; D198-K202 WeakPolarHBondContact O-CD 3.43Å; D198-K202 WeakPolarHBondContact O-CE 3.21Å; D198-K202 PolarHBondContact O-NZ 2.93Å
199	H	97.4	Very high	97.4	Very high	49 Å²	49	52.5 Å²	52.5	23%	0.227	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	5.4	178.1	-69.2	75.1	0	0	0	113.9	I85 W195 A196 R197 E201 K202	I85-H199 WeakPolarHBondContact CB-O 3.43Å; I85-H199 HydrophobicContact CD1-CB 3.81Å; W195-H199 AromaticContact CD1-CE1 3.58Å; W195-H199 AromaticContact CD1-ND1 3.92Å; W195-H199 AromaticContact CD2-CE1 3.87Å; W195-H199 AromaticContact CD2-ND1 3.62Å; W195-H199 AromaticContact CE2-CE1 3.33Å; W195-H199 AromaticContact CE2-CG 3.99Å; W195-H199 AromaticContact CE2-ND1 3.49Å; W195-H199 AromaticContact CE2-NE2 3.72Å; W195-H199 AromaticContact CG-CE1 3.99Å; W195-H199 AromaticContact CG-ND1 3.87Å; W195-H199 HydrophobicContact CH2-CB 4.44Å; W195-H199 AromaticContact CZ2-CD2 3.77Å; W195-H199 AromaticContact CZ2-CE1 3.76Å; W195-H199 AromaticContact CZ2-CG 3.91Å; W195-H199 AromaticContact CZ2-ND1 3.89Å; W195-H199 AromaticContact CZ2-NE2 3.68Å; W195-H199 HydrophobicContact CZ3-CB 4.43Å; W195-H199 AromaticContact NE1-CE1 3.16Å; W195-H199 PolarHBondContact NE1-CE1 3.12Å; W195-H199 AromaticContact NE1-ND1 3.72Å; W195-H199 AromaticContact NE1-NE2 3.73Å; W195-H199 WeakPolarHBondContact O-CB 3.24Å; W195-H199 PolarHBondContact O-N 2.86Å; W195-H199 VanDerWaalsContact O-N 3.12Å; W195-H199 PolarHBondContact O-ND1 3.15Å; A196-H199 PolarHBondContact O-N 3.37Å; R197-H199 PolarHBondContact O-N 2.8Å; H199-E201 PolarHBondContact O-N 3.34Å; H199-K202 PolarHBondContact O-N 3.02Å
200	F	96.2	Very high	97.5	Very high	25 Å²	25	51 Å²	51	11%	0.11	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-57	134.6	170.8	-81.5	7.5	0	0	0	111	I85 G87 V88 I104 A106 W136 F149 A196 R197 K202	I85-F200 HydrophobicContact CG2-CD1 3.92Å; I85-F200 HydrophobicContact CG2-CE1 4.33Å; G87-F200 VanDerWaalsContact C-CE1 3.46Å; V88-F200 HydrophobicContact CB-CE1 4.1Å; V88-F200 HydrophobicContact CB-CZ 4.2Å; V88-F200 HydrophobicContact CG1-CE1 4.31Å; V88-F200 HydrophobicContact CG1-CZ 3.91Å; I104-F200 HydrophobicContact CG2-CE2 4.23Å; I104-F200 HydrophobicContact CG2-CZ 4.4Å; A106-F200 HydrophobicContact CB-CB 4.16Å; A106-F200 HydrophobicContact CB-CD2 3.99Å; A106-F200 HydrophobicContact CB-CG 4.11Å; W136-F200 HydrophobicContact CH2-CD2 4.32Å; W136-F200 HydrophobicContact CH2-CE2 4.17Å; W136-F200 HydrophobicContact CZ2-CD2 4.33Å; W136-F200 HydrophobicContact CZ2-CE2 4.05Å; F149-F200 HydrophobicContact CE1-CZ 4.44Å; F149-F200 AromaticContact CZ-CE2 3.87Å; F149-F200 HydrophobicContact CZ-CE2 3.87Å; F149-F200 HydrophobicContact CZ-CZ 4.02Å; A196-F200 WeakPolarHBondContact O-CD1 3.46Å; A196-F200 WeakPolarHBondContact O-CE1 3.44Å; A196-F200 PolarHBondContact O-N 2.87Å; R197-F200 WeakPolarHBondContact O-CB 3.48Å; R197-F200 PolarHBondContact O-N 2.82Å; R197-F200 VanDerWaalsContact O-N 3.11Å; F200-K202 PolarHBondContact O-N 3.45Å
201	E	96.2	Very high	97.4	Very high	74 Å²	74	50.7 Å²	50.7	35%	0.346	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	-3.4	178.2	-49.6	179.3	-169.5	0	0	114.8	I85 A106 E107 H108 H199	I85-E201 WeakPolarHBondContact O-CA 3.49Å; I85-E201 PolarHBondContact O-N 3.26Å; A106-E201 HydrophobicContact CB-CG 3.64Å; E107-E201 WeakPolarHBondContact CA-OE1 3.09Å; E107-E201 PolarHBondContact N-OE1 2.83Å; H108-E201 IonicContact CD2-OE1 3.29Å; H108-E201 IonicContact CD2-OE2 2.66Å; H108-E201 PolarHBondContact CD2-OE2 2.85Å; H108-E201 VanDerWaalsContact CD2-OE2 3.29Å; H108-E201 IonicContact CG-OE2 3.87Å; H108-E201 PolarHBondContact N-OE1 2.89Å; H199-E201 PolarHBondContact O-N 3.34Å
202	K	97	Very high	97.4	Very high	117 Å²	117	51.6 Å²	51.6	51%	0.509	26%	0.255	S	S	.	.			trans	-82	144.1	175.7	-62.9	-175.7	-174	163.6	0	110.9	I85 D198 H199 F200	I85-K202 PolarHBondContact N-O 2.83Å; D198-K202 VanDerWaalsContact O-CD 3.29Å; D198-K202 WeakPolarHBondContact O-CD 3.43Å; D198-K202 WeakPolarHBondContact O-CE 3.21Å; D198-K202 PolarHBondContact O-NZ 2.93Å; H199-K202 PolarHBondContact O-N 3.02Å; F200-K202 PolarHBondContact O-N 3.45Å
203	S	96.6	Very high	97.3	Very high	60 Å²	60	53 Å²	53	42%	0.42	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.7	174.4	-69.1	0	0	0	0	110.4	M83 Q166	M83-S203 CarbonylContact O-C 3.6Å; Q166-S203 PolarHBondContact NE2-OG 3.05Å
204	I	97.7	Very high	97.3	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.046	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.2	175.5	-62	-178.2	0	0	0	108.3	L42 F45 P82 M83 I85 W195 K208 V209	L42-I204 HydrophobicContact CD1-CD1 3.61Å; L42-I204 HydrophobicContact CD1-CG2 4.15Å; F45-I204 VanDerWaalsContact CE2-O 3.3Å; F45-I204 WeakPolarHBondContact CE2-O 3.41Å; F45-I204 WeakPolarHBondContact CZ-O 3.49Å; P82-I204 CarbonylContact C-O 3.54Å; P82-I204 WeakPolarHBondContact CA-O 3.11Å; M83-I204 PolarHBondContact N-O 2.96Å; M83-I204 PolarHBondContact O-N 2.85Å; I85-I204 HydrophobicContact CD1-CD1 3.28Å; I85-I204 HydrophobicContact CD1-CG1 4.41Å; I85-I204 HydrophobicContact CG1-CD1 4.02Å; W195-I204 HydrophobicContact CH2-CD1 3.8Å; W195-I204 HydrophobicContact CZ2-CD1 4.37Å; I204-K208 HydrophobicContact CG2-CB 4.14Å; I204-V209 HydrophobicContact CG2-CG2 3.85Å
205	S	97.6	Very high	97.3	Very high	21 Å²	21	53.1 Å²	53.1	15%	0.147	26%	0.261	C	S	.	.			trans	-81.8	162.5	173	52.4	0	0	0	0	110.9	D207 K208	S205-D207 WeakPolarHBondContact CB-OD1 3.39Å; S205-D207 PolarHBondContact O-N 2.96Å; S205-D207 PolarHBondContact OG-OD1 2.74Å; S205-K208 PolarHBondContact O-N 2.84Å
206	I	98.1	Very high	97.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-69.2	-33.4	-172.3	-176.8	67.8	0	0	0	113.5	F45 T80 K208 V209 F210 I286 D323 V325 L341	F45-I206 HydrophobicContact CB-CD1 3.57Å; F45-I206 HydrophobicContact CD1-CB 4.42Å; F45-I206 HydrophobicContact CD1-CD1 3.41Å; F45-I206 VanDerWaalsContact CD1-CD1 3.41Å; F45-I206 HydrophobicContact CD1-CG1 4.43Å; F45-I206 HydrophobicContact CD2-CD1 4.07Å; F45-I206 HydrophobicContact CE1-CB 4.22Å; F45-I206 HydrophobicContact CE1-CD1 4.07Å; F45-I206 HydrophobicContact CG-CD1 3.42Å; F45-I206 VanDerWaalsContact CG-CD1 3.42Å; F45-I206 HydrophobicContact CZ-CB 4.3Å; T80-I206 HydrophobicContact CG2-CB 4.5Å; T80-I206 HydrophobicContact CG2-CD1 4.17Å; T80-I206 HydrophobicContact CG2-CG1 4.19Å; T80-I206 WeakPolarHBondContact OG1-CG2 3.33Å; I206-K208 PolarHBondContact O-N 2.84Å; I206-V209 PolarHBondContact O-N 3.48Å; I206-F210 HydrophobicContact CD1-CD2 3.48Å; I206-F210 VanDerWaalsContact CD1-CD2 3.48Å; I206-F210 HydrophobicContact CD1-CE2 3.96Å; I206-F210 HydrophobicContact CG1-CD2 4.34Å; I206-F210 PolarHBondContact O-N 3.37Å; I206-I286 HydrophobicContact CG2-CG2 3.67Å; I206-D323 HydrophobicContact CG2-CB 4.08Å; I206-V325 HydrophobicContact CB-CG2 4.49Å; I206-V325 HydrophobicContact CD1-CG2 4.13Å; I206-V325 HydrophobicContact CG1-CG2 3.42Å; I206-V325 VanDerWaalsContact CG1-CG2 3.42Å; I206-V325 HydrophobicContact CG2-CG2 4.36Å; I206-L341 HydrophobicContact CD1-CD1 4.21Å
207	D	97.4	Very high	97.3	Very high	65 Å²	65	50.7 Å²	50.7	35%	0.348	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-65.3	-24.1	177.6	60.1	-29.8	0	0	0	113	S205 V209 I286 K288	S205-D207 WeakPolarHBondContact CB-OD1 3.39Å; S205-D207 PolarHBondContact O-N 2.96Å; S205-D207 PolarHBondContact OG-OD1 2.74Å; D207-V209 PolarHBondContact O-N 3.37Å; D207-I286 HydrophobicContact CB-CG2 4.11Å; D207-K288 IonicContact OD1-NZ 2.79Å; D207-K288 IonicContact OD2-NZ 2.84Å; D207-K288 PolarHBondContact OD2-NZ 2.84Å
208	K	97.2	Very high	97.5	Very high	152 Å²	152	44.4 Å²	44.4	66%	0.661	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-75.6	-11.7	171.4	-67.2	-175.6	179.8	-173.7	0	113.4	I204 S205 I206	I204-K208 HydrophobicContact CG2-CB 4.14Å; S205-K208 PolarHBondContact O-N 2.84Å; I206-K208 PolarHBondContact O-N 2.84Å
209	V	98.2	Very high	97.5	Very high	8 Å²	8	39.9 Å²	39.9	5%	0.048	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-41.7	-177	-176.1	0	0	0	0	111.7	L42 F45 I204 I206 D207 K343	L42-V209 HydrophobicContact CB-CG1 3.98Å; L42-V209 HydrophobicContact CB-CG2 3.98Å; L42-V209 HydrophobicContact CD1-CG2 4.02Å; F45-V209 HydrophobicContact CD2-CB 4.49Å; F45-V209 HydrophobicContact CD2-CG2 3.94Å; F45-V209 HydrophobicContact CE2-CG2 4.49Å; I204-V209 HydrophobicContact CG2-CG2 3.85Å; I206-V209 PolarHBondContact O-N 3.48Å; D207-V209 PolarHBondContact O-N 3.37Å; V209-K343 WeakPolarHBondContact O-CE 3.39Å; V209-K343 PolarHBondContact O-NZ 2.87Å
210	F	98.3	Very high	97.6	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.018	19%	0.194	C	C	.	.			trans	-122	146.9	-178.4	-64.8	-77.9	0	0	0	110.9	F45 I206 I216 I283 I286 L341 K343	F45-F210 HydrophobicContact CB-CD2 4.38Å; F45-F210 HydrophobicContact CB-CE2 3.7Å; I206-F210 HydrophobicContact CD1-CD2 3.48Å; I206-F210 VanDerWaalsContact CD1-CD2 3.48Å; I206-F210 HydrophobicContact CD1-CE2 3.96Å; I206-F210 HydrophobicContact CG1-CD2 4.34Å; I206-F210 PolarHBondContact O-N 3.37Å; F210-I216 HydrophobicContact CD1-CB 4.46Å; F210-I216 HydrophobicContact CD1-CG2 3.35Å; F210-I216 HydrophobicContact CE1-CB 4.16Å; F210-I216 HydrophobicContact CE1-CG2 3.48Å; F210-I216 VanDerWaalsContact CE1-CG2 3.48Å; F210-I216 HydrophobicContact CG-CG2 4.24Å; F210-I216 HydrophobicContact CZ-CG2 4.46Å; F210-I283 HydrophobicContact CB-CD1 3.72Å; F210-I283 HydrophobicContact CD1-CD1 4.46Å; F210-I283 HydrophobicContact CG-CD1 4.23Å; F210-I286 HydrophobicContact CB-CD1 4.22Å; F210-I286 WeakPolarHBondContact O-CD1 3.44Å; F210-L341 HydrophobicContact CE2-CB 3.8Å; F210-L341 HydrophobicContact CZ-CB 3.84Å; F210-K343 HydrophobicContact CD1-CG 4.02Å; F210-K343 HydrophobicContact CE1-CB 4.3Å; F210-K343 HydrophobicContact CE1-CG 3.59Å; F210-K343 HydrophobicContact CZ-CG 4.43Å
211	A	97.2	Very high	97.7	Very high	55 Å²	55	36.4 Å²	36.4	46%	0.455	19%	0.188	S	C	.	.			trans	-95.2	158.3	172.3	0	0	0	0	0	111.2	E214 I283	A211-E214 HydrophobicContact CB-CB 4.44Å; A211-E214 PolarHBondContact N-OE2 2.8Å; A211-E214 VanDerWaalsContact N-OE2 3.07Å; A211-E214 WeakPolarHBondContact O-CB 3.06Å; A211-I283 WeakPolarHBondContact O-CD1 3.39Å
212	Q	96.7	Very high	97.8	Very high	93 Å²	93	34.4 Å²	34.4	44%	0.435	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	150.8	164	-175	161.2	-37.2	0	0	109.8	E214	Q212-E214 PolarHBondContact O-N 2.78Å
213	D	97.2	Very high	97.9	Very high	33 Å²	33	34.7 Å²	34.7	18%	0.176	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	-4.1	-178.6	-52.2	-31.8	0	0	0	116.6	K282 I283 K356 I357	D213-K282 VanDerWaalsContact O-CE 3.28Å; D213-K282 WeakPolarHBondContact O-CE 3.44Å; D213-K282 PolarHBondContact O-NZ 3.1Å; D213-I283 WeakPolarHBondContact CA-O 3.45Å; D213-I283 PolarHBondContact N-O 3.44Å; D213-I283 VanDerWaalsContact N-O 3.09Å; D213-K356 WeakPolarHBondContact OD2-CA 3.05Å; D213-I357 WeakPolarHBondContact OD1-CB 3.28Å; D213-I357 VanDerWaalsContact OD1-CG1 3.31Å; D213-I357 WeakPolarHBondContact OD1-CG1 3.39Å; D213-I357 PolarHBondContact OD1-N 3.14Å; D213-I357 PolarHBondContact OD2-N 3.14Å; D213-I357 VanDerWaalsContact OD2-N 3.13Å
214	E	97.1	Very high	97.9	Very high	45 Å²	45	33.8 Å²	33.8	21%	0.21	18%	0.182	C	C	.	.			trans	-68.4	145	176.6	-170	-179	168.4	0	0	111.6	A211 Q212 I216 I283 K343	A211-E214 HydrophobicContact CB-CB 4.44Å; A211-E214 PolarHBondContact N-OE2 2.8Å; A211-E214 VanDerWaalsContact N-OE2 3.07Å; A211-E214 WeakPolarHBondContact O-CB 3.06Å; Q212-E214 PolarHBondContact O-N 2.78Å; E214-I216 HydrophobicContact CG-CG2 4.44Å; E214-I283 PolarHBondContact O-N 2.89Å; E214-K343 VanDerWaalsContact CD-NZ 3.32Å; E214-K343 WeakPolarHBondContact OE1-CG 3.3Å; E214-K343 IonicContact OE1-NZ 2.93Å; E214-K343 PolarHBondContact OE1-NZ 2.66Å; E214-K343 IonicContact OE2-NZ 3.9Å; E214-K343 PolarHBondContact OE2-NZ 3.22Å
215	M	98.2	Very high	98	Very high	26 Å²	26	37.5 Å²	37.5	13%	0.128	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.7	168.9	-73.2	-67.9	-129.5	0	0	110.7	N280 K282 H348 A353	M215-N280 HydrophobicContact CE-CB 3.87Å; M215-N280 HydrophobicContact SD-CB 4.35Å; M215-K282 HydrophobicContact SD-CB 3.65Å; M215-K282 HydrophobicContact SD-CG 4.23Å; M215-H348 WeakPolarHBondContact CB-CD2 3.49Å; M215-H348 WeakPolarHBondContact CB-NE2 3.27Å; M215-A353 HydrophobicContact CE-CB 3.95Å; M215-A353 HydrophobicContact CG-CB 3.87Å
216	I	98.2	Very high	98	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	165.5	-179.7	68.1	168.8	0	0	0	112.1	F210 E214 N280 K281 I283 V327 L341	F210-I216 HydrophobicContact CD1-CB 4.46Å; F210-I216 HydrophobicContact CD1-CG2 3.35Å; F210-I216 HydrophobicContact CE1-CB 4.16Å; F210-I216 HydrophobicContact CE1-CG2 3.48Å; F210-I216 VanDerWaalsContact CE1-CG2 3.48Å; F210-I216 HydrophobicContact CG-CG2 4.24Å; F210-I216 HydrophobicContact CZ-CG2 4.46Å; E214-I216 HydrophobicContact CG-CG2 4.44Å; I216-N280 PolarHBondContact O-N 3.02Å; I216-K281 HydrophobicContact CG1-CB 4.2Å; I216-K281 VanDerWaalsContact CG1-O 3.26Å; I216-K281 WeakPolarHBondContact CG1-O 3.32Å; I216-K281 PolarHBondContact N-O 2.88Å; I216-K281 PolarHBondContact O-N 3.35Å; I216-I283 HydrophobicContact CD1-CD1 4.05Å; I216-I283 HydrophobicContact CD1-CG1 3.91Å; I216-I283 HydrophobicContact CG1-CD1 4.46Å; I216-I283 HydrophobicContact CG1-CG1 4.15Å; I216-I283 HydrophobicContact CG2-CD1 3.66Å; I216-I283 HydrophobicContact CG2-CG1 4.09Å; I216-V327 HydrophobicContact CD1-CG1 4Å; I216-L341 HydrophobicContact CD1-CB 4.24Å; I216-L341 HydrophobicContact CD1-CD1 4.11Å; I216-L341 HydrophobicContact CD1-CD2 3.8Å; I216-L341 HydrophobicContact CD1-CG 4.25Å
217	D	98.5	Very high	98	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.2	173.5	-59.5	-30	0	0	0	110.7	T277 E278 I279 N280 L341 R342 L345	D217-T277 HydrophobicContact CB-CG2 4.05Å; D217-E278 CarbonylContact C-O 3.23Å; D217-E278 WeakPolarHBondContact CA-O 3.39Å; D217-I279 WeakPolarHBondContact OD1-CA 3.26Å; D217-I279 VanDerWaalsContact OD1-CB 3.28Å; D217-I279 WeakPolarHBondContact OD1-CB 3.31Å; D217-I279 WeakPolarHBondContact OD1-CG2 3.1Å; D217-N280 PolarHBondContact OD1-N 3.31Å; D217-L341 WeakPolarHBondContact O-CA 3.44Å; D217-R342 HydrophobicContact CB-CB 4.32Å; D217-R342 PolarHBondContact N-O 2.8Å; D217-R342 PolarHBondContact O-N 2.74Å; D217-R342 IonicContact OD2-CZ 2.75Å; D217-R342 VanDerWaalsContact OD2-CZ 3.28Å; D217-R342 IonicContact OD2-NE 3.99Å; D217-R342 PolarHBondContact OD2-NE 2.64Å; D217-R342 IonicContact OD2-NH2 3.53Å; D217-R342 PolarHBondContact OD2-NH2 3.24Å; D217-L345 PolarHBondContact OD2-N 3.08Å
218	C	98.5	Very high	98.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	109.5	176.3	-73.9	0	0	0	0	110.3	E278 K281 I339 L341	C218-E278 HydrophobicContact CB-CB 4.44Å; C218-E278 PolarHBondContact N-O 3.31Å; C218-E278 PolarHBondContact O-N 2.93Å; C218-K281 HydrophobicContact CB-CG 4.32Å; C218-I339 HydrophobicContact CB-CG2 4.19Å; C218-L341 VanDerWaalsContact SG-CD2 3.57Å
219	I	98.6	Very high	98.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127	-178.4	-50.7	174.5	0	0	0	109.5	V28 H275 T277 T340 R342	V28-I219 HydrophobicContact CB-CD1 4.41Å; V28-I219 HydrophobicContact CG1-CD1 4.33Å; V28-I219 HydrophobicContact CG2-CD1 4.08Å; I219-H275 WeakPolarHBondContact CG2-NE2 3.5Å; I219-T277 HydrophobicContact CD1-CG2 4.45Å; I219-T277 HydrophobicContact CG1-CG2 3.8Å; I219-T340 WeakPolarHBondContact CA-O 3.2Å; I219-T340 WeakPolarHBondContact CB-O 3.49Å; I219-T340 PolarHBondContact N-O 3.38Å; I219-T340 PolarHBondContact O-N 2.95Å; I219-R342 HydrophobicContact CD1-CB 4.03Å
220	G	98.3	Very high	98.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	-163.5	-178.2	0	0	0	0	0	114.3	H275 R276 I332	G220-H275 WeakPolarHBondContact O-CA 2.98Å; G220-R276 PolarHBondContact N-O 2.88Å; G220-R276 PolarHBondContact O-N 2.7Å; G220-R276 VanDerWaalsContact O-N 3.09Å; G220-I332 VanDerWaalsContact C-CD1 3.48Å; G220-I332 WeakPolarHBondContact O-CD1 3.5Å
221	V	98.5	Very high	98	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.8	175.9	178.4	0	0	0	0	109	R23 H24 Y273 H274 G333	R23-V221 WeakPolarHBondContact O-CG2 3.47Å; H24-V221 VanDerWaalsContact O-CG2 3.24Å; H24-V221 WeakPolarHBondContact O-CG2 3.41Å; V221-Y273 HydrophobicContact CG1-CD1 4.12Å; V221-Y273 HydrophobicContact CG1-CD2 3.67Å; V221-Y273 HydrophobicContact CG1-CE1 4.38Å; V221-Y273 HydrophobicContact CG1-CE2 3.98Å; V221-Y273 HydrophobicContact CG1-CG 3.76Å; V221-H274 WeakPolarHBondContact CA-O 3.46Å; V221-G333 WeakPolarHBondContact O-CA 3.42Å
222	T	98.6	Very high	98	Very high	32 Å²	32	40.8 Å²	40.8	20%	0.196	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-57.9	158.4	-179.5	50.4	0	0	0	0	112.4	G224 Y273 H274 R276 I332	T222-G224 PolarHBondContact O-N 2.79Å; T222-Y273 VanDerWaalsContact O-CA 3.24Å; T222-Y273 WeakPolarHBondContact O-CA 3.39Å; T222-Y273 PolarHBondContact O-N 2.73Å; T222-Y273 PolarHBondContact OG1-N 3.49Å; T222-Y273 VanDerWaalsContact OG1-N 3.12Å; T222-H274 PolarHBondContact N-O 2.96Å; T222-H274 PolarHBondContact OG1-N 2.81Å; T222-H274 PolarHBondContact OG1-O 3.01Å; T222-H274 VanDerWaalsContact OG1-O 3.11Å; T222-R276 HydrophobicContact CG2-CG 3.86Å; T222-I332 HydrophobicContact CG2-CD1 3.81Å; T222-I332 HydrophobicContact CG2-CG1 3.82Å
223	K	98.4	Very high	98.1	Very high	124 Å²	124	38.3 Å²	38.3	54%	0.539	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-56.1	133.8	172.8	-171.7	175.4	-179.8	179.6	0	109.6	H225 G272 Y273 P334	K223-H225 PolarHBondContact O-CD2 3.44Å; K223-G272 CarbonylContact O-C 3.45Å; K223-G272 WeakPolarHBondContact O-CA 3.38Å; K223-Y273 PolarHBondContact O-N 2.86Å; K223-Y273 VanDerWaalsContact O-N 3.15Å; K223-P334 HydrophobicContact CG-CB 4.48Å
224	G	98.1	Very high	98.1	Very high	40 Å²	40	37.1 Å²	37.1	41%	0.412	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	138.3	177.1	0	0	0	0	0	111.1	T222	T222-G224 PolarHBondContact O-N 2.79Å
225	H	98.4	Very high	98.1	Very high	87 Å²	87	41.5 Å²	41.5	40%	0.403	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	8.3	175.9	-58.5	-77.7	0	0	0	112.9	K223 K228 K271	K223-H225 PolarHBondContact O-CD2 3.44Å; H225-K228 HydrophobicContact CB-CG 4.35Å; H225-K228 WeakPolarHBondContact O-CE 3.02Å; H225-K271 WeakPolarHBondContact CA-O 3.45Å; H225-K271 HydrophobicContact CB-CB 4.19Å; H225-K271 HydrophobicContact CB-CD 4.38Å; H225-K271 HydrophobicContact CB-CG 4.2Å; H225-K271 WeakPolarHBondContact CB-O 3.34Å; H225-K271 PolarHBondContact N-O 3.18Å
226	G	98.2	Very high	98.1	Very high	34 Å²	34	40.9 Å²	40.9	35%	0.351	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	67.2	-154.2	-179.3	0	0	0	0	0	113.7	K271	G226-K271 PolarHBondContact O-N 3.43Å
227	F	98.5	Very high	98	Very high	154 Å²	154	49.5 Å²	49.5	68%	0.675	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	126.9	174.2	-166.2	-80.7	0	0	0	110.1	A268	F227-A268 HydrophobicContact CE1-CB 3.81Å; F227-A268 HydrophobicContact CZ-CB 3.91Å
228	K	98.4	Very high	97.9	Very high	88 Å²	88	54.9 Å²	54.9	38%	0.383	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.1	178.8	-68.4	-62.6	-172.8	-164.5	0	111.3	H225 R233 A268 G269 K271	H225-K228 HydrophobicContact CB-CG 4.35Å; H225-K228 WeakPolarHBondContact O-CE 3.02Å; K228-R233 HydrophobicContact CB-CB 4.46Å; K228-A268 WeakPolarHBondContact O-CA 3.41Å; K228-G269 PolarHBondContact N-O 3.26Å; K228-G269 PolarHBondContact O-N 3.27Å; K228-K271 HydrophobicContact CB-CB 3.84Å; K228-K271 HydrophobicContact CB-CD 4.28Å; K228-K271 HydrophobicContact CG-CB 3.72Å; K228-K271 HydrophobicContact CG-CD 4.01Å; K228-K271 HydrophobicContact CG-CG 4.44Å
229	G	97.9	Very high	97.9	Very high	34 Å²	34	56.8 Å²	56.8	35%	0.351	29%	0.292	S	S	.	.			trans	-65.8	165.2	173.1	0	0	0	0	0	113.4	T231 S232 R233	G229-T231 VanDerWaalsContact C-N 3.32Å; G229-T231 PolarHBondContact O-N 3.37Å; G229-S232 PolarHBondContact O-N 3.08Å; G229-S232 VanDerWaalsContact O-N 3.08Å; G229-R233 WeakPolarHBondContact O-CB 3.47Å; G229-R233 PolarHBondContact O-N 3.28Å
230	V	97.9	Very high	97.9	Very high	10 Å²	10	61.4 Å²	61.4	6%	0.061	32%	0.322	C	S	.	.	H	α-helix	trans	-55.8	-40.7	-174.9	-68	0	0	0	0	113.5	S232 R233 W234 H235 R248 V250 A266 A268	V230-S232 VanDerWaalsContact C-N 3.31Å; V230-S232 PolarHBondContact O-N 2.89Å; V230-R233 PolarHBondContact O-N 3.47Å; V230-W234 WeakPolarHBondContact O-CA 3.42Å; V230-W234 WeakPolarHBondContact O-CB 3.33Å; V230-W234 PolarHBondContact O-N 2.88Å; V230-H235 PolarHBondContact O-N 3.47Å; V230-R248 WeakPolarHBondContact CG2-O 3.39Å; V230-V250 HydrophobicContact CB-CG2 4.12Å; V230-V250 HydrophobicContact CG1-CG2 4.2Å; V230-V250 HydrophobicContact CG2-CG2 4.05Å; V230-A266 VanDerWaalsContact CG1-O 3.29Å; V230-A266 WeakPolarHBondContact CG1-O 3.27Å; V230-A268 VanDerWaalsContact CG1-N 3.35Å
231	T	97.5	Very high	97.8	Very high	19 Å²	19	71.1 Å²	71.1	12%	0.117	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-39.2	178.1	-51.1	0	0	0	0	112	G229 H235 T236 K238	G229-T231 VanDerWaalsContact C-N 3.32Å; G229-T231 PolarHBondContact O-N 3.37Å; T231-H235 WeakPolarHBondContact O-CA 3.44Å; T231-H235 PolarHBondContact O-N 3.25Å; T231-T236 WeakPolarHBondContact CG2-O 3.46Å; T231-T236 PolarHBondContact N-OG1 2.96Å; T231-K238 HydrophobicContact CG2-CG 3.88Å
232	S	97.5	Very high	97.7	Very high	36 Å²	36	79.7 Å²	79.7	25%	0.252	40%	0.396	S	S	.	.	H	α-helix	trans	-86	-36.5	178.3	-170.7	0	0	0	0	112.1	G229 V230 H235 K271	G229-S232 PolarHBondContact O-N 3.08Å; G229-S232 VanDerWaalsContact O-N 3.08Å; V230-S232 VanDerWaalsContact C-N 3.31Å; V230-S232 PolarHBondContact O-N 2.89Å; S232-H235 PolarHBondContact O-NE2 2.88Å; S232-K271 WeakPolarHBondContact O-CE 3.33Å; S232-K271 PolarHBondContact O-NZ 3.05Å; S232-K271 PolarHBondContact OG-NZ 2.81Å
233	R	98	Very high	97.6	Very high	41 Å²	41	80.2 Å²	80.2	16%	0.155	40%	0.399	C	S	.	.	H	α-helix	trans	-78.3	-32.6	-174.6	-171.8	-177.5	-175.2	-151.2	6.2	113.6	K18 K228 G229 V230 R267 A268 Q270 K271	K18-R233 PolarHBondContact O-NH2 3.41Å; K228-R233 HydrophobicContact CB-CB 4.46Å; G229-R233 WeakPolarHBondContact O-CB 3.47Å; G229-R233 PolarHBondContact O-N 3.28Å; V230-R233 PolarHBondContact O-N 3.47Å; R233-R267 WeakPolarHBondContact CD-O 3.29Å; R233-R267 PolarHBondContact NH1-O 3.34Å; R233-A268 VanDerWaalsContact NH1-C 3.29Å; R233-A268 PolarHBondContact NH1-O 3.08Å; R233-Q270 PolarHBondContact NE-O 3.41Å; R233-K271 HydrophobicContact CG-CB 4.42Å
234	W	97.7	Very high	97.5	Very high	8 Å²	8	81.5 Å²	81.5	3%	0.03	41%	0.406	C	S	.	.	H	α-helix	trans	-122.4	-6.6	-174.8	-68.2	99.3	0	0	0	113.4	H10 L16 K18 V230 T236 A266 R267	H10-W234 VanDerWaalsContact O-CE3 3.31Å; L16-W234 HydrophobicContact CD2-CH2 3.79Å; L16-W234 HydrophobicContact CD2-CZ2 4.06Å; L16-W234 HydrophobicContact CG-CH2 4.4Å; K18-W234 HydrophobicContact CD-CH2 3.91Å; K18-W234 HydrophobicContact CD-CZ2 3.73Å; K18-W234 HydrophobicContact CD-CZ3 4.48Å; V230-W234 WeakPolarHBondContact O-CA 3.42Å; V230-W234 WeakPolarHBondContact O-CB 3.33Å; V230-W234 PolarHBondContact O-N 2.88Å; W234-T236 VanDerWaalsContact C-N 3.26Å; W234-T236 HydrophobicContact CB-CG2 4.01Å; W234-T236 PolarHBondContact O-N 3.11Å; W234-A266 HydrophobicContact CB-CB 3.77Å; W234-A266 HydrophobicContact CD2-CB 3.91Å; W234-A266 HydrophobicContact CG-CB 3.53Å; W234-R267 VanDerWaalsContact CD1-O 3.28Å; W234-R267 PolarHBondContact NE1-O 3.35Å
235	H	96.8	Very high	97.3	Very high	137 Å²	137	87.7 Å²	87.7	63%	0.634	42%	0.422	S	S	*	.			trans	60	35.8	-177.3	-47.8	132.7	0	0	0	112.8	H10 V230 T231 S232	H10-H235 PolarHBondContact CE1-O 3.26Å; H10-H235 PolarHBondContact ND1-O 3.44Å; H10-H235 VanDerWaalsContact ND1-O 3.14Å; V230-H235 PolarHBondContact O-N 3.47Å; T231-H235 WeakPolarHBondContact O-CA 3.44Å; T231-H235 PolarHBondContact O-N 3.25Å; S232-H235 PolarHBondContact O-NE2 2.88Å
236	T	96.6	Very high	97.1	Very high	12 Å²	12	85.5 Å²	85.5	7%	0.074	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-69.8	145.8	172.4	60.4	0	0	0	0	110.3	H10 T231 W234 V250 A266	H10-T236 HydrophobicContact CB-CG2 4.19Å; T231-T236 WeakPolarHBondContact CG2-O 3.46Å; T231-T236 PolarHBondContact N-OG1 2.96Å; W234-T236 VanDerWaalsContact C-N 3.26Å; W234-T236 HydrophobicContact CB-CG2 4.01Å; W234-T236 PolarHBondContact O-N 3.11Å; T236-V250 HydrophobicContact CG2-CG2 3.98Å; T236-A266 HydrophobicContact CG2-CB 3.89Å
237	K	96.7	Very high	97.1	Very high	181 Å²	181	87 Å²	87	79%	0.787	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-57.5	142.5	174.1	-165.1	176.4	177.7	175.6	0	110.3
238	K	97.4	Very high	97	Very high	115 Å²	115	86 Å²	86	50%	0.5	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-70.3	147.8	169.4	-64.5	175.7	-176.6	175.6	0	109.1	T231 L247	T231-K238 HydrophobicContact CG2-CG 3.88Å; K238-L247 HydrophobicContact CB-CD1 4.01Å; K238-L247 HydrophobicContact CD-CD1 3.8Å; K238-L247 HydrophobicContact CG-CD1 4.01Å
239	L	97.7	Very high	97	Very high	40 Å²	40	85.3 Å²	85.3	21%	0.209	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-75	163.1	172.5	-56.9	-179.2	0	0	0	111	T243 L247 K249 A251	L239-T243 HydrophobicContact CB-CG2 4.17Å; L239-T243 WeakPolarHBondContact CB-OG1 3.49Å; L239-T243 HydrophobicContact CD1-CG2 3.85Å; L239-L247 PolarHBondContact N-O 3.01Å; L239-K249 HydrophobicContact CD1-CD 4.23Å; L239-K249 HydrophobicContact CD1-CG 3.51Å; L239-K249 HydrophobicContact CG-CG 4.49Å; L239-A251 HydrophobicContact CD1-CB 4.21Å; L239-A251 HydrophobicContact CD2-CB 3.91Å
240	P	98	Very high	96.9	Very high	97 Å²	97	85.7 Å²	85.7	63%	0.63	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-55.1	151.9	178.3	-26.9	36.1	0	0	0	113.2	K242 T243	P240-K242 VanDerWaalsContact C-N 3.25Å; P240-K242 PolarHBondContact O-N 3.29Å; P240-T243 VanDerWaalsContact O-CB 3.27Å; P240-T243 WeakPolarHBondContact O-CB 3.44Å; P240-T243 PolarHBondContact O-N 3.26Å; P240-T243 PolarHBondContact O-OG1 2.91Å
241	R	97.3	Very high	96.9	Very high	205 Å²	205	89 Å²	89	77%	0.774	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-40.9	-177.4	-175.2	-176	64.3	78.2	-7.1	113	T243	R241-T243 PolarHBondContact O-N 2.79Å
242	K	97.1	Very high	96.9	Very high	180 Å²	180	92.5 Å²	92.5	78%	0.783	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	14.9	-178.7	-60.5	-174	178	-176.2	0	114	P240 H244	P240-K242 VanDerWaalsContact C-N 3.25Å; P240-K242 PolarHBondContact O-N 3.29Å; K242-H244 PolarHBondContact O-N 3.09Å
243	T	96.3	Very high	96.9	Very high	42 Å²	42	94.1 Å²	94.1	26%	0.258	47%	0.465	S	S	.	.			trans	-73.5	124	178.6	-56.9	0	0	0	0	111	L239 P240 R241	L239-T243 HydrophobicContact CB-CG2 4.17Å; L239-T243 WeakPolarHBondContact CB-OG1 3.49Å; L239-T243 HydrophobicContact CD1-CG2 3.85Å; P240-T243 VanDerWaalsContact O-CB 3.27Å; P240-T243 WeakPolarHBondContact O-CB 3.44Å; P240-T243 PolarHBondContact O-N 3.26Å; P240-T243 PolarHBondContact O-OG1 2.91Å; R241-T243 PolarHBondContact O-N 2.79Å
244	H	95.6	Very high	96.8	Very high	151 Å²	151	94.1 Å²	94.1	70%	0.699	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	143.5	173.7	-170.9	-136.1	0	0	0	112.3	K242 G246 K249	K242-H244 PolarHBondContact O-N 3.09Å; H244-G246 PolarHBondContact O-N 3.14Å; H244-K249 PolarHBondContact O-NZ 2.94Å
245	K	94.7	Very high	96.7	Very high	170 Å²	170	97.4 Å²	97.4	74%	0.739	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	39.2	179.6	-55.4	178.7	-179.1	-178	0	114.1	K249	K245-K249 PolarHBondContact O-NZ 2.91Å
246	G	94.3	Very high	96.7	Very high	41 Å²	41	101.2 Å²	101.2	42%	0.423	52%	0.515	S	S	.	.			trans	97.4	142	164.5	0	0	0	0	0	116.4	H244 K249	H244-G246 PolarHBondContact O-N 3.14Å; G246-K249 WeakPolarHBondContact O-CD 3.42Å; G246-K249 WeakPolarHBondContact O-CE 3.43Å; G246-K249 PolarHBondContact O-NZ 2.83Å
247	L	97	Very high	96.7	Very high	66 Å²	66	107.6 Å²	107.6	35%	0.346	54%	0.544	S	S	.	.	S	Bend	trans	-96.3	-14.3	-173.3	63.5	96.3	0	0	0	115	K238 L239 K249	K238-L247 HydrophobicContact CB-CD1 4.01Å; K238-L247 HydrophobicContact CD-CD1 3.8Å; K238-L247 HydrophobicContact CG-CD1 4.01Å; L239-L247 PolarHBondContact N-O 3.01Å; L247-K249 PolarHBondContact O-N 2.86Å
248	R	97.3	Very high	96.7	Very high	132 Å²	132	101.2 Å²	101.2	50%	0.498	52%	0.521	S	S	.	.	S	Bend	trans	-98.8	43.7	-173.7	-57	-173.5	70.8	104.6	3.1	112.8	V230	V230-R248 WeakPolarHBondContact CG2-O 3.39Å
249	K	97.3	Very high	96.7	Very high	74 Å²	74	101.2 Å²	101.2	32%	0.322	54%	0.535	S	S	.	.	S	Bend	trans	-126.4	165.6	-177.5	65.1	-170.6	179.9	-166.8	0	111.1	L239 H244 K245 G246 L247	L239-K249 HydrophobicContact CD1-CD 4.23Å; L239-K249 HydrophobicContact CD1-CG 3.51Å; L239-K249 HydrophobicContact CG-CG 4.49Å; H244-K249 PolarHBondContact O-NZ 2.94Å; K245-K249 PolarHBondContact O-NZ 2.91Å; G246-K249 WeakPolarHBondContact O-CD 3.42Å; G246-K249 WeakPolarHBondContact O-CE 3.43Å; G246-K249 PolarHBondContact O-NZ 2.83Å; L247-K249 PolarHBondContact O-N 2.86Å
250	V	97.3	Very high	96.6	Very high	42 Å²	42	108.7 Å²	108.7	26%	0.255	56%	0.561	S	S	.	*			trans	-87	127.7	164.4	174.2	0	0	0	0	106.2	V230 T236 C252 I253 A266	V230-V250 HydrophobicContact CB-CG2 4.12Å; V230-V250 HydrophobicContact CG1-CG2 4.2Å; V230-V250 HydrophobicContact CG2-CG2 4.05Å; T236-V250 HydrophobicContact CG2-CG2 3.98Å; V250-C252 WeakPolarHBondContact CG1-O 3.41Å; V250-I253 HydrophobicContact CB-CG2 4.47Å; V250-I253 HydrophobicContact CG1-CG2 4.38Å; V250-A266 HydrophobicContact CG2-CB 4.18Å
251	A	97.1	Very high	96.6	Very high	80 Å²	80	107.1 Å²	107.1	66%	0.661	55%	0.55	S	S	*	.	S	Bend	trans	-65.6	-56.1	-176.2	0	0	0	0	0	112.2	L239	L239-A251 HydrophobicContact CD1-CB 4.21Å; L239-A251 HydrophobicContact CD2-CB 3.91Å
252	C	96.2	Very high	96.6	Very high	92 Å²	92	104.4 Å²	104.4	62%	0.622	54%	0.539	S	S	*	.			trans	-110.1	123.4	177.9	175.3	0	0	0	0	110.4	V250 G254	V250-C252 WeakPolarHBondContact CG1-O 3.41Å; C252-G254 PolarHBondContact SG-O 3Å
253	I	97.4	Very high	96.6	Very high	70 Å²	70	104.8 Å²	104.8	36%	0.359	54%	0.537	S	S	.	.			trans	-99.8	5.1	-178.2	62.2	173.9	0	0	0	113.7	V250 V261 V265	V250-I253 HydrophobicContact CB-CG2 4.47Å; V250-I253 HydrophobicContact CG1-CG2 4.38Å; I253-V261 HydrophobicContact CB-CG1 4.49Å; I253-V261 HydrophobicContact CD1-CG2 3.74Å; I253-V261 HydrophobicContact CG1-CG2 4.18Å; I253-V265 HydrophobicContact CB-CG1 3.95Å; I253-V265 HydrophobicContact CG2-CG1 4.17Å; I253-V265 WeakPolarHBondContact O-CG2 3.39Å
254	G	96	Very high	96.6	Very high	41 Å²	41	104.3 Å²	104.3	42%	0.423	53%	0.534	S	S	.	.			trans	162.9	157.7	180	0	0	0	0	0	111.3	C252	C252-G254 PolarHBondContact SG-O 3Å
255	A	96.8	Very high	96.7	Very high	77 Å²	77	98.4 Å²	98.4	64%	0.636	51%	0.509	S	S	*	.			trans	-74.9	172.1	166.1	0	0	0	0	0	110.3
256	W	96.9	Very high	96.8	Very high	217 Å²	217	91 Å²	91	82%	0.822	48%	0.479	S	S	*	.	S	Bend	trans	-57.7	-50.6	174.2	-169.6	-29.4	0	0	0	111.1	P258 S259	W256-P258 CarbonylContact O-C 3.29Å; W256-P258 VanDerWaalsContact O-C 3.23Å; W256-S259 WeakPolarHBondContact O-CA 3.34Å; W256-S259 PolarHBondContact O-N 3.45Å
257	H	96.1	Very high	97	Very high	146 Å²	146	95 Å²	95	68%	0.676	48%	0.481	S	S	*	.	S	Bend	trans	-109.1	123.7	176.6	-63.7	94.3	0	0	0	109.2
258	P	96.3	Very high	97.1	Very high	48 Å²	48	93.8 Å²	93.8	31%	0.312	48%	0.481	S	S	.	.	S	Bend	cis	-75.2	147.2	2.1	32	-35.9	0	0	0	113	W256 R260	W256-P258 CarbonylContact O-C 3.29Å; W256-P258 VanDerWaalsContact O-C 3.23Å; P258-R260 HydrophobicContact CB-CG 4.28Å; P258-R260 PolarHBondContact O-N 3.31Å
259	S	96.9	Very high	97.1	Very high	114 Å²	114	87.9 Å²	87.9	80%	0.797	46%	0.461	S	S	*	.	S	Bend	trans	-73.1	38.9	-178.4	52.6	0	0	0	0	114.1	W256	W256-S259 WeakPolarHBondContact O-CA 3.34Å; W256-S259 PolarHBondContact O-N 3.45Å
260	R	97.2	Very high	97.2	Very high	197 Å²	197	86.2 Å²	86.2	74%	0.743	45%	0.454	S	S	*	.	S	Bend	trans	-150.9	143.1	178.6	59.9	-178.6	-178.3	155.2	-1.7	111.6	P258 R262	P258-R260 HydrophobicContact CB-CG 4.28Å; P258-R260 PolarHBondContact O-N 3.31Å; R260-R262 PolarHBondContact O-N 3.32Å
261	V	97.1	Very high	97.2	Very high	65 Å²	65	86.6 Å²	86.6	39%	0.394	45%	0.453	S	S	.	.			trans	-70.7	118.9	174.2	-176.7	0	0	0	0	109.5	I253 V265	I253-V261 HydrophobicContact CB-CG1 4.49Å; I253-V261 HydrophobicContact CD1-CG2 3.74Å; I253-V261 HydrophobicContact CG1-CG2 4.18Å; V261-V265 HydrophobicContact CG1-CB 3.86Å; V261-V265 HydrophobicContact CG1-CG1 4.16Å; V261-V265 HydrophobicContact CG1-CG2 3.99Å
262	R	97	Very high	97.3	Very high	147 Å²	147	83.2 Å²	83.2	56%	0.555	43%	0.425	S	S	*	.			trans	-67.8	147.7	179.8	-61.5	-176.1	-179.2	-169.5	-0.4	111.2	R260 T264 V265	R260-R262 PolarHBondContact O-N 3.32Å; R262-T264 PolarHBondContact O-N 3.09Å; R262-T264 VanDerWaalsContact O-N 3.09Å; R262-V265 HydrophobicContact CB-CG2 4.19Å; R262-V265 WeakPolarHBondContact O-CB 3.41Å; R262-V265 WeakPolarHBondContact O-CG2 3.26Å; R262-V265 PolarHBondContact O-N 3.4Å
263	Y	97	Very high	97.4	Very high	188 Å²	188	81 Å²	81	74%	0.737	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20	174.6	70.3	-86.7	0	0	0	113.4	L16 V265	L16-Y263 HydrophobicContact CD1-CD2 3.85Å; L16-Y263 HydrophobicContact CD1-CE2 4.33Å; Y263-V265 VanDerWaalsContact C-N 3.28Å
264	T	97	Very high	97.4	Very high	33 Å²	33	78.4 Å²	78.4	20%	0.202	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.6	174.7	58.9	0	0	0	0	112.4	R9 R262 A266	R9-T264 PolarHBondContact NH1-O 3.07Å; R9-T264 PolarHBondContact NH2-O 2.63Å; R262-T264 PolarHBondContact O-N 3.09Å; R262-T264 VanDerWaalsContact O-N 3.09Å; T264-A266 PolarHBondContact O-N 2.9Å
265	V	97.2	Very high	97.6	Very high	27 Å²	27	78.2 Å²	78.2	16%	0.164	38%	0.378	C	S	.	.	S	Bend	trans	-74.3	131.9	177.6	178.8	0	0	0	0	109.2	I253 V261 R262 Y263 R267	I253-V265 HydrophobicContact CB-CG1 3.95Å; I253-V265 HydrophobicContact CG2-CG1 4.17Å; I253-V265 WeakPolarHBondContact O-CG2 3.39Å; V261-V265 HydrophobicContact CG1-CB 3.86Å; V261-V265 HydrophobicContact CG1-CG1 4.16Å; V261-V265 HydrophobicContact CG1-CG2 3.99Å; R262-V265 HydrophobicContact CB-CG2 4.19Å; R262-V265 WeakPolarHBondContact O-CB 3.41Å; R262-V265 WeakPolarHBondContact O-CG2 3.26Å; R262-V265 PolarHBondContact O-N 3.4Å; Y263-V265 VanDerWaalsContact C-N 3.28Å; V265-R267 PolarHBondContact O-N 3.15Å; V265-R267 VanDerWaalsContact O-N 3.14Å
266	A	97.7	Very high	97.6	Very high	13 Å²	13	77 Å²	77	11%	0.107	36%	0.357	C	S	.	.			trans	-66.6	114.3	177.5	0	0	0	0	0	110.2	V230 W234 T236 V250 T264	V230-A266 VanDerWaalsContact CG1-O 3.29Å; V230-A266 WeakPolarHBondContact CG1-O 3.27Å; W234-A266 HydrophobicContact CB-CB 3.77Å; W234-A266 HydrophobicContact CD2-CB 3.91Å; W234-A266 HydrophobicContact CG-CB 3.53Å; T236-A266 HydrophobicContact CG2-CB 3.89Å; V250-A266 HydrophobicContact CG2-CB 4.18Å; T264-A266 PolarHBondContact O-N 2.9Å
267	R	98.2	Very high	97.7	Very high	126 Å²	126	69.4 Å²	69.4	48%	0.475	34%	0.335	S	S	.	.			trans	-120.3	154.6	176.9	-56.8	-62	-67.6	-82.2	2.2	112	R233 W234 V265	R233-R267 WeakPolarHBondContact CD-O 3.29Å; R233-R267 PolarHBondContact NH1-O 3.34Å; W234-R267 VanDerWaalsContact CD1-O 3.28Å; W234-R267 PolarHBondContact NE1-O 3.35Å; V265-R267 PolarHBondContact O-N 3.15Å; V265-R267 VanDerWaalsContact O-N 3.14Å
268	A	98.2	Very high	97.8	Very high	40 Å²	40	64.9 Å²	64.9	33%	0.331	31%	0.314	S	S	.	.			trans	-62.3	161.4	173	0	0	0	0	0	111.1	F227 K228 V230 R233	F227-A268 HydrophobicContact CE1-CB 3.81Å; F227-A268 HydrophobicContact CZ-CB 3.91Å; K228-A268 WeakPolarHBondContact O-CA 3.41Å; V230-A268 VanDerWaalsContact CG1-N 3.35Å; R233-A268 VanDerWaalsContact NH1-C 3.29Å; R233-A268 PolarHBondContact NH1-O 3.08Å
269	G	98.5	Very high	97.8	Very high	8 Å²	8	66.7 Å²	66.7	8%	0.082	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.8	-161.8	179.3	0	0	0	0	0	113	K228 K271	K228-G269 PolarHBondContact N-O 3.26Å; K228-G269 PolarHBondContact O-N 3.27Å; G269-K271 PolarHBondContact O-N 3.05Å
270	Q	98.4	Very high	97.8	Very high	39 Å²	39	64.2 Å²	64.2	18%	0.182	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	127.5	179.6	178.9	64.7	28	0	0	112.3	R20 R233 G272	R20-Q270 HydrophobicContact CG-CG 3.8Å; R233-Q270 PolarHBondContact NE-O 3.41Å; Q270-G272 PolarHBondContact NE2-O 2.63Å
271	K	98.4	Very high	97.9	Very high	51 Å²	51	56.2 Å²	56.2	22%	0.222	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.3	166.6	-177.5	179.5	179.2	170.2	0	109.8	H225 G226 K228 S232 R233 G269	H225-K271 WeakPolarHBondContact CA-O 3.45Å; H225-K271 HydrophobicContact CB-CB 4.19Å; H225-K271 HydrophobicContact CB-CD 4.38Å; H225-K271 HydrophobicContact CB-CG 4.2Å; H225-K271 WeakPolarHBondContact CB-O 3.34Å; H225-K271 PolarHBondContact N-O 3.18Å; G226-K271 PolarHBondContact O-N 3.43Å; K228-K271 HydrophobicContact CB-CB 3.84Å; K228-K271 HydrophobicContact CB-CD 4.28Å; K228-K271 HydrophobicContact CG-CB 3.72Å; K228-K271 HydrophobicContact CG-CD 4.01Å; K228-K271 HydrophobicContact CG-CG 4.44Å; S232-K271 WeakPolarHBondContact O-CE 3.33Å; S232-K271 PolarHBondContact O-NZ 3.05Å; S232-K271 PolarHBondContact OG-NZ 2.81Å; R233-K271 HydrophobicContact CG-CB 4.42Å; G269-K271 PolarHBondContact O-N 3.05Å
272	G	98.1	Very high	97.9	Very high	8 Å²	8	53.4 Å²	53.4	8%	0.082	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.5	-178.8	178.1	0	0	0	0	0	113.1	K223 Q270 H274	K223-G272 CarbonylContact O-C 3.45Å; K223-G272 WeakPolarHBondContact O-CA 3.38Å; Q270-G272 PolarHBondContact NE2-O 2.63Å; G272-H274 PolarHBondContact O-CD2 3.2Å; G272-H274 PolarHBondContact O-N 2.87Å; G272-H274 PolarHBondContact O-NE2 3.07Å
273	Y	98.5	Very high	98	Very high	46 Å²	46	46.4 Å²	46.4	18%	0.18	22%	0.224	C	C	.	.			trans	59.8	29.5	-167	-154.2	-100.2	0	0	0	113.1	R20 S21 V221 T222 K223	R20-Y273 CarbonylContact C-O 3.49Å; R20-Y273 HydrophobicContact CB-CD1 3.83Å; R20-Y273 HydrophobicContact CB-CE1 4.48Å; R20-Y273 HydrophobicContact CG-CD1 4.08Å; S21-Y273 WeakPolarHBondContact CB-O 3.36Å; S21-Y273 PolarHBondContact N-O 2.81Å; S21-Y273 WeakPolarHBondContact O-CE1 3.47Å; V221-Y273 HydrophobicContact CG1-CD1 4.12Å; V221-Y273 HydrophobicContact CG1-CD2 3.67Å; V221-Y273 HydrophobicContact CG1-CE1 4.38Å; V221-Y273 HydrophobicContact CG1-CE2 3.98Å; V221-Y273 HydrophobicContact CG1-CG 3.76Å; T222-Y273 VanDerWaalsContact O-CA 3.24Å; T222-Y273 WeakPolarHBondContact O-CA 3.39Å; T222-Y273 PolarHBondContact O-N 2.73Å; T222-Y273 PolarHBondContact OG1-N 3.49Å; T222-Y273 VanDerWaalsContact OG1-N 3.12Å; K223-Y273 PolarHBondContact O-N 2.86Å; K223-Y273 VanDerWaalsContact O-N 3.15Å
274	H	98.5	Very high	98.1	Very high	15 Å²	15	37.4 Å²	37.4	7%	0.069	19%	0.189	C	C	.	.			trans	-94.3	147.5	174.2	-50.7	159.5	0	0	0	110.8	K19 V221 T222 G272 R276	K19-H274 PolarHBondContact O-CD2 2.7Å; V221-H274 WeakPolarHBondContact CA-O 3.46Å; T222-H274 PolarHBondContact N-O 2.96Å; T222-H274 PolarHBondContact OG1-N 2.81Å; T222-H274 PolarHBondContact OG1-O 3.01Å; T222-H274 VanDerWaalsContact OG1-O 3.11Å; G272-H274 PolarHBondContact O-CD2 3.2Å; G272-H274 PolarHBondContact O-N 2.87Å; G272-H274 PolarHBondContact O-NE2 3.07Å; H274-R276 PolarHBondContact ND1-NH2 2.87Å
275	H	98.5	Very high	98.1	Very high	37 Å²	37	37.9 Å²	37.9	17%	0.171	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.7	168.4	176.8	-87.3	0	0	0	110.3	K27 I219 G220	K27-H275 PolarHBondContact N-NE2 3.1Å; K27-H275 PolarHBondContact O-NE2 2.97Å; I219-H275 WeakPolarHBondContact CG2-NE2 3.5Å; G220-H275 WeakPolarHBondContact O-CA 2.98Å
276	R	98.2	Very high	98.1	Very high	53 Å²	53	37.9 Å²	37.9	20%	0.2	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	159.7	172	-55.5	-74.5	-179.8	-101.4	5.1	110.1	G220 T222 H274 I332	G220-R276 PolarHBondContact N-O 2.88Å; G220-R276 PolarHBondContact O-N 2.7Å; G220-R276 VanDerWaalsContact O-N 3.09Å; T222-R276 HydrophobicContact CG2-CG 3.86Å; H274-R276 PolarHBondContact ND1-NH2 2.87Å; R276-I332 HydrophobicContact CB-CD1 3.56Å; R276-I332 HydrophobicContact CG-CD1 4.26Å
277	T	98.4	Very high	98.1	Very high	56 Å²	56	37.5 Å²	37.5	34%	0.344	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.3	168.6	-60.4	0	0	0	0	106.9	D217 I219 I279	D217-T277 HydrophobicContact CB-CG2 4.05Å; I219-T277 HydrophobicContact CD1-CG2 4.45Å; I219-T277 HydrophobicContact CG1-CG2 3.8Å; T277-I279 HydrophobicContact CG2-CG2 3.85Å
278	E	97.9	Very high	98	Very high	52 Å²	52	35.2 Å²	35.2	24%	0.243	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	109.8	167.8	-67.3	-177.3	-156	0	0	107.5	D217 C218 K281 I332	D217-E278 CarbonylContact C-O 3.23Å; D217-E278 WeakPolarHBondContact CA-O 3.39Å; C218-E278 HydrophobicContact CB-CB 4.44Å; C218-E278 PolarHBondContact N-O 3.31Å; C218-E278 PolarHBondContact O-N 2.93Å; E278-K281 WeakPolarHBondContact OE2-CE 3.5Å; E278-K281 IonicContact OE2-NZ 3.61Å; E278-K281 PolarHBondContact OE2-NZ 2.88Å; E278-I332 PolarHBondContact OE1-N 2.99Å
279	I	97.5	Very high	97.8	Very high	86 Å²	86	33.7 Å²	33.7	44%	0.441	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	164	-179.1	63.3	173.9	0	0	0	111.7	D217 T277 K281 L346	D217-I279 WeakPolarHBondContact OD1-CA 3.26Å; D217-I279 VanDerWaalsContact OD1-CB 3.28Å; D217-I279 WeakPolarHBondContact OD1-CB 3.31Å; D217-I279 WeakPolarHBondContact OD1-CG2 3.1Å; T277-I279 HydrophobicContact CG2-CG2 3.85Å; I279-K281 PolarHBondContact O-N 2.96Å; I279-L346 HydrophobicContact CD1-CD1 4.13Å
280	N	97	Very high	97.3	Very high	61 Å²	61	34 Å²	34	33%	0.326	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.5	42.9	168.8	-54.4	-7.5	0	0	0	113.7	M215 I216 D217 H348	M215-N280 HydrophobicContact CE-CB 3.87Å; M215-N280 HydrophobicContact SD-CB 4.35Å; I216-N280 PolarHBondContact O-N 3.02Å; D217-N280 PolarHBondContact OD1-N 3.31Å; N280-H348 PolarHBondContact OD1-CE1 2.84Å; N280-H348 PolarHBondContact OD1-NE2 2.89Å
281	K	98.2	Very high	96.7	Very high	30 Å²	30	39 Å²	39	13%	0.13	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	114.5	170	-63.3	-66.5	177.9	167.7	0	108.2	I216 C218 E278 I279 C330	I216-K281 HydrophobicContact CG1-CB 4.2Å; I216-K281 VanDerWaalsContact CG1-O 3.26Å; I216-K281 WeakPolarHBondContact CG1-O 3.32Å; I216-K281 PolarHBondContact N-O 2.88Å; I216-K281 PolarHBondContact O-N 3.35Å; C218-K281 HydrophobicContact CB-CG 4.32Å; E278-K281 WeakPolarHBondContact OE2-CE 3.5Å; E278-K281 IonicContact OE2-NZ 3.61Å; E278-K281 PolarHBondContact OE2-NZ 2.88Å; I279-K281 PolarHBondContact O-N 2.96Å; K281-C330 WeakPolarHBondContact CE-O 3.19Å; K281-C330 PolarHBondContact NZ-O 3.06Å
282	K	98.2	Very high	96.4	Very high	5 Å²	5	42.2 Å²	42.2	2%	0.022	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	134.1	177.6	-165.9	159.2	-177.8	128.7	0	110.5	D213 M215 Y284 V327 K328 S352 A353 E355 I357	D213-K282 VanDerWaalsContact O-CE 3.28Å; D213-K282 WeakPolarHBondContact O-CE 3.44Å; D213-K282 PolarHBondContact O-NZ 3.1Å; M215-K282 HydrophobicContact SD-CB 3.65Å; M215-K282 HydrophobicContact SD-CG 4.23Å; K282-Y284 HydrophobicContact CB-CD1 4.23Å; K282-Y284 HydrophobicContact CB-CE1 3.87Å; K282-Y284 HydrophobicContact CD-CE1 4.04Å; K282-Y284 HydrophobicContact CG-CD1 4.04Å; K282-Y284 HydrophobicContact CG-CE1 3.87Å; K282-V327 WeakPolarHBondContact O-CA 3.17Å; K282-K328 HydrophobicContact CB-CB 4.24Å; K282-K328 PolarHBondContact O-N 2.85Å; K282-S352 PolarHBondContact NZ-O 3.23Å; K282-A353 VanDerWaalsContact NZ-C 3.29Å; K282-A353 PolarHBondContact NZ-O 3.13Å; K282-E355 WeakPolarHBondContact CE-O 3.28Å; K282-E355 PolarHBondContact NZ-O 2.92Å; K282-I357 HydrophobicContact CD-CD1 4.15Å; K282-I357 HydrophobicContact CD-CG1 4.1Å; K282-I357 VanDerWaalsContact CE-CG1 3.45Å
283	I	98.5	Very high	96.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.7	168.6	-63.6	176.3	0	0	0	108	F210 A211 D213 E214 I216 I286 V325	F210-I283 HydrophobicContact CB-CD1 3.72Å; F210-I283 HydrophobicContact CD1-CD1 4.46Å; F210-I283 HydrophobicContact CG-CD1 4.23Å; A211-I283 WeakPolarHBondContact O-CD1 3.39Å; D213-I283 WeakPolarHBondContact CA-O 3.45Å; D213-I283 PolarHBondContact N-O 3.44Å; D213-I283 VanDerWaalsContact N-O 3.09Å; E214-I283 PolarHBondContact O-N 2.89Å; I216-I283 HydrophobicContact CD1-CD1 4.05Å; I216-I283 HydrophobicContact CD1-CG1 3.91Å; I216-I283 HydrophobicContact CG1-CD1 4.46Å; I216-I283 HydrophobicContact CG1-CG1 4.15Å; I216-I283 HydrophobicContact CG2-CD1 3.66Å; I216-I283 HydrophobicContact CG2-CG1 4.09Å; I283-I286 HydrophobicContact CD1-CD1 4.46Å; I283-I286 HydrophobicContact CG2-CD1 4.35Å; I283-I286 HydrophobicContact CG2-CG1 3.7Å; I283-V325 HydrophobicContact CB-CG1 4.38Å; I283-V325 HydrophobicContact CD1-CG1 4.08Å; I283-V325 HydrophobicContact CG1-CG1 3.81Å; I283-V325 HydrophobicContact CG2-CG1 3.88Å
284	Y	98.1	Very high	95.7	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-28.4	176.9	-77.1	7.5	0	0	0	112.6	I55 E73 V75 K282 M326 K328 I357 L359	I55-Y284 HydrophobicContact CD1-CD2 3.72Å; I55-Y284 HydrophobicContact CD1-CE2 3.74Å; I55-Y284 HydrophobicContact CG1-CD2 4.25Å; I55-Y284 HydrophobicContact CG1-CE2 4.4Å; E73-Y284 HydrophobicContact CB-CE2 4.42Å; E73-Y284 VanDerWaalsContact OE2-CE2 3.24Å; E73-Y284 WeakPolarHBondContact OE2-CE2 3.11Å; E73-Y284 VanDerWaalsContact OE2-CZ 3.23Å; E73-Y284 PolarHBondContact OE2-OH 2.96Å; V75-Y284 HydrophobicContact CG1-CD2 3.69Å; V75-Y284 HydrophobicContact CG1-CE2 4.13Å; K282-Y284 HydrophobicContact CB-CD1 4.23Å; K282-Y284 HydrophobicContact CB-CE1 3.87Å; K282-Y284 HydrophobicContact CD-CE1 4.04Å; K282-Y284 HydrophobicContact CG-CD1 4.04Å; K282-Y284 HydrophobicContact CG-CE1 3.87Å; Y284-M326 PolarHBondContact N-O 2.86Å; Y284-K328 HydrophobicContact CD1-CB 4.4Å; Y284-K328 HydrophobicContact CE1-CB 3.85Å; Y284-K328 HydrophobicContact CE1-CD 4.26Å; Y284-K328 HydrophobicContact CE1-CG 4.22Å; Y284-K328 HydrophobicContact CE2-CB 4.35Å; Y284-K328 HydrophobicContact CE2-CG 4.3Å; Y284-K328 VanDerWaalsContact OH-CD 3.22Å; Y284-K328 WeakPolarHBondContact OH-CD 3.44Å; Y284-K328 WeakPolarHBondContact OH-CE 3.24Å; Y284-K328 WeakPolarHBondContact OH-CG 3.33Å; Y284-K328 PolarHBondContact OH-NZ 3.26Å; Y284-I357 HydrophobicContact CD1-CB 4.26Å; Y284-I357 HydrophobicContact CD1-CD1 4.33Å; Y284-I357 HydrophobicContact CD1-CG1 3.76Å; Y284-I357 HydrophobicContact CD1-CG2 3.93Å; Y284-I357 HydrophobicContact CD2-CG2 4.2Å; Y284-I357 HydrophobicContact CE1-CD1 3.88Å; Y284-I357 HydrophobicContact CE1-CG1 3.82Å; Y284-I357 HydrophobicContact CE1-CG2 4.31Å; Y284-I357 HydrophobicContact CG-CG2 3.87Å; Y284-L359 HydrophobicContact CD2-CD2 4.28Å
285	R	97.9	Very high	95.5	Very high	42 Å²	42	54 Å²	54	16%	0.158	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	138.6	176.2	-178.6	173.7	-77.2	-166.2	-3.9	109.7	N296 S298 M326 L359 I362	R285-N296 PolarHBondContact NH1-O 3.42Å; R285-S298 VanDerWaalsContact CZ-O 3.29Å; R285-S298 PolarHBondContact NH1-O 3.43Å; R285-S298 PolarHBondContact NH2-O 2.86Å; R285-M326 HydrophobicContact CB-CB 4.15Å; R285-M326 PolarHBondContact O-N 2.88Å; R285-L359 HydrophobicContact CB-CD1 4.07Å; R285-I362 VanDerWaalsContact NH1-CD1 3.32Å
286	I	98.1	Very high	95.3	Very high	28 Å²	28	52.4 Å²	52.4	14%	0.144	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	102.5	161.8	-57.6	-177	0	0	0	106.1	I206 D207 F210 I283 F324 V325	I206-I286 HydrophobicContact CG2-CG2 3.67Å; D207-I286 HydrophobicContact CB-CG2 4.11Å; F210-I286 HydrophobicContact CB-CD1 4.22Å; F210-I286 WeakPolarHBondContact O-CD1 3.44Å; I283-I286 HydrophobicContact CD1-CD1 4.46Å; I283-I286 HydrophobicContact CG2-CD1 4.35Å; I283-I286 HydrophobicContact CG2-CG1 3.7Å; I286-F324 CarbonylContact C-O 3.59Å; I286-F324 WeakPolarHBondContact CA-O 3.39Å; I286-V325 HydrophobicContact CG1-CG2 4.46Å
287	G	96.8	Very high	95.1	Very high	5 Å²	5	49.9 Å²	49.9	5%	0.052	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.3	-176.3	0	0	0	0	0	111.7	D323 F324	G287-D323 CarbonylContact O-C 3.5Å; G287-D323 VanDerWaalsContact O-CA 3.27Å; G287-D323 WeakPolarHBondContact O-CA 3.36Å; G287-F324 PolarHBondContact N-O 2.76Å; G287-F324 PolarHBondContact O-N 3.26Å
288	K	96.8	Very high	95	Very high	77 Å²	77	47.9 Å²	47.9	34%	0.335	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-78	158.3	175.4	-65.3	-67.2	176.9	177.9	0	111.5	D207 D293 N296 D323	D207-K288 IonicContact OD1-NZ 2.79Å; D207-K288 IonicContact OD2-NZ 2.84Å; D207-K288 PolarHBondContact OD2-NZ 2.84Å; K288-D293 HydrophobicContact CB-CB 4.02Å; K288-N296 PolarHBondContact O-ND2 3.17Å; K288-D323 WeakPolarHBondContact CA-OD1 3.45Å
289	A	92.6	Very high	94.8	Very high	8 Å²	8	46 Å²	46	7%	0.066	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-46.7	138	172.6	0	0	0	0	0	112	L291 V292 D293 N321 D323	A289-L291 PolarHBondContact O-N 3.06Å; A289-L291 VanDerWaalsContact O-N 3.08Å; A289-V292 HydrophobicContact CB-CB 4.48Å; A289-V292 HydrophobicContact CB-CG2 4.13Å; A289-V292 PolarHBondContact O-N 2.62Å; A289-D293 PolarHBondContact O-N 3.44Å; A289-N321 VanDerWaalsContact CB-O 3.25Å; A289-N321 WeakPolarHBondContact CB-O 3.37Å; A289-D323 PolarHBondContact N-OD1 2.99Å
290	A	87.8	Confident	94.6	Very high	14 Å²	14	49.7 Å²	49.7	12%	0.116	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.6	-178.5	0	0	0	0	0	113.9	N296 T307	A290-N296 WeakPolarHBondContact CA-ND2 3.2Å; A290-N296 PolarHBondContact N-ND2 3.45Å; A290-T307 HydrophobicContact CB-CG2 4.08Å
291	L	86.9	Confident	94.5	Very high	145 Å²	145	52.8 Å²	52.8	76%	0.759	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-26.2	173.6	-67.3	173	0	0	0	112.9	A289	A289-L291 PolarHBondContact O-N 3.06Å; A289-L291 VanDerWaalsContact O-N 3.08Å
292	V	91.5	Very high	94.2	Very high	118 Å²	118	52.3 Å²	52.3	72%	0.715	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-45.2	178.9	179.2	0	0	0	0	109.9	A289	A289-V292 HydrophobicContact CB-CB 4.48Å; A289-V292 HydrophobicContact CB-CG2 4.13Å; A289-V292 PolarHBondContact O-N 2.62Å
293	D	92	Very high	93.9	Very high	58 Å²	58	59.2 Å²	59.2	31%	0.31	29%	0.292	S	S	.	.			trans	-125.1	101.3	179.7	178.1	11.8	0	0	0	110.2	K288 A289 K295 N296	K288-D293 HydrophobicContact CB-CB 4.02Å; A289-D293 PolarHBondContact O-N 3.44Å; D293-K295 PolarHBondContact O-N 2.96Å; D293-K295 WeakPolarHBondContact OD1-CA 3.45Å; D293-K295 WeakPolarHBondContact OD1-CB 3.39Å; D293-K295 PolarHBondContact OD1-N 3.49Å; D293-N296 HydrophobicContact CB-CB 4.16Å; D293-N296 WeakPolarHBondContact O-CB 3.05Å; D293-N296 PolarHBondContact O-N 3.17Å; D293-N296 PolarHBondContact O-ND2 2.61Å; D293-N296 PolarHBondContact OD1-N 2.9Å; D293-N296 VanDerWaalsContact OD2-CA 3.25Å; D293-N296 WeakPolarHBondContact OD2-CA 3.48Å; D293-N296 WeakPolarHBondContact OD2-CB 3.11Å; D293-N296 PolarHBondContact OD2-N 3.45Å
294	K	90.5	Very high	93.6	Very high	160 Å²	160	62 Å²	62	70%	0.696	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.5	176.4	-66.1	-177.6	-178.2	175.8	0	112.8	K306 T307	K294-K306 CarbonylContact O-C 3.51Å; K294-T307 WeakPolarHBondContact O-CG2 3.22Å
295	K	93.5	Very high	93.3	Very high	100 Å²	100	68 Å²	68	44%	0.435	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	17.2	180	-53.6	-172.4	-170.6	-159	0	112.3	D293 G297 S298 E305 K306	D293-K295 PolarHBondContact O-N 2.96Å; D293-K295 WeakPolarHBondContact OD1-CA 3.45Å; D293-K295 WeakPolarHBondContact OD1-CB 3.39Å; D293-K295 PolarHBondContact OD1-N 3.49Å; K295-G297 PolarHBondContact O-N 2.89Å; K295-S298 VanDerWaalsContact O-CB 3.31Å; K295-S298 WeakPolarHBondContact O-CB 3.25Å; K295-S298 PolarHBondContact O-N 3.03Å; K295-S298 PolarHBondContact O-OG 3.14Å; K295-E305 HydrophobicContact CD-CG 3.96Å; K295-E305 WeakPolarHBondContact CE-OE1 3.41Å; K295-E305 HydrophobicContact CG-CB 4.27Å; K295-E305 HydrophobicContact CG-CG 4.13Å; K295-E305 VanDerWaalsContact NZ-CD 3.33Å; K295-E305 IonicContact NZ-OE1 3.58Å; K295-E305 PolarHBondContact NZ-OE1 3.02Å; K295-K306 CarbonylContact C-O 3.54Å
296	N	94.9	Very high	93.2	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.011	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.2	-176.6	67.2	16.2	0	0	0	114.8	R285 K288 A290 D293 T307 I308 F324	R285-N296 PolarHBondContact NH1-O 3.42Å; K288-N296 PolarHBondContact O-ND2 3.17Å; A290-N296 WeakPolarHBondContact CA-ND2 3.2Å; A290-N296 PolarHBondContact N-ND2 3.45Å; D293-N296 HydrophobicContact CB-CB 4.16Å; D293-N296 WeakPolarHBondContact O-CB 3.05Å; D293-N296 PolarHBondContact O-N 3.17Å; D293-N296 PolarHBondContact O-ND2 2.61Å; D293-N296 PolarHBondContact OD1-N 2.9Å; D293-N296 VanDerWaalsContact OD2-CA 3.25Å; D293-N296 WeakPolarHBondContact OD2-CA 3.48Å; D293-N296 WeakPolarHBondContact OD2-CB 3.11Å; D293-N296 PolarHBondContact OD2-N 3.45Å; N296-T307 WeakPolarHBondContact OD1-CA 3.21Å; N296-T307 WeakPolarHBondContact OD1-CB 3.31Å; N296-I308 PolarHBondContact OD1-N 3.42Å; N296-F324 HydrophobicContact CB-CE1 4.03Å
297	G	94.5	Very high	93.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-2.6	172.1	0	0	0	0	0	114.9	K295 K306	K295-G297 PolarHBondContact O-N 2.89Å; G297-K306 CarbonylContact C-O 3.58Å; G297-K306 WeakPolarHBondContact CA-O 3.23Å; G297-K306 PolarHBondContact N-O 3.4Å; G297-K306 VanDerWaalsContact O-CE 3.29Å; G297-K306 WeakPolarHBondContact O-CE 3.34Å
298	S	95.1	Very high	93.1	Very high	14 Å²	14	67 Å²	67	10%	0.098	33%	0.334	C	S	.	.			trans	-83.3	164.3	176	-52.1	0	0	0	0	111.5	R285 K295 T304 K306	R285-S298 VanDerWaalsContact CZ-O 3.29Å; R285-S298 PolarHBondContact NH1-O 3.43Å; R285-S298 PolarHBondContact NH2-O 2.86Å; K295-S298 VanDerWaalsContact O-CB 3.31Å; K295-S298 WeakPolarHBondContact O-CB 3.25Å; K295-S298 PolarHBondContact O-N 3.03Å; K295-S298 PolarHBondContact O-OG 3.14Å; S298-T304 WeakPolarHBondContact CB-O 3.33Å; S298-T304 PolarHBondContact OG-O 3.45Å; S298-K306 PolarHBondContact N-O 2.83Å; S298-K306 PolarHBondContact OG-N 3.09Å
299	T	95.5	Very high	93.1	Very high	12 Å²	12	64.1 Å²	64.1	7%	0.074	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-135.1	166.6	176.6	48.2	0	0	0	0	109.9	Y301 D302 L359 K360 I362	T299-Y301 PolarHBondContact O-N 3.44Å; T299-D302 PolarHBondContact N-O 3.42Å; T299-D302 CarbonylContact O-C 3.56Å; T299-D302 VanDerWaalsContact O-C 3.29Å; T299-D302 PolarHBondContact O-N 2.9Å; T299-D302 VanDerWaalsContact O-N 3.07Å; T299-D302 WeakPolarHBondContact OG1-CB 3.5Å; T299-D302 PolarHBondContact OG1-N 3.44Å; T299-L359 VanDerWaalsContact CB-O 3.25Å; T299-L359 WeakPolarHBondContact CB-O 3.47Å; T299-L359 HydrophobicContact CG2-CB 3.68Å; T299-L359 VanDerWaalsContact CG2-O 3.28Å; T299-L359 WeakPolarHBondContact CG2-O 3.24Å; T299-K360 VanDerWaalsContact OG1-C 3.26Å; T299-K360 PolarHBondContact OG1-O 3.21Å; T299-I362 HydrophobicContact CG2-CD1 4.25Å; T299-I362 HydrophobicContact CG2-CG1 4.2Å
300	E	93.2	Very high	93.4	Very high	164 Å²	164	63.9 Å²	63.9	77%	0.766	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.5	177.7	-65.5	179.6	-171.4	0	0	112.2
301	Y	93.7	Very high	93.8	Very high	126 Å²	126	65.3 Å²	65.3	49%	0.494	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-17	176	-59.1	-87.5	0	0	0	114.8	T299 E358 K360	T299-Y301 PolarHBondContact O-N 3.44Å; Y301-E358 HydrophobicContact CE2-CG 4.08Å; Y301-E358 WeakPolarHBondContact CE2-OE1 3.46Å; Y301-E358 PolarHBondContact OH-OE1 2.66Å; Y301-K360 HydrophobicContact CD2-CB 4.14Å; Y301-K360 HydrophobicContact CD2-CD 4.44Å; Y301-K360 HydrophobicContact CD2-CG 3.64Å; Y301-K360 HydrophobicContact CE2-CG 3.88Å; Y301-K360 HydrophobicContact CG-CB 4.31Å; Y301-K360 HydrophobicContact CG-CD 4.48Å; Y301-K360 HydrophobicContact CG-CG 4.03Å
302	D	92.1	Very high	94.2	Very high	20 Å²	20	62.9 Å²	62.9	11%	0.107	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-120.6	92.2	179.9	-179.9	9.9	0	0	0	108.3	T299 T304 K306 F361	T299-D302 PolarHBondContact N-O 3.42Å; T299-D302 CarbonylContact O-C 3.56Å; T299-D302 VanDerWaalsContact O-C 3.29Å; T299-D302 PolarHBondContact O-N 2.9Å; T299-D302 VanDerWaalsContact O-N 3.07Å; T299-D302 WeakPolarHBondContact OG1-CB 3.5Å; T299-D302 PolarHBondContact OG1-N 3.44Å; D302-T304 PolarHBondContact O-N 2.77Å; D302-T304 WeakPolarHBondContact OD1-CB 3.01Å; D302-T304 PolarHBondContact OD1-N 3.37Å; D302-T304 PolarHBondContact OD1-OG1 2.88Å; D302-K306 WeakPolarHBondContact OD2-CE 3.48Å; D302-K306 IonicContact OD2-NZ 2.59Å; D302-K306 PolarHBondContact OD2-NZ 3.31Å; D302-F361 HydrophobicContact CB-CD2 4.49Å; D302-F361 WeakPolarHBondContact OD2-CD2 3.32Å
303	L	90.9	Very high	94.4	Very high	151 Å²	151	57.5 Å²	57.5	79%	0.791	30%	0.304	S	S	*	.			trans	-70.1	-6.7	-176.1	-56.4	179.7	0	0	0	113	E305	L303-E305 PolarHBondContact O-N 3.41Å; L303-E305 VanDerWaalsContact O-N 3.14Å
304	T	92.5	Very high	94.7	Very high	57 Å²	57	55 Å²	55	35%	0.35	29%	0.29	S	S	.	.			trans	-60.8	116.4	178.4	-50.5	0	0	0	0	110	S298 D302 K306 T375	S298-T304 WeakPolarHBondContact CB-O 3.33Å; S298-T304 PolarHBondContact OG-O 3.45Å; D302-T304 PolarHBondContact O-N 2.77Å; D302-T304 WeakPolarHBondContact OD1-CB 3.01Å; D302-T304 PolarHBondContact OD1-N 3.37Å; D302-T304 PolarHBondContact OD1-OG1 2.88Å; T304-K306 HydrophobicContact CG2-CD 4.21Å; T304-K306 PolarHBondContact O-N 3.19Å; T304-T375 HydrophobicContact CG2-CG2 3.43Å; T304-T375 VanDerWaalsContact CG2-CG2 3.43Å
305	E	92.6	Very high	94.9	Very high	126 Å²	126	48.9 Å²	48.9	59%	0.589	27%	0.267	S	S	*	.			trans	-67.8	106.7	175.5	-60.6	-167.4	178.6	0	0	110.6	K295 L303	K295-E305 HydrophobicContact CD-CG 3.96Å; K295-E305 WeakPolarHBondContact CE-OE1 3.41Å; K295-E305 HydrophobicContact CG-CB 4.27Å; K295-E305 HydrophobicContact CG-CG 4.13Å; K295-E305 VanDerWaalsContact NZ-CD 3.33Å; K295-E305 IonicContact NZ-OE1 3.58Å; K295-E305 PolarHBondContact NZ-OE1 3.02Å; L303-E305 PolarHBondContact O-N 3.41Å; L303-E305 VanDerWaalsContact O-N 3.14Å
306	K	95	Very high	95	Very high	12 Å²	12	50.3 Å²	50.3	5%	0.052	28%	0.275	C	S	.	.			trans	-149	150.9	-178	66.4	-164.1	-173.4	175.1	0	111.4	K294 K295 G297 S298 D302 T304 I362 T364 T375	K294-K306 CarbonylContact O-C 3.51Å; K295-K306 CarbonylContact C-O 3.54Å; G297-K306 CarbonylContact C-O 3.58Å; G297-K306 WeakPolarHBondContact CA-O 3.23Å; G297-K306 PolarHBondContact N-O 3.4Å; G297-K306 VanDerWaalsContact O-CE 3.29Å; G297-K306 WeakPolarHBondContact O-CE 3.34Å; S298-K306 PolarHBondContact N-O 2.83Å; S298-K306 PolarHBondContact OG-N 3.09Å; D302-K306 WeakPolarHBondContact OD2-CE 3.48Å; D302-K306 IonicContact OD2-NZ 2.59Å; D302-K306 PolarHBondContact OD2-NZ 3.31Å; T304-K306 HydrophobicContact CG2-CD 4.21Å; T304-K306 PolarHBondContact O-N 3.19Å; K306-I362 WeakPolarHBondContact CE-O 3.34Å; K306-I362 PolarHBondContact NZ-O 3.21Å; K306-T364 HydrophobicContact CD-CG2 4.05Å; K306-T364 WeakPolarHBondContact CD-OG1 3.36Å; K306-T364 HydrophobicContact CG-CG2 4.22Å; K306-T375 HydrophobicContact CB-CG2 4.1Å; K306-T375 HydrophobicContact CD-CG2 4.48Å
307	T	96.6	Very high	95.1	Very high	40 Å²	40	50.8 Å²	50.8	25%	0.245	28%	0.276	C	S	.	.			trans	-86.2	165.9	171.7	72.1	0	0	0	0	110.7	A290 K294 N296 N309 T364	A290-T307 HydrophobicContact CB-CG2 4.08Å; K294-T307 WeakPolarHBondContact O-CG2 3.22Å; N296-T307 WeakPolarHBondContact OD1-CA 3.21Å; N296-T307 WeakPolarHBondContact OD1-CB 3.31Å; T307-N309 PolarHBondContact O-N 3.11Å; T307-N309 WeakPolarHBondContact OG1-CB 3.22Å; T307-N309 PolarHBondContact OG1-N 3.5Å; T307-N309 PolarHBondContact OG1-ND2 3.36Å; T307-T364 WeakPolarHBondContact O-CG2 3.25Å
308	I	97.1	Very high	95.1	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	29%	0.294	C	S	.	.	S	Bend	trans	-61.2	-11	172.5	-166.3	53.8	0	0	0	113.9	V77 N296 W314 V320 F324 M326 I362	V77-I308 HydrophobicContact CG1-CG1 4.12Å; V77-I308 HydrophobicContact CG2-CD1 4.11Å; V77-I308 HydrophobicContact CG2-CG1 3.96Å; N296-I308 PolarHBondContact OD1-N 3.42Å; I308-W314 HydrophobicContact CG1-CZ2 4.39Å; I308-W314 WeakPolarHBondContact O-CZ2 3.34Å; I308-V320 HydrophobicContact CG2-CB 4.16Å; I308-V320 HydrophobicContact CG2-CG1 4.1Å; I308-F324 HydrophobicContact CB-CD1 4.44Å; I308-F324 HydrophobicContact CB-CE1 3.79Å; I308-F324 HydrophobicContact CB-CE2 4.24Å; I308-F324 HydrophobicContact CB-CZ 3.68Å; I308-F324 HydrophobicContact CD1-CE2 4.16Å; I308-F324 HydrophobicContact CD1-CZ 4.23Å; I308-F324 HydrophobicContact CG1-CD2 4.25Å; I308-F324 HydrophobicContact CG1-CE1 4.21Å; I308-F324 HydrophobicContact CG1-CE2 3.76Å; I308-F324 HydrophobicContact CG1-CZ 3.73Å; I308-F324 HydrophobicContact CG2-CD1 3.85Å; I308-F324 HydrophobicContact CG2-CE1 3.61Å; I308-F324 HydrophobicContact CG2-CG 4.41Å; I308-F324 HydrophobicContact CG2-CZ 4.02Å; I308-M326 HydrophobicContact CD1-CE 3.72Å; I308-I362 HydrophobicContact CD1-CG2 3.68Å
309	N	97.1	Very high	95.1	Very high	17 Å²	17	55.9 Å²	55.9	9%	0.091	31%	0.31	C	S	.	.	S	Bend	trans	-77.4	126.1	-178.4	-67.9	-60.5	0	0	0	110.9	T307 W314 L319 V320	T307-N309 PolarHBondContact O-N 3.11Å; T307-N309 WeakPolarHBondContact OG1-CB 3.22Å; T307-N309 PolarHBondContact OG1-N 3.5Å; T307-N309 PolarHBondContact OG1-ND2 3.36Å; N309-W314 VanDerWaalsContact OD1-CD1 3.31Å; N309-W314 PolarHBondContact OD1-NE1 2.77Å; N309-L319 HydrophobicContact CB-CD2 3.96Å; N309-L319 WeakPolarHBondContact OD1-CA 3.14Å; N309-V320 PolarHBondContact ND2-O 2.93Å; N309-V320 PolarHBondContact OD1-N 2.68Å
310	P	97.4	Very high	95.2	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.026	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-66	159.8	172.2	27.6	-32.8	0	0	0	111.1	G312 G313 W314 T364 S365 K367	P310-G312 PolarHBondContact O-N 3.41Å; P310-G313 WeakPolarHBondContact O-CA 3.02Å; P310-G313 PolarHBondContact O-N 3.02Å; P310-W314 VanDerWaalsContact CD-CE2 3.44Å; P310-W314 HydrophobicContact CG-CD2 3.94Å; P310-W314 HydrophobicContact CG-CE3 4.05Å; P310-W314 HydrophobicContact CG-CG 4.25Å; P310-W314 HydrophobicContact CG-CZ3 4.46Å; P310-T364 CarbonylContact C-O 3.48Å; P310-T364 WeakPolarHBondContact CA-O 3.28Å; P310-S365 WeakPolarHBondContact CB-O 3.3Å; P310-K367 HydrophobicContact CB-CG 3.98Å; P310-K367 HydrophobicContact CG-CG 4.08Å
311	M	96.9	Very high	95.2	Very high	44 Å²	44	48.8 Å²	48.8	22%	0.217	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	128.8	172.7	-65.1	-172	72.2	0	0	111.2	G313 T364 S366 F373 A376 K379	M311-G313 VanDerWaalsContact C-N 3.27Å; M311-T364 PolarHBondContact N-O 3.05Å; M311-S366 WeakPolarHBondContact O-CA 3.43Å; M311-F373 HydrophobicContact SD-CB 3.91Å; M311-F373 VanDerWaalsContact SD-O 3.32Å; M311-A376 HydrophobicContact CE-CB 4.34Å; M311-K379 HydrophobicContact CE-CB 3.99Å; M311-K379 HydrophobicContact CE-CD 3.73Å; M311-K379 HydrophobicContact CE-CG 4.49Å
312	G	95.4	Very high	95.3	Very high	93 Å²	93	44.2 Å²	44.2	96%	0.959	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	1.7	-173.6	0	0	0	0	0	114.8	P310	P310-G312 PolarHBondContact O-N 3.41Å
313	G	96.3	Very high	95.6	Very high	6 Å²	6	44.1 Å²	44.1	6%	0.062	26%	0.26	C	S	.	.			trans	76.2	174.8	-177.1	0	0	0	0	0	113.6	P310 M311 P315	P310-G313 WeakPolarHBondContact O-CA 3.02Å; P310-G313 PolarHBondContact O-N 3.02Å; M311-G313 VanDerWaalsContact C-N 3.27Å; G313-P315 WeakPolarHBondContact O-CD 3.4Å
314	W	97	Very high	96	Very high	6 Å²	6	37 Å²	37	2%	0.023	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-69.4	125.9	-179.4	-69	96.1	0	0	0	110.8	A50 G51 M52 T53 V77 I308 N309 P310 H316 Y317 G318	A50-W314 HydrophobicContact CB-CD2 4.47Å; A50-W314 HydrophobicContact CB-CG 4.29Å; G51-W314 VanDerWaalsContact CA-CE3 3.5Å; M52-W314 VanDerWaalsContact N-CZ3 3.26Å; M52-W314 WeakPolarHBondContact O-CZ3 3.12Å; T53-W314 HydrophobicContact CG2-CH2 4.06Å; V77-W314 HydrophobicContact CB-CH2 4.14Å; V77-W314 HydrophobicContact CB-CZ2 3.83Å; V77-W314 HydrophobicContact CG1-CZ2 4.25Å; V77-W314 HydrophobicContact CG2-CH2 3.72Å; V77-W314 HydrophobicContact CG2-CZ2 3.59Å; I308-W314 HydrophobicContact CG1-CZ2 4.39Å; I308-W314 WeakPolarHBondContact O-CZ2 3.34Å; N309-W314 VanDerWaalsContact OD1-CD1 3.31Å; N309-W314 PolarHBondContact OD1-NE1 2.77Å; P310-W314 VanDerWaalsContact CD-CE2 3.44Å; P310-W314 HydrophobicContact CG-CD2 3.94Å; P310-W314 HydrophobicContact CG-CE3 4.05Å; P310-W314 HydrophobicContact CG-CG 4.25Å; P310-W314 HydrophobicContact CG-CZ3 4.46Å; W314-H316 PolarHBondContact O-N 3.41Å; W314-H316 VanDerWaalsContact O-N 3.08Å; W314-Y317 HydrophobicContact CB-CD1 4.24Å; W314-Y317 HydrophobicContact CB-CG 4.37Å; W314-Y317 PolarHBondContact O-N 2.79Å; W314-G318 WeakPolarHBondContact CB-O 2.99Å; W314-G318 PolarHBondContact N-O 2.84Å; W314-G318 PolarHBondContact O-N 3.25Å
315	P	96.7	Very high	96.2	Very high	31 Å²	31	34.2 Å²	34.2	20%	0.201	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	117.1	-173.8	-30.5	35.2	0	0	0	113.5	G313 Y317 K335 K367 F368	G313-P315 WeakPolarHBondContact O-CD 3.4Å; P315-Y317 PolarHBondContact O-N 3.42Å; P315-K335 WeakPolarHBondContact O-CD 3.2Å; P315-K335 WeakPolarHBondContact O-CE 3.23Å; P315-K335 PolarHBondContact O-NZ 2.92Å; P315-K367 HydrophobicContact CG-CB 3.7Å; P315-K367 WeakPolarHBondContact CG-O 3.37Å; P315-F368 HydrophobicContact CB-CD2 4.46Å; P315-F368 HydrophobicContact CG-CB 4.46Å
316	H	95.2	Very high	96.5	Very high	130 Å²	130	28.2 Å²	28.2	60%	0.602	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	19.2	-176	-38.2	-120.4	0	0	0	115.6	W314 K335 K336	W314-H316 PolarHBondContact O-N 3.41Å; W314-H316 VanDerWaalsContact O-N 3.08Å; H316-K335 HydrophobicContact CB-CD 3.97Å; H316-K335 PolarHBondContact CD2-NZ 3.25Å; H316-K336 WeakPolarHBondContact O-CE 3.46Å; H316-K336 PolarHBondContact O-NZ 2.64Å
317	Y	96.2	Very high	96.7	Very high	12 Å²	12	27.7 Å²	27.7	5%	0.047	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-47.4	169.3	-175.7	-90.6	0	0	0	110.9	A50 E79 M170 H172 W314 P315 V320 K336	A50-Y317 HydrophobicContact CB-CD1 3.73Å; A50-Y317 HydrophobicContact CB-CD2 4.28Å; A50-Y317 HydrophobicContact CB-CE1 3.62Å; A50-Y317 HydrophobicContact CB-CE2 4.18Å; A50-Y317 HydrophobicContact CB-CG 4.06Å; A50-Y317 WeakPolarHBondContact O-CB 3.4Å; E79-Y317 WeakPolarHBondContact CB-OH 3.45Å; E79-Y317 WeakPolarHBondContact OE2-CE1 3.06Å; E79-Y317 VanDerWaalsContact OE2-CZ 3.24Å; E79-Y317 PolarHBondContact OE2-OH 2.82Å; M170-Y317 WeakPolarHBondContact CE-OH 3.28Å; H172-Y317 AromaticContact CE1-CD2 3.75Å; H172-Y317 AromaticContact CE1-CE2 3.34Å; H172-Y317 WeakPolarHBondContact CE1-CE2 3.44Å; H172-Y317 AromaticContact CE1-CZ 3.54Å; H172-Y317 AromaticContact NE2-CE2 3.39Å; H172-Y317 WeakPolarHBondContact NE2-CE2 3.14Å; H172-Y317 AromaticContact NE2-CZ 3.38Å; H172-Y317 PolarHBondContact NE2-OH 3.36Å; W314-Y317 HydrophobicContact CB-CD1 4.24Å; W314-Y317 HydrophobicContact CB-CG 4.37Å; W314-Y317 PolarHBondContact O-N 2.79Å; P315-Y317 PolarHBondContact O-N 3.42Å; Y317-V320 HydrophobicContact CE1-CG2 4.04Å; Y317-K336 HydrophobicContact CD2-CB 4.4Å; Y317-K336 HydrophobicContact CD2-CG 3.56Å; Y317-K336 HydrophobicContact CE2-CG 4.09Å
318	G	95.3	Very high	96.8	Very high	35 Å²	35	28.8 Å²	28.8	36%	0.361	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	106.1	-149.9	-172.9	0	0	0	0	0	110.9	W314	W314-G318 WeakPolarHBondContact CB-O 2.99Å; W314-G318 PolarHBondContact N-O 2.84Å; W314-G318 PolarHBondContact O-N 3.25Å
319	L	95.3	Very high	96.8	Very high	85 Å²	85	29.7 Å²	29.7	45%	0.445	19%	0.186	S	C	.	.			trans	-90.8	142.5	176.7	-57.3	174.8	0	0	0	110.7	N309 N321	N309-L319 HydrophobicContact CB-CD2 3.96Å; N309-L319 WeakPolarHBondContact OD1-CA 3.14Å; L319-N321 WeakPolarHBondContact CB-OD1 3.3Å
320	V	96.1	Very high	96.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.205	C	C	.	.			trans	-82.5	112.4	162.7	173.4	0	0	0	0	106.7	A50 V77 E79 I308 N309 Y317 F324	A50-V320 HydrophobicContact CB-CG2 3.47Å; A50-V320 VanDerWaalsContact CB-CG2 3.47Å; V77-V320 HydrophobicContact CG1-CG2 4.32Å; E79-V320 HydrophobicContact CB-CG1 4.1Å; E79-V320 HydrophobicContact CB-CG2 4.35Å; E79-V320 HydrophobicContact CG-CG1 3.95Å; I308-V320 HydrophobicContact CG2-CB 4.16Å; I308-V320 HydrophobicContact CG2-CG1 4.1Å; N309-V320 PolarHBondContact ND2-O 2.93Å; N309-V320 PolarHBondContact OD1-N 2.68Å; Y317-V320 HydrophobicContact CE1-CG2 4.04Å; V320-F324 HydrophobicContact CG1-CB 3.97Å; V320-F324 HydrophobicContact CG1-CD1 4.25Å; V320-F324 HydrophobicContact CG1-CG 4.4Å
321	N	94.3	Very high	96.8	Very high	27 Å²	27	32.3 Å²	32.3	14%	0.144	21%	0.205	C	C	.	.			trans	-113.9	-17	-175.7	-67.2	-29.2	0	0	0	112.5	E79 A289 L319	E79-N321 PolarHBondContact OE1-N 3.1Å; A289-N321 VanDerWaalsContact CB-O 3.25Å; A289-N321 WeakPolarHBondContact CB-O 3.37Å; L319-N321 WeakPolarHBondContact CB-OD1 3.3Å
322	Q	96.3	Very high	96.8	Very high	30 Å²	30	30.3 Å²	30.3	14%	0.14	20%	0.196	C	C	.	.	S	Bend	trans	-98.6	174.7	176.7	-57.7	-60.6	-52.4	0	0	111	E79 P81 L169 M170	E79-Q322 HydrophobicContact CG-CB 3.84Å; E79-Q322 PolarHBondContact OE1-N 3.25Å; P81-Q322 HydrophobicContact CB-CB 4.37Å; P81-Q322 HydrophobicContact CB-CG 4.12Å; L169-Q322 HydrophobicContact CB-CG 4.23Å; M170-Q322 HydrophobicContact SD-CG 4.05Å
323	D	97.9	Very high	96.9	Very high	19 Å²	19	26.6 Å²	26.6	10%	0.102	16%	0.157	C	C	.	.			trans	-49.8	149	169.5	-66.2	-3	0	0	0	110.2	T80 I206 G287 K288 A289	T80-D323 CarbonylContact C-O 3.6Å; T80-D323 WeakPolarHBondContact CA-O 3.46Å; T80-D323 PolarHBondContact N-O 3.11Å; T80-D323 VanDerWaalsContact OG1-C 3.32Å; T80-D323 PolarHBondContact OG1-O 2.85Å; I206-D323 HydrophobicContact CG2-CB 4.08Å; G287-D323 CarbonylContact O-C 3.5Å; G287-D323 VanDerWaalsContact O-CA 3.27Å; G287-D323 WeakPolarHBondContact O-CA 3.36Å; K288-D323 WeakPolarHBondContact CA-OD1 3.45Å; A289-D323 PolarHBondContact N-OD1 2.99Å
324	F	98.2	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.1	-179.1	69.5	-90.7	0	0	0	112.3	V77 L78 T80 I286 G287 N296 I308 V320 M326	V77-F324 HydrophobicContact CG1-CB 4.09Å; V77-F324 HydrophobicContact CG1-CD2 3.97Å; V77-F324 HydrophobicContact CG1-CG 4.19Å; L78-F324 CarbonylContact O-C 3.6Å; L78-F324 WeakPolarHBondContact O-CA 3.48Å; L78-F324 WeakPolarHBondContact O-CB 3.27Å; T80-F324 WeakPolarHBondContact OG1-CA 3.36Å; I286-F324 CarbonylContact C-O 3.59Å; I286-F324 WeakPolarHBondContact CA-O 3.39Å; G287-F324 PolarHBondContact N-O 2.76Å; G287-F324 PolarHBondContact O-N 3.26Å; N296-F324 HydrophobicContact CB-CE1 4.03Å; I308-F324 HydrophobicContact CB-CD1 4.44Å; I308-F324 HydrophobicContact CB-CE1 3.79Å; I308-F324 HydrophobicContact CB-CE2 4.24Å; I308-F324 HydrophobicContact CB-CZ 3.68Å; I308-F324 HydrophobicContact CD1-CE2 4.16Å; I308-F324 HydrophobicContact CD1-CZ 4.23Å; I308-F324 HydrophobicContact CG1-CD2 4.25Å; I308-F324 HydrophobicContact CG1-CE1 4.21Å; I308-F324 HydrophobicContact CG1-CE2 3.76Å; I308-F324 HydrophobicContact CG1-CZ 3.73Å; I308-F324 HydrophobicContact CG2-CD1 3.85Å; I308-F324 HydrophobicContact CG2-CE1 3.61Å; I308-F324 HydrophobicContact CG2-CG 4.41Å; I308-F324 HydrophobicContact CG2-CZ 4.02Å; V320-F324 HydrophobicContact CG1-CB 3.97Å; V320-F324 HydrophobicContact CG1-CD1 4.25Å; V320-F324 HydrophobicContact CG1-CG 4.4Å; F324-M326 HydrophobicContact CE2-CB 4.5Å
325	V	98.3	Very high	96.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.4	169.6	-177.5	0	0	0	0	109	L78 T80 I206 I283 I286 V327 L341	L78-V325 PolarHBondContact N-O 3.37Å; L78-V325 PolarHBondContact O-N 3.38Å; T80-V325 HydrophobicContact CG2-CG2 4.1Å; I206-V325 HydrophobicContact CB-CG2 4.49Å; I206-V325 HydrophobicContact CD1-CG2 4.13Å; I206-V325 HydrophobicContact CG1-CG2 3.42Å; I206-V325 VanDerWaalsContact CG1-CG2 3.42Å; I206-V325 HydrophobicContact CG2-CG2 4.36Å; I283-V325 HydrophobicContact CB-CG1 4.38Å; I283-V325 HydrophobicContact CD1-CG1 4.08Å; I283-V325 HydrophobicContact CG1-CG1 3.81Å; I283-V325 HydrophobicContact CG2-CG1 3.88Å; I286-V325 HydrophobicContact CG1-CG2 4.46Å; V325-V327 HydrophobicContact CG1-CG1 3.76Å; V325-L341 HydrophobicContact CG2-CD1 4.45Å
326	M	98.6	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	113.6	169.8	-176.2	-174.5	-70.7	0	0	108.9	I55 V75 Y284 R285 I308 F324 L359 I362	I55-M326 HydrophobicContact CG2-CE 4.06Å; I55-M326 HydrophobicContact CG2-SD 3.69Å; V75-M326 HydrophobicContact CB-CG 3.57Å; V75-M326 HydrophobicContact CB-SD 4.03Å; V75-M326 HydrophobicContact CG1-CG 3.9Å; V75-M326 HydrophobicContact CG1-SD 3.96Å; V75-M326 HydrophobicContact CG2-CE 4.24Å; V75-M326 HydrophobicContact CG2-CG 3.76Å; V75-M326 HydrophobicContact CG2-SD 3.77Å; Y284-M326 PolarHBondContact N-O 2.86Å; R285-M326 HydrophobicContact CB-CB 4.15Å; R285-M326 PolarHBondContact O-N 2.88Å; I308-M326 HydrophobicContact CD1-CE 3.72Å; F324-M326 HydrophobicContact CE2-CB 4.5Å; M326-L359 HydrophobicContact SD-CD1 4.05Å; M326-I362 HydrophobicContact CE-CD1 3.86Å; M326-I362 HydrophobicContact CE-CG1 4.21Å; M326-I362 HydrophobicContact CE-CG2 4.09Å
327	V	98.4	Very high	97	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	141	178.5	-60.9	0	0	0	0	111.4	V75 T76 L78 I216 K282 V325 G329 C331	V75-V327 CarbonylContact C-O 3.57Å; V75-V327 WeakPolarHBondContact CA-O 3.19Å; T76-V327 PolarHBondContact N-O 3Å; T76-V327 PolarHBondContact O-N 2.95Å; L78-V327 HydrophobicContact CD1-CG1 4.24Å; L78-V327 HydrophobicContact CD1-CG2 4.26Å; L78-V327 HydrophobicContact CG-CG2 4.46Å; I216-V327 HydrophobicContact CD1-CG1 4Å; K282-V327 WeakPolarHBondContact O-CA 3.17Å; V325-V327 HydrophobicContact CG1-CG1 3.76Å; V327-G329 PolarHBondContact O-N 2.82Å; V327-C331 HydrophobicContact CG2-CB 4.31Å
328	K	98.3	Very high	97.1	Very high	63 Å²	63	29.9 Å²	29.9	27%	0.274	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	129.4	175.7	-173.6	-174.4	-172.8	127.4	0	111.7	E73 K282 Y284	E73-K328 WeakPolarHBondContact OE1-CE 3.22Å; E73-K328 IonicContact OE1-NZ 3.28Å; E73-K328 PolarHBondContact OE1-NZ 3.09Å; E73-K328 IonicContact OE2-NZ 2.64Å; K282-K328 HydrophobicContact CB-CB 4.24Å; K282-K328 PolarHBondContact O-N 2.85Å; Y284-K328 HydrophobicContact CD1-CB 4.4Å; Y284-K328 HydrophobicContact CE1-CB 3.85Å; Y284-K328 HydrophobicContact CE1-CD 4.26Å; Y284-K328 HydrophobicContact CE1-CG 4.22Å; Y284-K328 HydrophobicContact CE2-CB 4.35Å; Y284-K328 HydrophobicContact CE2-CG 4.3Å; Y284-K328 VanDerWaalsContact OH-CD 3.22Å; Y284-K328 WeakPolarHBondContact OH-CD 3.44Å; Y284-K328 WeakPolarHBondContact OH-CE 3.24Å; Y284-K328 WeakPolarHBondContact OH-CG 3.33Å; Y284-K328 PolarHBondContact OH-NZ 3.26Å
329	G	98.1	Very high	97.2	Very high	21 Å²	21	28.2 Å²	28.2	22%	0.216	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	69.5	-159.5	172.9	0	0	0	0	0	113.6	M52 A74 T76 V327	M52-G329 WeakPolarHBondContact CE-O 3.45Å; A74-G329 WeakPolarHBondContact O-CA 3.5Å; A74-G329 PolarHBondContact O-N 2.95Å; T76-G329 PolarHBondContact N-O 2.57Å; T76-G329 PolarHBondContact OG1-O 2.98Å; V327-G329 PolarHBondContact O-N 2.82Å
330	C	97.7	Very high	97.4	Very high	71 Å²	71	24.2 Å²	24.2	48%	0.48	13%	0.129	S	C	.	.			trans	-71.8	150	-179.6	63.4	0	0	0	0	111.5	M52 K281	M52-C330 VanDerWaalsContact CE-CA 3.45Å; M52-C330 HydrophobicContact CE-CB 4.04Å; M52-C330 VanDerWaalsContact CE-N 3.34Å; K281-C330 WeakPolarHBondContact CE-O 3.19Å; K281-C330 PolarHBondContact NZ-O 3.06Å
331	C	95.8	Very high	97.5	Very high	6 Å²	6	24.2 Å²	24.2	4%	0.041	13%	0.129	C	C	.	.			trans	-117	154.4	166.7	-171.3	0	0	0	0	110.4	K49 T76 L78 V327	K49-C331 HydrophobicContact CD-CB 4.45Å; K49-C331 PolarHBondContact NZ-O 3.14Å; T76-C331 HydrophobicContact CG2-CB 3.81Å; T76-C331 PolarHBondContact OG1-N 2.74Å; L78-C331 HydrophobicContact CD2-CB 4.44Å; V327-C331 HydrophobicContact CG2-CB 4.31Å
332	I	97.4	Very high	97.7	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.01	12%	0.123	C	C	.	.	S	Bend	trans	-58	143.3	-178.6	-171.3	168.4	0	0	0	113.4	G220 T222 R276 E278 I339	G220-I332 VanDerWaalsContact C-CD1 3.48Å; G220-I332 WeakPolarHBondContact O-CD1 3.5Å; T222-I332 HydrophobicContact CG2-CD1 3.81Å; T222-I332 HydrophobicContact CG2-CG1 3.82Å; R276-I332 HydrophobicContact CB-CD1 3.56Å; R276-I332 HydrophobicContact CG-CD1 4.26Å; E278-I332 PolarHBondContact OE1-N 2.99Å; I332-I339 HydrophobicContact CG2-CD1 3.77Å; I332-I339 HydrophobicContact CG2-CG2 4.41Å; I332-I339 WeakPolarHBondContact O-CD1 3.12Å
333	G	97.6	Very high	97.8	Very high	14 Å²	14	23.8 Å²	23.8	14%	0.144	13%	0.125	C	C	.	.	S	Bend	trans	82.3	172	172.3	0	0	0	0	0	115	K49 V221	K49-G333 PolarHBondContact NZ-O 3.41Å; V221-G333 WeakPolarHBondContact O-CA 3.42Å
334	P	97.6	Very high	97.8	Very high	30 Å²	30	23.7 Å²	23.7	20%	0.195	13%	0.126	C	C	.	.			trans	-77.8	174.6	177	34.4	-36.1	0	0	0	111.6	K223 R337	K223-P334 HydrophobicContact CG-CB 4.48Å; P334-R337 HydrophobicContact CG-CB 4.33Å; P334-R337 VanDerWaalsContact CG-NH2 3.31Å; P334-R337 WeakPolarHBondContact O-CB 3.43Å; P334-R337 PolarHBondContact O-N 3.07Å
335	K	95.7	Very high	97.8	Very high	79 Å²	79	27.4 Å²	27.4	34%	0.343	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	154.8	162.3	57.9	-172.2	163.7	-163.4	0	112.4	K49 A50 P315 H316 R337	K49-K335 CarbonylContact O-C 3.42Å; K49-K335 VanDerWaalsContact O-CA 3.27Å; K49-K335 WeakPolarHBondContact O-CA 3.4Å; A50-K335 WeakPolarHBondContact O-CB 3.43Å; P315-K335 WeakPolarHBondContact O-CD 3.2Å; P315-K335 WeakPolarHBondContact O-CE 3.23Å; P315-K335 PolarHBondContact O-NZ 2.92Å; H316-K335 HydrophobicContact CB-CD 3.97Å; H316-K335 PolarHBondContact CD2-NZ 3.25Å; K335-R337 PolarHBondContact O-N 2.92Å; K335-R337 VanDerWaalsContact O-N 3.13Å
336	K	96.8	Very high	97.6	Very high	102 Å²	102	31.8 Å²	31.8	44%	0.443	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	1.8	-172.4	-60.6	175.2	155.9	153.5	0	114.9	K49 H316 Y317	K49-K336 PolarHBondContact O-N 3.02Å; H316-K336 WeakPolarHBondContact O-CE 3.46Å; H316-K336 PolarHBondContact O-NZ 2.64Å; Y317-K336 HydrophobicContact CD2-CB 4.4Å; Y317-K336 HydrophobicContact CD2-CG 3.56Å; Y317-K336 HydrophobicContact CE2-CG 4.09Å
337	R	97.4	Very high	97.4	Very high	43 Å²	43	38.1 Å²	38.1	16%	0.162	21%	0.207	C	C	.	.			trans	-75.2	134.7	178.9	-165.4	61.5	29.7	148.8	-6.1	109.9	H24 Y48 K49 P334 K335 I339	H24-R337 PolarHBondContact CE1-NH1 2.63Å; H24-R337 WeakPolarHBondContact NE2-CD 3.11Å; Y48-R337 WeakPolarHBondContact CA-O 3.29Å; K49-R337 PolarHBondContact N-O 2.73Å; P334-R337 HydrophobicContact CG-CB 4.33Å; P334-R337 VanDerWaalsContact CG-NH2 3.31Å; P334-R337 WeakPolarHBondContact O-CB 3.43Å; P334-R337 PolarHBondContact O-N 3.07Å; K335-R337 PolarHBondContact O-N 2.92Å; K335-R337 VanDerWaalsContact O-N 3.13Å; R337-I339 HydrophobicContact CB-CD1 4.2Å; R337-I339 HydrophobicContact CG-CD1 4.04Å
338	V	98	Very high	97.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.8	167.3	66.7	0	0	0	0	110.2	R25 I46 Y48 H178	R25-V338 HydrophobicContact CB-CG1 3.84Å; R25-V338 HydrophobicContact CG-CG1 3.89Å; R25-V338 HydrophobicContact CG-CG2 4.07Å; I46-V338 HydrophobicContact CG2-CG2 3.19Å; Y48-V338 HydrophobicContact CD1-CB 4.16Å; Y48-V338 HydrophobicContact CE1-CB 3.82Å; Y48-V338 HydrophobicContact CE1-CG2 3.93Å; H178-V338 HydrophobicContact CB-CG2 4.45Å
339	I	98.5	Very high	97.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.2	178.5	-50.2	-58.5	0	0	0	107.5	I46 G47 K49 L78 C218 I332 R337 L341	I46-I339 WeakPolarHBondContact CA-O 2.74Å; G47-I339 PolarHBondContact N-O 2.97Å; G47-I339 PolarHBondContact O-N 3.42Å; K49-I339 HydrophobicContact CB-CG1 4.23Å; L78-I339 HydrophobicContact CD2-CG1 4.25Å; C218-I339 HydrophobicContact CB-CG2 4.19Å; I332-I339 HydrophobicContact CG2-CD1 3.77Å; I332-I339 HydrophobicContact CG2-CG2 4.41Å; I332-I339 WeakPolarHBondContact O-CD1 3.12Å; R337-I339 HydrophobicContact CB-CD1 4.2Å; R337-I339 HydrophobicContact CG-CD1 4.04Å; I339-L341 HydrophobicContact CG2-CD2 3.99Å
340	T	98.7	Very high	96.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	115.2	172.2	-62.9	0	0	0	0	108.3	R25 G26 V28 F45 M180 I219	R25-T340 WeakPolarHBondContact CD-OG1 3.34Å; R25-T340 WeakPolarHBondContact CG-OG1 3.43Å; G26-T340 PolarHBondContact O-OG1 3.27Å; V28-T340 HydrophobicContact CG2-CG2 3.49Å; V28-T340 VanDerWaalsContact CG2-CG2 3.49Å; F45-T340 CarbonylContact O-C 3.37Å; F45-T340 WeakPolarHBondContact O-CA 3.45Å; M180-T340 HydrophobicContact CE-CG2 3.74Å; M180-T340 HydrophobicContact SD-CG2 3.96Å; I219-T340 WeakPolarHBondContact CA-O 3.2Å; I219-T340 WeakPolarHBondContact CB-O 3.49Å; I219-T340 PolarHBondContact N-O 3.38Å; I219-T340 PolarHBondContact O-N 2.95Å
341	L	98.6	Very high	96.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.6	172.5	-54.3	-177.9	0	0	0	108.1	A44 F45 L78 T80 I206 F210 I216 D217 C218 V325 I339	A44-L341 CarbonylContact C-O 3.52Å; A44-L341 WeakPolarHBondContact CA-O 3.14Å; A44-L341 WeakPolarHBondContact CB-O 3.45Å; F45-L341 PolarHBondContact N-O 3.32Å; F45-L341 PolarHBondContact O-N 3Å; L78-L341 HydrophobicContact CD1-CD1 4.35Å; L78-L341 HydrophobicContact CD1-CD2 3.69Å; T80-L341 HydrophobicContact CG2-CD1 4.47Å; I206-L341 HydrophobicContact CD1-CD1 4.21Å; F210-L341 HydrophobicContact CE2-CB 3.8Å; F210-L341 HydrophobicContact CZ-CB 3.84Å; I216-L341 HydrophobicContact CD1-CB 4.24Å; I216-L341 HydrophobicContact CD1-CD1 4.11Å; I216-L341 HydrophobicContact CD1-CD2 3.8Å; I216-L341 HydrophobicContact CD1-CG 4.25Å; D217-L341 WeakPolarHBondContact O-CA 3.44Å; C218-L341 VanDerWaalsContact SG-CD2 3.57Å; V325-L341 HydrophobicContact CG2-CD1 4.45Å; I339-L341 HydrophobicContact CG2-CD2 3.99Å
342	R	98.6	Very high	96.4	Very high	9 Å²	9	57.2 Å²	57.2	3%	0.034	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.4	176.4	-175.2	-165.7	59.1	-165.8	-4.4	108.2	V28 S30 T43 D217 I219 L345	V28-R342 HydrophobicContact CG1-CG 4.34Å; S30-R342 VanDerWaalsContact O-CD 3.27Å; S30-R342 WeakPolarHBondContact O-CD 3.5Å; S30-R342 PolarHBondContact O-NH1 3.28Å; T43-R342 CarbonylContact O-C 3.56Å; T43-R342 WeakPolarHBondContact O-CA 3.2Å; D217-R342 HydrophobicContact CB-CB 4.32Å; D217-R342 PolarHBondContact N-O 2.8Å; D217-R342 PolarHBondContact O-N 2.74Å; D217-R342 IonicContact OD2-CZ 2.75Å; D217-R342 VanDerWaalsContact OD2-CZ 3.28Å; D217-R342 IonicContact OD2-NE 3.99Å; D217-R342 PolarHBondContact OD2-NE 2.64Å; D217-R342 IonicContact OD2-NH2 3.53Å; D217-R342 PolarHBondContact OD2-NH2 3.24Å; I219-R342 HydrophobicContact CD1-CB 4.03Å; R342-L345 VanDerWaalsContact CZ-CG 3.41Å; R342-L345 VanDerWaalsContact NH2-CD1 3.31Å; R342-L345 VanDerWaalsContact NH2-CG 3.31Å
343	K	98.3	Very high	96.3	Very high	39 Å²	39	57.5 Å²	57.5	17%	0.17	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	148	166	-73.4	-168.5	172.9	-76.9	0	109.6	P32 T43 V209 F210 E214	P32-K343 HydrophobicContact CG-CB 3.87Å; T43-K343 PolarHBondContact O-N 2.97Å; V209-K343 WeakPolarHBondContact O-CE 3.39Å; V209-K343 PolarHBondContact O-NZ 2.87Å; F210-K343 HydrophobicContact CD1-CG 4.02Å; F210-K343 HydrophobicContact CE1-CB 4.3Å; F210-K343 HydrophobicContact CE1-CG 3.59Å; F210-K343 HydrophobicContact CZ-CG 4.43Å; E214-K343 VanDerWaalsContact CD-NZ 3.32Å; E214-K343 WeakPolarHBondContact OE1-CG 3.3Å; E214-K343 IonicContact OE1-NZ 2.93Å; E214-K343 PolarHBondContact OE1-NZ 2.66Å; E214-K343 IonicContact OE2-NZ 3.9Å; E214-K343 PolarHBondContact OE2-NZ 3.22Å
344	S	97.6	Very high	96.1	Very high	18 Å²	18	62.2 Å²	62.2	13%	0.126	31%	0.311	C	S	.	.			trans	-58	143.6	-176.4	-172.7	0	0	0	0	111.4	L346 H348	S344-L346 VanDerWaalsContact C-N 3.26Å; S344-L346 PolarHBondContact OG-N 2.6Å; S344-L346 PolarHBondContact OG-O 3.18Å; S344-L346 VanDerWaalsContact OG-O 3.11Å; S344-H348 VanDerWaalsContact CB-NE2 3.3Å; S344-H348 WeakPolarHBondContact CB-NE2 3.27Å; S344-H348 PolarHBondContact OG-NE2 3.17Å
345	L	97.2	Very high	96	Very high	77 Å²	77	61.3 Å²	61.3	40%	0.403	30%	0.303	S	S	.	.	S	Bend	trans	-79.3	-15.1	166.2	-62.3	-177.1	0	0	0	112.5	F31 P32 D217 R342	F31-L345 VanDerWaalsContact C-CD2 3.41Å; F31-L345 WeakPolarHBondContact O-CD2 3.49Å; P32-L345 HydrophobicContact CG-CD2 4.36Å; D217-L345 PolarHBondContact OD2-N 3.08Å; R342-L345 VanDerWaalsContact CZ-CG 3.41Å; R342-L345 VanDerWaalsContact NH2-CD1 3.31Å; R342-L345 VanDerWaalsContact NH2-CG 3.31Å
346	L	95.4	Very high	96	Very high	92 Å²	92	66 Å²	66	48%	0.482	32%	0.324	S	S	.	.	S	Bend	trans	-100.6	134	-177.2	-57.8	177.7	0	0	0	109	I279 S344 H348	I279-L346 HydrophobicContact CD1-CD1 4.13Å; S344-L346 VanDerWaalsContact C-N 3.26Å; S344-L346 PolarHBondContact OG-N 2.6Å; S344-L346 PolarHBondContact OG-O 3.18Å; S344-L346 VanDerWaalsContact OG-O 3.11Å; L346-H348 PolarHBondContact O-CD2 3.37Å; L346-H348 PolarHBondContact O-N 3.44Å; L346-H348 PolarHBondContact O-NE2 2.73Å
347	T	93.7	Very high	96	Very high	133 Å²	133	61.4 Å²	61.4	82%	0.816	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-70.9	123.4	164.5	-53.3	0	0	0	0	108.4
348	H	94.8	Very high	95.8	Very high	47 Å²	47	63.7 Å²	63.7	22%	0.218	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-97.5	116.4	-176.5	-70.7	-58.5	0	0	0	111.4	M215 N280 S344 L346 A353	M215-H348 WeakPolarHBondContact CB-CD2 3.49Å; M215-H348 WeakPolarHBondContact CB-NE2 3.27Å; N280-H348 PolarHBondContact OD1-CE1 2.84Å; N280-H348 PolarHBondContact OD1-NE2 2.89Å; S344-H348 VanDerWaalsContact CB-NE2 3.3Å; S344-H348 WeakPolarHBondContact CB-NE2 3.27Å; S344-H348 PolarHBondContact OG-NE2 3.17Å; L346-H348 PolarHBondContact O-CD2 3.37Å; L346-H348 PolarHBondContact O-N 3.44Å; L346-H348 PolarHBondContact O-NE2 2.73Å; H348-A353 HydrophobicContact CB-CB 3.72Å
349	T	94.7	Very high	95.7	Very high	113 Å²	113	64.1 Å²	64.1	69%	0.693	32%	0.319	S	S	*	.			trans	-116.2	-10.6	176.9	54	0	0	0	0	113
350	K	93.6	Very high	95.7	Very high	157 Å²	157	65.5 Å²	65.5	68%	0.683	33%	0.325	S	S	*	.	S	Bend	trans	-69.4	136.6	-179.7	-65	-171.4	177.5	-172.6	0	110.2	S352 A353 L354	K350-S352 VanDerWaalsContact C-N 3.27Å; K350-S352 PolarHBondContact O-N 2.7Å; K350-S352 VanDerWaalsContact O-N 3.17Å; K350-A353 WeakPolarHBondContact O-CA 3.35Å; K350-A353 WeakPolarHBondContact O-CB 3.03Å; K350-A353 PolarHBondContact O-N 3.14Å; K350-L354 PolarHBondContact O-N 3.2Å; K350-L354 VanDerWaalsContact O-N 3.16Å
351	R	92.3	Very high	95.6	Very high	195 Å²	195	67.9 Å²	67.9	74%	0.736	34%	0.336	S	S	*	.	H	α-helix	trans	-50	-43.1	177.5	-68.8	-174.4	178.9	177.7	-1.1	113.2	A353 L354 E355	R351-A353 PolarHBondContact O-N 3.38Å; R351-L354 CarbonylContact O-C 3.52Å; R351-L354 PolarHBondContact O-N 3.43Å; R351-L354 VanDerWaalsContact O-N 3.08Å; R351-E355 WeakPolarHBondContact O-CB 3.22Å; R351-E355 PolarHBondContact O-N 3.49Å
352	S	92.3	Very high	95.6	Very high	51 Å²	51	67.9 Å²	67.9	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-62.5	-27.8	177.3	57.6	0	0	0	0	114.3	K282 K350	K282-S352 PolarHBondContact NZ-O 3.23Å; K350-S352 VanDerWaalsContact C-N 3.27Å; K350-S352 PolarHBondContact O-N 2.7Å; K350-S352 VanDerWaalsContact O-N 3.17Å
353	A	94.3	Very high	95.6	Very high	7 Å²	7	68 Å²	68	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-80.2	-31.2	175.1	0	0	0	0	0	112.2	M215 K282 H348 K350 R351	M215-A353 HydrophobicContact CE-CB 3.95Å; M215-A353 HydrophobicContact CG-CB 3.87Å; K282-A353 VanDerWaalsContact NZ-C 3.29Å; K282-A353 PolarHBondContact NZ-O 3.13Å; H348-A353 HydrophobicContact CB-CB 3.72Å; K350-A353 WeakPolarHBondContact O-CA 3.35Å; K350-A353 WeakPolarHBondContact O-CB 3.03Å; K350-A353 PolarHBondContact O-N 3.14Å; R351-A353 PolarHBondContact O-N 3.38Å
354	L	94.8	Very high	95.5	Very high	114 Å²	114	66.1 Å²	66.1	60%	0.597	33%	0.329	S	S	*	.	H	α-helix	trans	-90.6	-10.1	178.5	-59.9	176.8	0	0	0	114.1	K350 R351 K356	K350-L354 PolarHBondContact O-N 3.2Å; K350-L354 VanDerWaalsContact O-N 3.16Å; R351-L354 CarbonylContact O-C 3.52Å; R351-L354 PolarHBondContact O-N 3.43Å; R351-L354 VanDerWaalsContact O-N 3.08Å; L354-K356 PolarHBondContact O-N 2.98Å
355	E	94.7	Very high	95.5	Very high	10 Å²	10	65.7 Å²	65.7	5%	0.047	33%	0.326	C	S	.	.			trans	-51.7	123.7	179.1	-176.7	179.6	176.8	0	0	111.4	R57 D60 R61 K282 R351 I357	R57-E355 IonicContact CZ-OE1 2.87Å; R57-E355 IonicContact NH1-OE1 2.88Å; R57-E355 PolarHBondContact NH1-OE1 3.09Å; R57-E355 IonicContact NH2-OE1 2.62Å; R57-E355 PolarHBondContact NH2-OE1 2.99Å; R57-E355 IonicContact NH2-OE2 2.96Å; D60-E355 PolarHBondContact N-OE1 3.41Å; R61-E355 IonicContact CZ-OE2 3.83Å; R61-E355 VanDerWaalsContact CZ-OE2 3.26Å; R61-E355 IonicContact NE-OE1 2.79Å; R61-E355 IonicContact NE-OE2 2.77Å; R61-E355 PolarHBondContact NE-OE2 2.92Å; R61-E355 IonicContact NH2-OE1 3.18Å; R61-E355 IonicContact NH2-OE2 2.63Å; R61-E355 PolarHBondContact NH2-OE2 3.14Å; K282-E355 WeakPolarHBondContact CE-O 3.28Å; K282-E355 PolarHBondContact NZ-O 2.92Å; R351-E355 WeakPolarHBondContact O-CB 3.22Å; R351-E355 PolarHBondContact O-N 3.49Å; E355-I357 HydrophobicContact CG-CD1 4.13Å
356	K	95.9	Very high	95.5	Very high	177 Å²	177	63.4 Å²	63.4	77%	0.77	32%	0.316	S	S	*	.			trans	-72.3	137.4	171.2	-66.8	-176.7	179.2	-179.6	0	109.3	D213 L354	D213-K356 WeakPolarHBondContact OD2-CA 3.05Å; L354-K356 PolarHBondContact O-N 2.98Å
357	I	95.8	Very high	95.6	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.036	30%	0.304	C	S	.	.			trans	-105.2	116.6	-176.5	-54.1	-64.2	0	0	0	109.8	D213 K282 Y284 E355 L359	D213-I357 WeakPolarHBondContact OD1-CB 3.28Å; D213-I357 VanDerWaalsContact OD1-CG1 3.31Å; D213-I357 WeakPolarHBondContact OD1-CG1 3.39Å; D213-I357 PolarHBondContact OD1-N 3.14Å; D213-I357 PolarHBondContact OD2-N 3.14Å; D213-I357 VanDerWaalsContact OD2-N 3.13Å; K282-I357 HydrophobicContact CD-CD1 4.15Å; K282-I357 HydrophobicContact CD-CG1 4.1Å; K282-I357 VanDerWaalsContact CE-CG1 3.45Å; Y284-I357 HydrophobicContact CD1-CB 4.26Å; Y284-I357 HydrophobicContact CD1-CD1 4.33Å; Y284-I357 HydrophobicContact CD1-CG1 3.76Å; Y284-I357 HydrophobicContact CD1-CG2 3.93Å; Y284-I357 HydrophobicContact CD2-CG2 4.2Å; Y284-I357 HydrophobicContact CE1-CD1 3.88Å; Y284-I357 HydrophobicContact CE1-CG1 3.82Å; Y284-I357 HydrophobicContact CE1-CG2 4.31Å; Y284-I357 HydrophobicContact CG-CG2 3.87Å; E355-I357 HydrophobicContact CG-CD1 4.13Å; I357-L359 HydrophobicContact CG2-CD2 3.82Å; I357-L359 HydrophobicContact CG2-CG 4.45Å
358	E	93.7	Very high	95.7	Very high	90 Å²	90	62.6 Å²	62.6	42%	0.421	30%	0.298	S	S	.	.			trans	-108.2	119.2	172.8	-172.2	173.9	-167.8	0	0	109.3	R57 Y301	R57-E358 WeakPolarHBondContact CB-O 3.26Å; Y301-E358 HydrophobicContact CE2-CG 4.08Å; Y301-E358 WeakPolarHBondContact CE2-OE1 3.46Å; Y301-E358 PolarHBondContact OH-OE1 2.66Å
359	L	96.8	Very high	95.7	Very high	11 Å²	11	63.3 Å²	63.3	6%	0.058	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.5	-178.5	-60	-177.8	0	0	0	109.4	I55 R57 Y284 R285 T299 M326 I357 I362	I55-L359 HydrophobicContact CB-CD2 4.28Å; I55-L359 HydrophobicContact CD1-CD2 3.44Å; I55-L359 VanDerWaalsContact CD1-CD2 3.44Å; I55-L359 HydrophobicContact CG1-CD2 4.27Å; I55-L359 HydrophobicContact CG2-CD2 4.45Å; R57-L359 HydrophobicContact CB-CD2 4.36Å; Y284-L359 HydrophobicContact CD2-CD2 4.28Å; R285-L359 HydrophobicContact CB-CD1 4.07Å; T299-L359 VanDerWaalsContact CB-O 3.25Å; T299-L359 WeakPolarHBondContact CB-O 3.47Å; T299-L359 HydrophobicContact CG2-CB 3.68Å; T299-L359 VanDerWaalsContact CG2-O 3.28Å; T299-L359 WeakPolarHBondContact CG2-O 3.24Å; M326-L359 HydrophobicContact SD-CD1 4.05Å; I357-L359 HydrophobicContact CG2-CD2 3.82Å; I357-L359 HydrophobicContact CG2-CG 4.45Å; L359-I362 HydrophobicContact CD1-CD1 4.02Å; L359-I362 HydrophobicContact CD1-CG1 4.29Å
360	K	97.2	Very high	95.8	Very high	29 Å²	29	66.9 Å²	66.9	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-28.5	174.9	-65.8	-164.4	170.6	178.6	0	113.5	V56 E58 E70 T299 Y301	V56-K360 HydrophobicContact CB-CB 4.43Å; V56-K360 HydrophobicContact CG1-CB 4.32Å; V56-K360 PolarHBondContact O-N 3.47Å; E58-K360 WeakPolarHBondContact OE2-CE 3.13Å; E58-K360 IonicContact OE2-NZ 2.57Å; E58-K360 PolarHBondContact OE2-NZ 3.03Å; E70-K360 HydrophobicContact CG-CD 4.07Å; E70-K360 WeakPolarHBondContact OE1-CD 3.31Å; E70-K360 IonicContact OE1-NZ 3.72Å; E70-K360 PolarHBondContact OE1-NZ 3.19Å; T299-K360 VanDerWaalsContact OG1-C 3.26Å; T299-K360 PolarHBondContact OG1-O 3.21Å; Y301-K360 HydrophobicContact CD2-CB 4.14Å; Y301-K360 HydrophobicContact CD2-CD 4.44Å; Y301-K360 HydrophobicContact CD2-CG 3.64Å; Y301-K360 HydrophobicContact CE2-CG 3.88Å; Y301-K360 HydrophobicContact CG-CB 4.31Å; Y301-K360 HydrophobicContact CG-CD 4.48Å; Y301-K360 HydrophobicContact CG-CG 4.03Å
361	F	97.5	Very high	95.8	Very high	50 Å²	50	60.8 Å²	60.8	22%	0.219	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	146.3	179.6	176.9	-106	0	0	0	111.4	I55 V56 D302 D363 Q374	I55-F361 CarbonylContact C-O 3.28Å; I55-F361 WeakPolarHBondContact CA-O 3.34Å; I55-F361 WeakPolarHBondContact CB-O 3.47Å; V56-F361 HydrophobicContact CB-CB 3.86Å; V56-F361 HydrophobicContact CG2-CB 3.96Å; V56-F361 HydrophobicContact CG2-CD1 4.07Å; V56-F361 HydrophobicContact CG2-CG 4.46Å; V56-F361 PolarHBondContact N-O 3.06Å; V56-F361 PolarHBondContact O-N 3.48Å; D302-F361 HydrophobicContact CB-CD2 4.49Å; D302-F361 WeakPolarHBondContact OD2-CD2 3.32Å; F361-D363 HydrophobicContact CE1-CB 3.78Å; F361-D363 HydrophobicContact CZ-CB 4.45Å; F361-Q374 HydrophobicContact CE2-CG 4.1Å; F361-Q374 VanDerWaalsContact CZ-CD 3.41Å; F361-Q374 HydrophobicContact CZ-CG 3.92Å
362	I	98	Very high	96	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123	171.3	-58.1	172.1	0	0	0	108.2	T53 I55 R285 T299 K306 I308 M326 L359 T364	T53-I362 HydrophobicContact CG2-CG2 4.36Å; I55-I362 HydrophobicContact CG2-CB 4.47Å; I55-I362 HydrophobicContact CG2-CG1 3.99Å; I55-I362 HydrophobicContact CG2-CG2 4.45Å; R285-I362 VanDerWaalsContact NH1-CD1 3.32Å; T299-I362 HydrophobicContact CG2-CD1 4.25Å; T299-I362 HydrophobicContact CG2-CG1 4.2Å; K306-I362 WeakPolarHBondContact CE-O 3.34Å; K306-I362 PolarHBondContact NZ-O 3.21Å; I308-I362 HydrophobicContact CD1-CG2 3.68Å; M326-I362 HydrophobicContact CE-CD1 3.86Å; M326-I362 HydrophobicContact CE-CG1 4.21Å; M326-I362 HydrophobicContact CE-CG2 4.09Å; L359-I362 HydrophobicContact CD1-CD1 4.02Å; L359-I362 HydrophobicContact CD1-CG1 4.29Å; I362-T364 PolarHBondContact O-N 3.13Å
363	D	98	Very high	96.2	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.053	30%	0.298	C	S	.	.			trans	-77	108.8	-177.9	176.4	46.1	0	0	0	111.7	T53 H54 F361 S365 K367 Q374	T53-D363 PolarHBondContact OG1-O 2.78Å; H54-D363 VanDerWaalsContact CE1-CB 3.43Å; H54-D363 WeakPolarHBondContact CE1-CB 3.17Å; H54-D363 IonicContact CE1-OD1 3.42Å; H54-D363 IonicContact CE1-OD2 2.76Å; H54-D363 PolarHBondContact CE1-OD2 2.92Å; H54-D363 IonicContact ND1-OD2 2.74Å; H54-D363 PolarHBondContact ND1-OD2 3.42Å; H54-D363 IonicContact NE2-OD2 2.86Å; H54-D363 WeakPolarHBondContact O-CB 3.35Å; H54-D363 PolarHBondContact O-N 2.61Å; F361-D363 HydrophobicContact CE1-CB 3.78Å; F361-D363 HydrophobicContact CZ-CB 4.45Å; D363-S365 WeakPolarHBondContact OD1-CB 3.11Å; D363-S365 PolarHBondContact OD1-N 3.01Å; D363-S365 PolarHBondContact OD1-OG 2.89Å; D363-S365 PolarHBondContact OD2-OG 2.46Å; D363-K367 VanDerWaalsContact CG-NZ 3.28Å; D363-K367 PolarHBondContact O-NZ 3.21Å; D363-K367 VanDerWaalsContact O-NZ 3.14Å; D363-K367 IonicContact OD1-NZ 2.63Å; D363-K367 WeakPolarHBondContact OD2-CE 3.43Å; D363-K367 IonicContact OD2-NZ 2.9Å; D363-K367 PolarHBondContact OD2-NZ 3.07Å; D363-Q374 PolarHBondContact OD1-NE2 3.23Å; D363-Q374 PolarHBondContact OD1-OE1 2.8Å
364	T	97.6	Very high	96.3	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.006	30%	0.303	C	S	.	.			trans	-106.4	15.7	176.8	58	0	0	0	0	111.8	K306 T307 P310 M311 I362 Q374	K306-T364 HydrophobicContact CD-CG2 4.05Å; K306-T364 WeakPolarHBondContact CD-OG1 3.36Å; K306-T364 HydrophobicContact CG-CG2 4.22Å; T307-T364 WeakPolarHBondContact O-CG2 3.25Å; P310-T364 CarbonylContact C-O 3.48Å; P310-T364 WeakPolarHBondContact CA-O 3.28Å; M311-T364 PolarHBondContact N-O 3.05Å; I362-T364 PolarHBondContact O-N 3.13Å; T364-Q374 PolarHBondContact OG1-O 2.96Å; T364-Q374 PolarHBondContact OG1-OE1 3.33Å
365	S	97.6	Very high	96.4	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.063	28%	0.282	C	S	.	.	S	Bend	trans	-59.3	155.8	169.9	66.5	0	0	0	0	113	P310 D363 K367 F373	P310-S365 WeakPolarHBondContact CB-O 3.3Å; D363-S365 WeakPolarHBondContact OD1-CB 3.11Å; D363-S365 PolarHBondContact OD1-N 3.01Å; D363-S365 PolarHBondContact OD1-OG 2.89Å; D363-S365 PolarHBondContact OD2-OG 2.46Å; S365-K367 PolarHBondContact O-N 2.82Å; S365-K367 PolarHBondContact O-NZ 3.19Å; S365-K367 PolarHBondContact OG-NZ 2.89Å; S365-F373 VanDerWaalsContact CA-O 3.23Å; S365-F373 WeakPolarHBondContact CA-O 3.2Å
366	S	97.7	Very high	96.3	Very high	28 Å²	28	60.1 Å²	60.1	20%	0.196	31%	0.307	C	S	.	.			trans	-55.4	127.4	175.4	177.8	0	0	0	0	111.2	M311 F368 G371	M311-S366 WeakPolarHBondContact O-CA 3.43Å; S366-F368 VanDerWaalsContact C-N 3.33Å; S366-F368 PolarHBondContact OG-N 2.86Å; S366-F368 VanDerWaalsContact OG-N 3.1Å; S366-F368 PolarHBondContact OG-O 3.17Å; S366-G371 WeakPolarHBondContact O-CA 3.49Å; S366-G371 PolarHBondContact O-N 3.19Å; S366-G371 VanDerWaalsContact O-N 3.13Å
367	K	97.2	Very high	96.3	Very high	53 Å²	53	55.1 Å²	55.1	23%	0.23	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	3.8	171.7	-53	-59.2	-178.4	-90.8	0	112.3	T53 P310 P315 D363 S365	T53-K367 WeakPolarHBondContact OG1-CE 3.28Å; T53-K367 PolarHBondContact OG1-NZ 2.85Å; P310-K367 HydrophobicContact CB-CG 3.98Å; P310-K367 HydrophobicContact CG-CG 4.08Å; P315-K367 HydrophobicContact CG-CB 3.7Å; P315-K367 WeakPolarHBondContact CG-O 3.37Å; D363-K367 VanDerWaalsContact CG-NZ 3.28Å; D363-K367 PolarHBondContact O-NZ 3.21Å; D363-K367 VanDerWaalsContact O-NZ 3.14Å; D363-K367 IonicContact OD1-NZ 2.63Å; D363-K367 WeakPolarHBondContact OD2-CE 3.43Å; D363-K367 IonicContact OD2-NZ 2.9Å; D363-K367 PolarHBondContact OD2-NZ 3.07Å; S365-K367 PolarHBondContact O-N 2.82Å; S365-K367 PolarHBondContact O-NZ 3.19Å; S365-K367 PolarHBondContact OG-NZ 2.89Å
368	F	94.5	Very high	96.3	Very high	156 Å²	156	58.4 Å²	58.4	68%	0.684	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	97.1	171.4	-162.6	-92.4	0	0	0	107.8	P315 S366	P315-F368 HydrophobicContact CB-CD2 4.46Å; P315-F368 HydrophobicContact CG-CB 4.46Å; S366-F368 VanDerWaalsContact C-N 3.33Å; S366-F368 PolarHBondContact OG-N 2.86Å; S366-F368 VanDerWaalsContact OG-N 3.1Å; S366-F368 PolarHBondContact OG-O 3.17Å
369	G	95.1	Very high	96.4	Very high	62 Å²	62	58.5 Å²	58.5	64%	0.639	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-151.1	-166.2	0	0	0	0	0	112.3
370	H	96.1	Very high	96.3	Very high	188 Å²	188	64.7 Å²	64.7	87%	0.87	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	94.5	177.5	-61.1	-80.2	0	0	0	109.8	R372	H370-R372 PolarHBondContact O-N 3.16Å
371	G	94.9	Very high	96.2	Very high	29 Å²	29	67.3 Å²	67.3	30%	0.299	37%	0.367	S	S	.	.			trans	-68.2	125.6	177.5	0	0	0	0	0	112.1	S366	S366-G371 WeakPolarHBondContact O-CA 3.49Å; S366-G371 PolarHBondContact O-N 3.19Å; S366-G371 VanDerWaalsContact O-N 3.13Å
372	R	96.1	Very high	96.2	Very high	209 Å²	209	72.1 Å²	72.1	79%	0.789	39%	0.388	S	S	*	.			trans	-100.1	-25.7	177.4	-68.2	-175.3	175.6	176.4	-2.3	114.2	H370	H370-R372 PolarHBondContact O-N 3.16Å
373	F	96.9	Very high	96.1	Very high	24 Å²	24	76.4 Å²	76.4	11%	0.105	41%	0.409	C	S	.	.			trans	-111.3	146.4	-176.2	-49.4	-72.4	0	0	0	110	M311 S365 E378 K379 F382 M383	M311-F373 HydrophobicContact SD-CB 3.91Å; M311-F373 VanDerWaalsContact SD-O 3.32Å; S365-F373 VanDerWaalsContact CA-O 3.23Å; S365-F373 WeakPolarHBondContact CA-O 3.2Å; F373-E378 WeakPolarHBondContact CA-OE1 3.38Å; F373-E378 HydrophobicContact CB-CG 4.4Å; F373-E378 HydrophobicContact CD1-CG 4.08Å; F373-K379 HydrophobicContact CB-CB 3.93Å; F373-K379 HydrophobicContact CD1-CB 4.41Å; F373-K379 HydrophobicContact CD2-CB 3.62Å; F373-K379 HydrophobicContact CD2-CD 3.99Å; F373-K379 HydrophobicContact CD2-CG 3.58Å; F373-K379 HydrophobicContact CE2-CB 4.25Å; F373-K379 HydrophobicContact CE2-CD 4.38Å; F373-K379 HydrophobicContact CE2-CG 3.82Å; F373-K379 HydrophobicContact CG-CB 3.71Å; F373-K379 HydrophobicContact CG-CG 4.19Å; F373-F382 HydrophobicContact CD1-CB 4.37Å; F373-F382 HydrophobicContact CE1-CB 3.53Å; F373-F382 AromaticContact CE1-CD1 3.72Å; F373-F382 HydrophobicContact CE1-CD1 3.72Å; F373-F382 HydrophobicContact CE1-CD2 4.06Å; F373-F382 HydrophobicContact CE1-CE1 4.46Å; F373-F382 AromaticContact CE1-CG 3.48Å; F373-F382 HydrophobicContact CE1-CG 3.48Å; F373-F382 VanDerWaalsContact CE1-CG 3.48Å; F373-F382 HydrophobicContact CZ-CB 3.99Å; F373-F382 AromaticContact CZ-CD1 3.45Å; F373-F382 HydrophobicContact CZ-CD1 3.45Å; F373-F382 VanDerWaalsContact CZ-CD1 3.45Å; F373-F382 HydrophobicContact CZ-CE1 4.06Å; F373-F382 AromaticContact CZ-CG 3.75Å; F373-F382 HydrophobicContact CZ-CG 3.75Å; F373-M383 HydrophobicContact CE2-CE 3.81Å; F373-M383 HydrophobicContact CZ-CE 3.97Å
374	Q	96.2	Very high	95.9	Very high	35 Å²	35	77.6 Å²	77.6	16%	0.164	42%	0.424	C	S	.	.	S	Bend	trans	-86.6	-29.9	178.2	-60	-57.8	-40.5	0	0	112.1	F361 D363 T364 E378	F361-Q374 HydrophobicContact CE2-CG 4.1Å; F361-Q374 VanDerWaalsContact CZ-CD 3.41Å; F361-Q374 HydrophobicContact CZ-CG 3.92Å; D363-Q374 PolarHBondContact OD1-NE2 3.23Å; D363-Q374 PolarHBondContact OD1-OE1 2.8Å; T364-Q374 PolarHBondContact OG1-O 2.96Å; T364-Q374 PolarHBondContact OG1-OE1 3.33Å; Q374-E378 WeakPolarHBondContact CA-OE2 3.34Å; Q374-E378 WeakPolarHBondContact CB-OE2 3.25Å; Q374-E378 PolarHBondContact N-OE2 2.89Å
375	T	96.2	Very high	95.8	Very high	23 Å²	23	82.3 Å²	82.3	14%	0.141	45%	0.453	C	S	.	.	S	Bend	trans	-132.1	162.4	179.6	68.4	0	0	0	0	112.9	T304 K306 A377 E378 K379	T304-T375 HydrophobicContact CG2-CG2 3.43Å; T304-T375 VanDerWaalsContact CG2-CG2 3.43Å; K306-T375 HydrophobicContact CB-CG2 4.1Å; K306-T375 HydrophobicContact CD-CG2 4.48Å; T375-A377 VanDerWaalsContact C-N 3.3Å; T375-E378 PolarHBondContact N-OE2 3.22Å; T375-E378 VanDerWaalsContact OG1-CB 3.3Å; T375-E378 WeakPolarHBondContact OG1-CB 3.49Å; T375-E378 PolarHBondContact OG1-N 2.76Å; T375-E378 VanDerWaalsContact OG1-N 3.09Å; T375-K379 PolarHBondContact O-N 3.08Å
376	A	94.1	Very high	95.6	Very high	71 Å²	71	84.9 Å²	84.9	59%	0.587	47%	0.465	S	S	*	.	H	α-helix	trans	-66.4	-33.9	172.6	0	0	0	0	0	112.3	M311 K379 K380	M311-A376 HydrophobicContact CE-CB 4.34Å; A376-K379 PolarHBondContact O-N 2.69Å; A376-K380 PolarHBondContact O-N 2.92Å
377	A	94	Very high	95.5	Very high	73 Å²	73	91.6 Å²	91.6	60%	0.603	49%	0.49	S	S	*	.	H	α-helix	trans	-65.1	-48.7	177.2	0	0	0	0	0	111.3	T375 K379 K380 A381	T375-A377 VanDerWaalsContact C-N 3.3Å; A377-K379 VanDerWaalsContact C-N 3.31Å; A377-K379 PolarHBondContact O-N 3.35Å; A377-K380 PolarHBondContact O-N 2.86Å; A377-K380 VanDerWaalsContact O-N 3.14Å; A377-A381 WeakPolarHBondContact O-CB 3.15Å; A377-A381 PolarHBondContact O-N 2.79Å
378	E	95.8	Very high	95.4	Very high	76 Å²	76	95.3 Å²	95.3	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-56.7	-44.6	174.7	-175.9	-163.8	154.9	0	0	111.6	F373 Q374 T375 K380 A381 F382	F373-E378 WeakPolarHBondContact CA-OE1 3.38Å; F373-E378 HydrophobicContact CB-CG 4.4Å; F373-E378 HydrophobicContact CD1-CG 4.08Å; Q374-E378 WeakPolarHBondContact CA-OE2 3.34Å; Q374-E378 WeakPolarHBondContact CB-OE2 3.25Å; Q374-E378 PolarHBondContact N-OE2 2.89Å; T375-E378 PolarHBondContact N-OE2 3.22Å; T375-E378 VanDerWaalsContact OG1-CB 3.3Å; T375-E378 WeakPolarHBondContact OG1-CB 3.49Å; T375-E378 PolarHBondContact OG1-N 2.76Å; T375-E378 VanDerWaalsContact OG1-N 3.09Å; E378-K380 PolarHBondContact O-N 2.74Å; E378-A381 PolarHBondContact O-N 3.33Å; E378-F382 WeakPolarHBondContact O-CB 3.04Å; E378-F382 PolarHBondContact O-N 3.17Å
379	K	96.4	Very high	95.4	Very high	91 Å²	91	89.8 Å²	89.8	40%	0.396	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-43.7	175.8	-179.8	176.2	178.5	-177.2	0	112.4	M311 F373 T375 A376 A377 M383	M311-K379 HydrophobicContact CE-CB 3.99Å; M311-K379 HydrophobicContact CE-CD 3.73Å; M311-K379 HydrophobicContact CE-CG 4.49Å; F373-K379 HydrophobicContact CB-CB 3.93Å; F373-K379 HydrophobicContact CD1-CB 4.41Å; F373-K379 HydrophobicContact CD2-CB 3.62Å; F373-K379 HydrophobicContact CD2-CD 3.99Å; F373-K379 HydrophobicContact CD2-CG 3.58Å; F373-K379 HydrophobicContact CE2-CB 4.25Å; F373-K379 HydrophobicContact CE2-CD 4.38Å; F373-K379 HydrophobicContact CE2-CG 3.82Å; F373-K379 HydrophobicContact CG-CB 3.71Å; F373-K379 HydrophobicContact CG-CG 4.19Å; T375-K379 PolarHBondContact O-N 3.08Å; A376-K379 PolarHBondContact O-N 2.69Å; A377-K379 VanDerWaalsContact C-N 3.31Å; A377-K379 PolarHBondContact O-N 3.35Å; K379-M383 HydrophobicContact CG-CG 4.23Å; K379-M383 WeakPolarHBondContact O-CB 3.22Å; K379-M383 VanDerWaalsContact O-CG 3.23Å; K379-M383 WeakPolarHBondContact O-CG 3.47Å; K379-M383 PolarHBondContact O-N 3.11Å
380	K	95	Very high	95.2	Very high	142 Å²	142	91.9 Å²	91.9	62%	0.617	48%	0.48	S	S	*	.	H	α-helix	trans	-65.4	-43.9	179.9	-172.6	178.6	179.3	-177.8	0	110.4	A376 A377 E378 F382 M383 G384	A376-K380 PolarHBondContact O-N 2.92Å; A377-K380 PolarHBondContact O-N 2.86Å; A377-K380 VanDerWaalsContact O-N 3.14Å; E378-K380 PolarHBondContact O-N 2.74Å; K380-F382 PolarHBondContact O-N 2.84Å; K380-M383 PolarHBondContact O-N 2.8Å; K380-G384 PolarHBondContact O-N 3.07Å
381	A	95.7	Very high	95.1	Very high	84 Å²	84	89.1 Å²	89.1	69%	0.694	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-44.3	176.8	0	0	0	0	0	112.1	A377 E378	A377-A381 WeakPolarHBondContact O-CB 3.15Å; A377-A381 PolarHBondContact O-N 2.79Å; E378-A381 PolarHBondContact O-N 3.33Å
382	F	96.5	Very high	94.9	Very high	150 Å²	150	92 Å²	92	66%	0.658	49%	0.492	S	S	*	.	H	α-helix	trans	-67.9	-41.6	178.8	-176.5	-86.8	0	0	0	113.3	F373 E378 K380	F373-F382 HydrophobicContact CD1-CB 4.37Å; F373-F382 HydrophobicContact CE1-CB 3.53Å; F373-F382 AromaticContact CE1-CD1 3.72Å; F373-F382 HydrophobicContact CE1-CD1 3.72Å; F373-F382 HydrophobicContact CE1-CD2 4.06Å; F373-F382 HydrophobicContact CE1-CE1 4.46Å; F373-F382 AromaticContact CE1-CG 3.48Å; F373-F382 HydrophobicContact CE1-CG 3.48Å; F373-F382 VanDerWaalsContact CE1-CG 3.48Å; F373-F382 HydrophobicContact CZ-CB 3.99Å; F373-F382 AromaticContact CZ-CD1 3.45Å; F373-F382 HydrophobicContact CZ-CD1 3.45Å; F373-F382 VanDerWaalsContact CZ-CD1 3.45Å; F373-F382 HydrophobicContact CZ-CE1 4.06Å; F373-F382 AromaticContact CZ-CG 3.75Å; F373-F382 HydrophobicContact CZ-CG 3.75Å; E378-F382 WeakPolarHBondContact O-CB 3.04Å; E378-F382 PolarHBondContact O-N 3.17Å; K380-F382 PolarHBondContact O-N 2.84Å
383	M	95.9	Very high	94.1	Very high	90 Å²	90	91.6 Å²	91.6	44%	0.443	50%	0.499	S	S	.	.	H	α-helix	trans	-79.7	-18.3	-175.7	-68.2	-74.5	176.7	0	0	113.4	F373 K379 K380	F373-M383 HydrophobicContact CE2-CE 3.81Å; F373-M383 HydrophobicContact CZ-CE 3.97Å; K379-M383 HydrophobicContact CG-CG 4.23Å; K379-M383 WeakPolarHBondContact O-CB 3.22Å; K379-M383 VanDerWaalsContact O-CG 3.23Å; K379-M383 WeakPolarHBondContact O-CG 3.47Å; K379-M383 PolarHBondContact O-N 3.11Å; K380-M383 PolarHBondContact O-N 2.8Å
384	G	95	Very high	94	Very high	35 Å²	35	95 Å²	95	36%	0.361	52%	0.519	S	S	.	.			trans	65.2	-164	-172.2	0	0	0	0	0	112.9	K380 M386	K380-G384 PolarHBondContact O-N 3.07Å; G384-M386 PolarHBondContact O-N 3.13Å
385	T	93.8	Very high	93.9	Very high	101 Å²	101	98.1 Å²	98.1	62%	0.62	54%	0.537	S	S	*	.	S	Bend	trans	-73.1	118.9	176.6	-50.8	0	0	0	0	109.9	D389 L390	T385-D389 HydrophobicContact CG2-CB 4.11Å; T385-L390 HydrophobicContact CG2-CD2 3.72Å; T385-L390 HydrophobicContact CG2-CG 3.87Å
386	M	94.6	Very high	93.8	Very high	63 Å²	63	102.3 Å²	102.3	31%	0.31	56%	0.559	S	S	.	*			trans	-93.7	163.7	176.2	-65.4	174.4	-80.6	0	0	111	G384 K388 D389 L390	G384-M386 PolarHBondContact O-N 3.13Å; M386-K388 HydrophobicContact CB-CG 4.07Å; M386-K388 PolarHBondContact O-N 2.78Å; M386-K388 VanDerWaalsContact O-N 3.11Å; M386-D389 WeakPolarHBondContact CB-OD2 3.07Å; M386-D389 WeakPolarHBondContact CE-OD2 3.2Å; M386-D389 PolarHBondContact N-OD2 3.11Å; M386-D389 WeakPolarHBondContact O-CB 3.23Å; M386-D389 PolarHBondContact O-N 2.85Å; M386-L390 PolarHBondContact O-N 3.12Å
387	K	96	Very high	93.7	Very high	168 Å²	168	104.1 Å²	104.1	73%	0.73	56%	0.558	S	S	*	*	H	α-helix	trans	-49	-41.1	175	-177.9	174.4	-178.7	174.2	0	113.7	D389 L390 L391	K387-D389 VanDerWaalsContact C-N 3.26Å; K387-D389 PolarHBondContact O-N 3.44Å; K387-L390 PolarHBondContact O-N 3.43Å; K387-L391 HydrophobicContact CG-CD1 4.22Å; K387-L391 VanDerWaalsContact O-CG 3.3Å; K387-L391 WeakPolarHBondContact O-CG 3.3Å; K387-L391 PolarHBondContact O-N 3Å
388	K	95.5	Very high	93.7	Very high	132 Å²	132	106.1 Å²	106.1	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-69.6	-22.6	179.6	60.1	165.2	-170.9	161.9	0	114	M386 A392	M386-K388 HydrophobicContact CB-CG 4.07Å; M386-K388 PolarHBondContact O-N 2.78Å; M386-K388 VanDerWaalsContact O-N 3.11Å; K388-A392 PolarHBondContact O-N 2.88Å
389	D	92.7	Very high	93.6	Very high	39 Å²	39	108.1 Å²	108.1	21%	0.209	57%	0.568	C	S	.	*	H	α-helix	trans	-80.3	-41.5	179.6	-53.7	-41.4	0	0	0	108.2	T385 M386 K387 L391 A392 E393	T385-D389 HydrophobicContact CG2-CB 4.11Å; M386-D389 WeakPolarHBondContact CB-OD2 3.07Å; M386-D389 WeakPolarHBondContact CE-OD2 3.2Å; M386-D389 PolarHBondContact N-OD2 3.11Å; M386-D389 WeakPolarHBondContact O-CB 3.23Å; M386-D389 PolarHBondContact O-N 2.85Å; K387-D389 VanDerWaalsContact C-N 3.26Å; K387-D389 PolarHBondContact O-N 3.44Å; D389-L391 PolarHBondContact O-N 3.21Å; D389-A392 PolarHBondContact O-N 3.05Å; D389-E393 PolarHBondContact O-N 3Å
390	L	92	Very high	93.4	Very high	106 Å²	106	109.3 Å²	109.3	56%	0.555	58%	0.581	S	S	*	*	H	α-helix	trans	-61.4	-25.1	170.1	-62.4	174.1	0	0	0	114	T385 M386 K387	T385-L390 HydrophobicContact CG2-CD2 3.72Å; T385-L390 HydrophobicContact CG2-CG 3.87Å; M386-L390 PolarHBondContact O-N 3.12Å; K387-L390 PolarHBondContact O-N 3.43Å
391	L	93.8	Very high	93.3	Very high	131 Å²	131	106.8 Å²	106.8	69%	0.686	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-13.4	176.5	-71.9	171.3	0	0	0	113.1	K387 D389	K387-L391 HydrophobicContact CG-CD1 4.22Å; K387-L391 VanDerWaalsContact O-CG 3.3Å; K387-L391 WeakPolarHBondContact O-CG 3.3Å; K387-L391 PolarHBondContact O-N 3Å; D389-L391 PolarHBondContact O-N 3.21Å
392	A	90.4	Very high	93.1	Very high	89 Å²	89	108.7 Å²	108.7	74%	0.736	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-20	179.6	0	0	0	0	0	112.3	K388 D389	K388-A392 PolarHBondContact O-N 2.88Å; D389-A392 PolarHBondContact O-N 3.05Å
393	E	80.6	Confident	92.7	Very high	200 Å²	200	104.9 Å²	104.9	94%	0.935	56%	0.56	S	S	*	*			trans	-71.6	0	159.8	-68.1	173	-174.5	0	0	109.7	D389	D389-E393 PolarHBondContact O-N 3Å

Retrieved 393 of 393 residues in 399.2 ms (Link to these results)

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