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Electron transfer flavoprotein subunit beta

Heterodimeric electron transfer flavoprotein that accepts electrons from several mitochondrial dehydrogenases, including acyl-CoA dehydrogenases, glutaryl-CoA and sarcosine dehydrogenase. It transfers the electrons to the main mitochondrial respiratory chain via ETF-ubiquinone oxidoreductase. Required for normal mitochondrial fatty acid oxidation and normal amino acid metabolism. ETFB binds an AMP molecule that probably has a purely structural role. The electron transfer flavoprotein serves as a specific electron acceptor for several dehydrogenases, including five acyl-CoA dehydrogenases, glutaryl-CoA and sarcosine dehydrogenase. It transfers the electrons to the main mitochondrial respiratory chain via ETF-ubiquinone oxidoreductase (ETF dehydrogenase).

AlphaFold DB , UniProt , Accession A0A087XGW0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 254 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.1	Low	88.3	Confident	107 Å²	107	36.7 Å²	36.7	53%	0.527	20%	0.195	S	C	.	.				0	132.8	0	-163.3	-165.5	-84.3	0	0	107.5	L56 G156 D157 T176	M1-L56 VanDerWaalsContact O-O 3.1Å; M1-G156 VanDerWaalsContact CE-C 3.49Å; M1-G156 WeakPolarHBondContact CE-O 3.42Å; M1-D157 VanDerWaalsContact CE-CA 3.41Å; M1-D157 HydrophobicContact CE-CB 4.3Å; M1-T176 HydrophobicContact CE-CG2 4.2Å; M1-T176 WeakPolarHBondContact CE-OG1 3.37Å; M1-T176 HydrophobicContact SD-CG2 4.37Å
2	S	56.5	Low	89.1	Confident	101 Å²	101	33.8 Å²	33.8	71%	0.706	18%	0.18	S	C	*	.			trans	-109	40.3	-171.9	-54.7	0	0	0	0	111.7
3	G	79.4	Confident	89.8	Confident	9 Å²	9	32.7 Å²	32.7	9%	0.093	17%	0.174	C	C	.	.			trans	-79.3	159.6	-170.5	0	0	0	0	0	114.2	K58	G3-K58 PolarHBondContact O-N 2.92Å
4	R	94.8	Very high	90.4	Very high	70 Å²	70	31.3 Å²	31.3	26%	0.264	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.3	172.5	-178.5	178.7	-70.4	155.1	-4.4	110.3	E59 V61 R84 E114 Q117 I118	R4-E59 HydrophobicContact CG-CB 4.41Å; R4-E59 IonicContact CZ-OE2 2.66Å; R4-E59 IonicContact NE-OE2 3.91Å; R4-E59 PolarHBondContact NE-OE2 2.83Å; R4-E59 IonicContact NH2-OE2 3.4Å; R4-E59 PolarHBondContact NH2-OE2 2.77Å; R4-V61 HydrophobicContact CG-CG2 3.98Å; R4-R84 VanDerWaalsContact CZ-NH2 3.26Å; R4-E114 VanDerWaalsContact CD-O 3.28Å; R4-E114 WeakPolarHBondContact CD-O 3.41Å; R4-E114 IonicContact CZ-OE2 3.7Å; R4-E114 PolarHBondContact NH1-O 3.13Å; R4-E114 IonicContact NH1-OE2 2.64Å; R4-E114 PolarHBondContact NH1-OE2 3.26Å; R4-Q117 PolarHBondContact O-N 3.41Å; R4-I118 PolarHBondContact O-N 3.19Å
5	V	97.9	Very high	90.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.2	174	-175.7	0	0	0	0	109.6	V7 A48 V57 E59 V61 I118 I120	V5-V7 HydrophobicContact CG1-CG2 3.95Å; V5-A48 HydrophobicContact CG1-CB 4.03Å; V5-V57 HydrophobicContact CG2-CB 3.72Å; V5-V57 HydrophobicContact CG2-CG1 3.5Å; V5-V57 VanDerWaalsContact CG2-CG1 3.5Å; V5-V57 HydrophobicContact CG2-CG2 3.87Å; V5-E59 PolarHBondContact N-O 2.92Å; V5-V61 PolarHBondContact O-N 2.83Å; V5-I118 CarbonylContact C-O 3.58Å; V5-I118 VanDerWaalsContact CA-O 3.3Å; V5-I118 WeakPolarHBondContact CA-O 3.24Å; V5-I118 HydrophobicContact CG1-CB 4.46Å; V5-I118 HydrophobicContact CG2-CB 4.25Å; V5-I120 HydrophobicContact CG1-CD1 4.02Å; V5-I120 HydrophobicContact CG1-CG1 3.89Å
6	L	98.6	Very high	91	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.3	164	-59.6	-173.3	0	0	0	109.5	V61 V63 M107 L110 A111 E114 A116 I118 I119 I120	L6-V61 WeakPolarHBondContact CA-O 3.28Å; L6-V61 HydrophobicContact CD2-CB 3.72Å; L6-V61 HydrophobicContact CD2-CG1 4.07Å; L6-V61 HydrophobicContact CD2-CG2 4.34Å; L6-V63 HydrophobicContact CD2-CG2 4.42Å; L6-M107 HydrophobicContact CB-CE 4.19Å; L6-L110 HydrophobicContact CD1-CB 4.04Å; L6-A111 HydrophobicContact CD1-CB 4.12Å; L6-E114 HydrophobicContact CD2-CB 4.17Å; L6-E114 HydrophobicContact CD2-CG 4.33Å; L6-A116 HydrophobicContact CD1-CB 3.95Å; L6-A116 HydrophobicContact CD2-CB 4.43Å; L6-A116 HydrophobicContact CG-CB 3.65Å; L6-I118 PolarHBondContact N-O 3.43Å; L6-I119 HydrophobicContact CB-CG1 4.32Å; L6-I119 HydrophobicContact CB-CG2 4.44Å; L6-I119 CarbonylContact O-C 3.57Å; L6-I119 VanDerWaalsContact O-CA 3.31Å; L6-I119 WeakPolarHBondContact O-CA 3.49Å; L6-I120 PolarHBondContact O-N 2.89Å
7	V	98.8	Very high	91.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.2	175.8	-172.9	0	0	0	0	109.9	V5 V9 A44 V45 A48 V60 V61 A62 V63 I120	V5-V7 HydrophobicContact CG1-CG2 3.95Å; V7-V9 HydrophobicContact CG1-CG1 4.32Å; V7-A44 HydrophobicContact CG1-CB 3.94Å; V7-V45 HydrophobicContact CG1-CB 4.43Å; V7-V45 HydrophobicContact CG1-CG2 3.66Å; V7-A48 HydrophobicContact CG2-CB 3.37Å; V7-V60 HydrophobicContact CG2-CG1 3.87Å; V7-V61 PolarHBondContact N-O 2.91Å; V7-A62 CarbonylContact O-C 3.55Å; V7-V63 PolarHBondContact O-N 2.92Å; V7-I120 VanDerWaalsContact CA-O 3.3Å; V7-I120 WeakPolarHBondContact CA-O 3.37Å
8	G	98.6	Very high	91.6	Very high	11 Å²	11	51.8 Å²	51.8	11%	0.113	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.8	176.2	0	0	0	0	0	111.6	C41 I120	G8-C41 PolarHBondContact O-SG 3.5Å; G8-I120 PolarHBondContact N-O 3.35Å; G8-I120 VanDerWaalsContact N-O 3.08Å
9	V	98.7	Very high	91.8	Very high	6 Å²	6	53.5 Å²	53.5	4%	0.036	28%	0.275	C	S	.	.			trans	-121.7	127.7	175.6	-57.2	0	0	0	0	111.1	V7 M37 C41 V45 V63 S64 T73 I74 A77	V7-V9 HydrophobicContact CG1-CG1 4.32Å; V9-M37 HydrophobicContact CB-CE 4.32Å; V9-M37 HydrophobicContact CB-CG 4.43Å; V9-M37 HydrophobicContact CB-SD 4.23Å; V9-M37 HydrophobicContact CG1-CE 4.19Å; V9-M37 HydrophobicContact CG1-SD 3.95Å; V9-C41 HydrophobicContact CB-CB 4.22Å; V9-C41 HydrophobicContact CG1-CB 4.16Å; V9-V45 HydrophobicContact CG1-CG2 3.45Å; V9-V45 VanDerWaalsContact CG1-CG2 3.45Å; V9-V63 PolarHBondContact N-O 3.13Å; V9-S64 WeakPolarHBondContact O-CA 3.34Å; V9-S64 WeakPolarHBondContact O-CB 3.36Å; V9-S64 PolarHBondContact O-OG 2.9Å; V9-T73 HydrophobicContact CB-CG2 4.11Å; V9-T73 HydrophobicContact CG2-CG2 3.97Å; V9-I74 HydrophobicContact CG2-CG1 4.39Å; V9-A77 HydrophobicContact CG1-CB 4.33Å
10	K	98.8	Very high	92	Very high	57 Å²	57	59.3 Å²	59.3	25%	0.248	29%	0.293	C	S	.	.			trans	-107.6	138.4	178.5	-162.7	-175.5	-178.1	-169.3	0	110.5	V12 N38 A125 D127 D128	K10-V12 HydrophobicContact CB-CG1 4.28Å; K10-V12 HydrophobicContact CD-CG1 3.84Å; K10-V12 HydrophobicContact CG-CG1 3.95Å; K10-N38 HydrophobicContact CB-CB 4.36Å; K10-N38 PolarHBondContact O-N 3.35Å; K10-A125 HydrophobicContact CD-CB 3.55Å; K10-D127 VanDerWaalsContact CE-OD2 3.23Å; K10-D127 WeakPolarHBondContact CE-OD2 3.43Å; K10-D127 IonicContact NZ-OD1 3.56Å; K10-D127 PolarHBondContact NZ-OD1 2.84Å; K10-D127 IonicContact NZ-OD2 3.66Å; K10-D127 PolarHBondContact NZ-OD2 2.84Å; K10-D128 IonicContact NZ-OD2 3.21Å; K10-D128 PolarHBondContact NZ-OD2 2.72Å
11	R	98.4	Very high	92.3	Very high	43 Å²	43	57.4 Å²	57.4	16%	0.162	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121.7	168.6	-176.8	178.6	175.7	-78.2	-0.8	108.2	H35 T73	R11-H35 HydrophobicContact CG-CB 4.08Å; R11-H35 VanDerWaalsContact CZ-CB 3.42Å; R11-H35 PolarHBondContact NH1-CD2 3.09Å; R11-H35 VanDerWaalsContact NH1-CG 3.26Å; R11-H35 PolarHBondContact NH1-NE2 2.87Å; R11-H35 PolarHBondContact NH2-ND1 2.98Å; R11-T73 WeakPolarHBondContact CB-OG1 3.33Å
12	V	98.3	Very high	94.4	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	164.9	-177.2	-60.2	0	0	0	0	110.1	K10 D14 H35 S36 N38 I126 D127	K10-V12 HydrophobicContact CB-CG1 4.28Å; K10-V12 HydrophobicContact CD-CG1 3.84Å; K10-V12 HydrophobicContact CG-CG1 3.95Å; V12-D14 PolarHBondContact O-N 3.42Å; V12-H35 VanDerWaalsContact C-CD2 3.43Å; V12-H35 CarbonylContact O-C 3.6Å; V12-H35 WeakPolarHBondContact O-CA 3.14Å; V12-H35 VanDerWaalsContact O-CB 3.23Å; V12-H35 WeakPolarHBondContact O-CB 3.39Å; V12-H35 PolarHBondContact O-CD2 3.01Å; V12-S36 PolarHBondContact N-O 2.99Å; V12-S36 PolarHBondContact O-N 3.23Å; V12-N38 HydrophobicContact CG1-CB 4.09Å; V12-N38 HydrophobicContact CG2-CB 3.91Å; V12-I126 HydrophobicContact CB-CG1 4.24Å; V12-I126 HydrophobicContact CG2-CD1 3.87Å; V12-I126 HydrophobicContact CG2-CG1 3.77Å; V12-D127 HydrophobicContact CB-CB 4.39Å; V12-D127 HydrophobicContact CG1-CB 4.28Å; V12-D127 WeakPolarHBondContact CG1-OD2 3.48Å
13	I	98.1	Very high	96.3	Very high	20 Å²	20	57.1 Å²	57.1	10%	0.103	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	137.2	168.6	-67.8	174.6	0	0	0	108.2	Y15 V17 I19 V28 T30 V33	I13-Y15 PolarHBondContact O-N 3.02Å; I13-V17 HydrophobicContact CG2-CB 3.76Å; I13-V17 HydrophobicContact CG2-CG1 3.91Å; I13-V17 HydrophobicContact CG2-CG2 4.36Å; I13-I19 HydrophobicContact CD1-CG2 4Å; I13-I19 HydrophobicContact CG2-CG2 4.03Å; I13-V28 HydrophobicContact CD1-CG2 4.08Å; I13-T30 HydrophobicContact CD1-CG2 4.32Å; I13-V33 HydrophobicContact CD1-CG1 4.39Å; I13-V33 HydrophobicContact CG1-CG1 4.18Å; I13-V33 HydrophobicContact CG2-CG1 3.7Å
14	D	97.5	Very high	97	Very high	13 Å²	13	61.5 Å²	61.5	7%	0.07	30%	0.303	C	S	.	.			trans	-59.1	133.6	-177.9	-174.2	-81.3	0	0	0	111	V12 A16 V17 K34 S36	V12-D14 PolarHBondContact O-N 3.42Å; D14-A16 PolarHBondContact O-N 2.99Å; D14-A16 WeakPolarHBondContact OD1-CB 3.44Å; D14-A16 PolarHBondContact OD1-N 2.66Å; D14-V17 HydrophobicContact CB-CG2 4.01Å; D14-V17 VanDerWaalsContact O-CB 3.32Å; D14-V17 WeakPolarHBondContact O-CB 3.45Å; D14-V17 PolarHBondContact O-N 2.9Å; D14-K34 HydrophobicContact CB-CB 4.38Å; D14-K34 HydrophobicContact CB-CD 4.12Å; D14-K34 HydrophobicContact CB-CG 4.12Å; D14-K34 WeakPolarHBondContact CB-O 3.08Å; D14-K34 PolarHBondContact N-O 3.25Å; D14-K34 IonicContact OD1-NZ 3.49Å; D14-K34 WeakPolarHBondContact OD2-CE 3.24Å; D14-K34 IonicContact OD2-NZ 3.83Å; D14-K34 PolarHBondContact OD2-NZ 3.45Å; D14-S36 WeakPolarHBondContact CA-OG 3.41Å; D14-S36 WeakPolarHBondContact CB-OG 3.36Å; D14-S36 PolarHBondContact OD2-OG 3.01Å
15	Y	95.1	Very high	97.1	Very high	177 Å²	177	61.2 Å²	61.2	69%	0.694	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	-173.8	70.7	-91.9	0	0	0	113.8	I13 V17 P39	I13-Y15 PolarHBondContact O-N 3.02Å; Y15-V17 VanDerWaalsContact C-N 3.33Å; Y15-P39 HydrophobicContact CD1-CG 4.06Å; Y15-P39 HydrophobicContact CG-CG 4.49Å
16	A	96	Very high	96.9	Very high	76 Å²	76	65.4 Å²	65.4	63%	0.628	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.6	176.4	0	0	0	0	0	113.2	D14	D14-A16 PolarHBondContact O-N 2.99Å; D14-A16 WeakPolarHBondContact OD1-CB 3.44Å; D14-A16 PolarHBondContact OD1-N 2.66Å
17	V	96.6	Very high	96.7	Very high	49 Å²	49	66 Å²	66	30%	0.297	34%	0.338	S	S	.	.	S	Bend	trans	-85	128.4	179.2	174.1	0	0	0	0	110.3	I13 D14 Y15 I19 V33 K34	I13-V17 HydrophobicContact CG2-CB 3.76Å; I13-V17 HydrophobicContact CG2-CG1 3.91Å; I13-V17 HydrophobicContact CG2-CG2 4.36Å; D14-V17 HydrophobicContact CB-CG2 4.01Å; D14-V17 VanDerWaalsContact O-CB 3.32Å; D14-V17 WeakPolarHBondContact O-CB 3.45Å; D14-V17 PolarHBondContact O-N 2.9Å; Y15-V17 VanDerWaalsContact C-N 3.33Å; V17-I19 PolarHBondContact O-N 2.87Å; V17-V33 HydrophobicContact CB-CG1 4.47Å; V17-V33 HydrophobicContact CG1-CG1 3.76Å; V17-V33 HydrophobicContact CG2-CG1 4.33Å; V17-K34 HydrophobicContact CG2-CB 4.34Å
18	K	95.6	Very high	96.6	Very high	193 Å²	193	68.3 Å²	68.3	84%	0.839	35%	0.352	S	S	*	.			trans	-73.7	109.9	164.1	-175	177.5	178.8	-179.2	0	109.4
19	I	96.3	Very high	96.4	Very high	84 Å²	84	69.7 Å²	69.7	43%	0.431	36%	0.359	S	S	.	.			trans	-64.7	158	176.8	59	76.5	0	0	0	111.6	I13 V17	I13-I19 HydrophobicContact CD1-CG2 4Å; I13-I19 HydrophobicContact CG2-CG2 4.03Å; V17-I19 PolarHBondContact O-N 2.87Å
20	R	96.1	Very high	96.2	Very high	168 Å²	168	72.2 Å²	72.2	63%	0.634	37%	0.374	S	S	*	.			trans	-131.7	132.1	173.9	-68.9	-177.3	-73.2	-179.2	-1.3	108.4	V28 V29	R20-V28 WeakPolarHBondContact O-CA 3.46Å; R20-V29 HydrophobicContact CB-CG2 4.33Å; R20-V29 PolarHBondContact O-N 3Å
21	V	97.1	Very high	95.9	Very high	21 Å²	21	76.1 Å²	76.1	13%	0.127	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-69	141.9	170.5	-179	0	0	0	0	108.7	V226	V21-V226 HydrophobicContact CG1-CG1 4.22Å; V21-V226 WeakPolarHBondContact CG1-O 3.48Å; V21-V226 HydrophobicContact CG2-CG1 4.29Å
22	K	96.1	Very high	95.7	Very high	68 Å²	68	78.6 Å²	78.6	30%	0.296	44%	0.436	S	S	.	.			trans	-67.4	145	174.8	-70.1	176.8	177.7	179.6	0	109.6	D24 N25 T26 G27 V28 V29	K22-D24 WeakPolarHBondContact CB-OD1 3.32Å; K22-D24 PolarHBondContact O-N 3.12Å; K22-N25 PolarHBondContact O-N 2.95Å; K22-T26 VanDerWaalsContact CD-OG1 3.29Å; K22-T26 WeakPolarHBondContact CD-OG1 3.28Å; K22-G27 WeakPolarHBondContact CB-O 3.5Å; K22-G27 PolarHBondContact N-O 2.91Å; K22-V28 WeakPolarHBondContact CE-O 3.28Å; K22-V29 HydrophobicContact CG-CG2 4.07Å
23	P	95.3	Very high	95.6	Very high	134 Å²	134	79.9 Å²	79.9	87%	0.87	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.3	177.4	-25.1	34.7	0	0	0	115
24	D	95.7	Very high	95.5	Very high	101 Å²	101	85.3 Å²	85.3	54%	0.54	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	3	178	63.9	12.1	0	0	0	113.7	K22 T26	K22-D24 WeakPolarHBondContact CB-OD1 3.32Å; K22-D24 PolarHBondContact O-N 3.12Å; D24-T26 HydrophobicContact CB-CG2 4.19Å; D24-T26 VanDerWaalsContact CG-OG1 3.26Å; D24-T26 PolarHBondContact O-N 2.76Å; D24-T26 VanDerWaalsContact O-N 3.11Å; D24-T26 WeakPolarHBondContact OD1-CB 2.82Å; D24-T26 WeakPolarHBondContact OD1-CG2 3.48Å; D24-T26 PolarHBondContact OD1-N 3.45Å; D24-T26 PolarHBondContact OD1-OG1 2.82Å; D24-T26 PolarHBondContact OD2-OG1 2.93Å
25	N	95.5	Very high	95.5	Very high	64 Å²	64	86.5 Å²	86.5	34%	0.342	47%	0.472	S	S	.	.	S	Bend	trans	56.6	20	-178.1	-61.1	-23.1	0	0	0	115	K22 G27 R225 V226	K22-N25 PolarHBondContact O-N 2.95Å; N25-G27 VanDerWaalsContact C-N 3.35Å; N25-R225 CarbonylContact O-C 3.54Å; N25-R225 WeakPolarHBondContact O-CA 3.47Å; N25-V226 VanDerWaalsContact CA-O 3.29Å; N25-V226 WeakPolarHBondContact CA-O 3.33Å; N25-V226 VanDerWaalsContact CB-O 3.26Å; N25-V226 WeakPolarHBondContact CB-O 3.2Å; N25-V226 PolarHBondContact O-N 3.28Å; N25-V226 PolarHBondContact OD1-O 3.07Å
26	T	93.9	Very high	95.6	Very high	87 Å²	87	79.3 Å²	79.3	53%	0.534	45%	0.448	S	S	.	.	S	Bend	trans	-82.4	-13.9	179.4	61.6	0	0	0	0	113.4	K22 D24	K22-T26 VanDerWaalsContact CD-OG1 3.29Å; K22-T26 WeakPolarHBondContact CD-OG1 3.28Å; D24-T26 HydrophobicContact CB-CG2 4.19Å; D24-T26 VanDerWaalsContact CG-OG1 3.26Å; D24-T26 PolarHBondContact O-N 2.76Å; D24-T26 VanDerWaalsContact O-N 3.11Å; D24-T26 WeakPolarHBondContact OD1-CB 2.82Å; D24-T26 WeakPolarHBondContact OD1-CG2 3.48Å; D24-T26 PolarHBondContact OD1-N 3.45Å; D24-T26 PolarHBondContact OD1-OG1 2.82Å; D24-T26 PolarHBondContact OD2-OG1 2.93Å
27	G	95.1	Very high	95.7	Very high	13 Å²	13	76 Å²	76	13%	0.134	42%	0.42	C	S	.	.	S	Bend	trans	165.6	-158.6	-175.8	0	0	0	0	0	112.9	K22 N25	K22-G27 WeakPolarHBondContact CB-O 3.5Å; K22-G27 PolarHBondContact N-O 2.91Å; N25-G27 VanDerWaalsContact C-N 3.35Å
28	V	96.1	Very high	95.8	Very high	49 Å²	49	73.8 Å²	73.8	30%	0.297	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-101.1	155.2	174.4	-62	0	0	0	0	111.3	I13 R20 K22 T30	I13-V28 HydrophobicContact CD1-CG2 4.08Å; R20-V28 WeakPolarHBondContact O-CA 3.46Å; K22-V28 WeakPolarHBondContact CE-O 3.28Å; V28-T30 HydrophobicContact CG2-CG2 4.36Å; V28-T30 PolarHBondContact O-N 3.48Å
29	V	95.4	Very high	95.9	Very high	40 Å²	40	65.9 Å²	65.9	24%	0.242	38%	0.375	C	S	.	.			trans	-71.2	116.7	174.8	-180	0	0	0	0	109.6	R20 K22 V33	R20-V29 HydrophobicContact CB-CG2 4.33Å; R20-V29 PolarHBondContact O-N 3Å; K22-V29 HydrophobicContact CG-CG2 4.07Å; V29-V33 HydrophobicContact CG1-CG2 4.37Å; V29-V33 WeakPolarHBondContact O-CG2 3.26Å
30	T	93.9	Very high	96.1	Very high	59 Å²	59	62.5 Å²	62.5	36%	0.362	36%	0.357	S	S	.	.			trans	-106.4	-24.8	177.6	51.2	0	0	0	0	113.1	I13 V28 V33 H35	I13-T30 HydrophobicContact CD1-CG2 4.32Å; V28-T30 HydrophobicContact CG2-CG2 4.36Å; V28-T30 PolarHBondContact O-N 3.48Å; T30-V33 WeakPolarHBondContact O-CB 3.4Å; T30-V33 PolarHBondContact O-N 2.93Å; T30-H35 PolarHBondContact O-CE1 3.23Å
31	D	92.9	Very high	96.2	Very high	138 Å²	138	54.9 Å²	54.9	74%	0.738	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	133.3	-174.7	-62.1	-31.1	0	0	0	111.6	V33	D31-V33 PolarHBondContact O-N 2.93Å; D31-V33 VanDerWaalsContact O-N 3.1Å
32	G	92.4	Very high	96.2	Very high	95 Å²	95	57 Å²	57	98%	0.979	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	5.9	-175.9	0	0	0	0	0	114.4
33	V	95.9	Very high	96.4	Very high	29 Å²	29	54 Å²	54	18%	0.176	33%	0.325	C	S	.	.			trans	-90.9	136.6	178.5	179.4	0	0	0	0	110.2	I13 V17 V29 T30 D31 H35	I13-V33 HydrophobicContact CD1-CG1 4.39Å; I13-V33 HydrophobicContact CG1-CG1 4.18Å; I13-V33 HydrophobicContact CG2-CG1 3.7Å; V17-V33 HydrophobicContact CB-CG1 4.47Å; V17-V33 HydrophobicContact CG1-CG1 3.76Å; V17-V33 HydrophobicContact CG2-CG1 4.33Å; V29-V33 HydrophobicContact CG1-CG2 4.37Å; V29-V33 WeakPolarHBondContact O-CG2 3.26Å; T30-V33 WeakPolarHBondContact O-CB 3.4Å; T30-V33 PolarHBondContact O-N 2.93Å; D31-V33 PolarHBondContact O-N 2.93Å; D31-V33 VanDerWaalsContact O-N 3.1Å; V33-H35 PolarHBondContact O-N 3.48Å; V33-H35 PolarHBondContact O-ND1 3.42Å
34	K	96.1	Very high	96.5	Very high	133 Å²	133	47.7 Å²	47.7	58%	0.578	28%	0.283	S	S	*	.			trans	-62.5	128.1	174.9	-174.2	-172.3	174.4	-145.8	0	109.9	D14 V17	D14-K34 HydrophobicContact CB-CB 4.38Å; D14-K34 HydrophobicContact CB-CD 4.12Å; D14-K34 HydrophobicContact CB-CG 4.12Å; D14-K34 WeakPolarHBondContact CB-O 3.08Å; D14-K34 PolarHBondContact N-O 3.25Å; D14-K34 IonicContact OD1-NZ 3.49Å; D14-K34 WeakPolarHBondContact OD2-CE 3.24Å; D14-K34 IonicContact OD2-NZ 3.83Å; D14-K34 PolarHBondContact OD2-NZ 3.45Å; V17-K34 HydrophobicContact CG2-CB 4.34Å
35	H	97.7	Very high	96.7	Very high	39 Å²	39	42.9 Å²	42.9	18%	0.181	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	155.2	171.9	-70.6	70.9	0	0	0	110.2	R11 V12 T30 V33	R11-H35 HydrophobicContact CG-CB 4.08Å; R11-H35 VanDerWaalsContact CZ-CB 3.42Å; R11-H35 PolarHBondContact NH1-CD2 3.09Å; R11-H35 VanDerWaalsContact NH1-CG 3.26Å; R11-H35 PolarHBondContact NH1-NE2 2.87Å; R11-H35 PolarHBondContact NH2-ND1 2.98Å; V12-H35 VanDerWaalsContact C-CD2 3.43Å; V12-H35 CarbonylContact O-C 3.6Å; V12-H35 WeakPolarHBondContact O-CA 3.14Å; V12-H35 VanDerWaalsContact O-CB 3.23Å; V12-H35 WeakPolarHBondContact O-CB 3.39Å; V12-H35 PolarHBondContact O-CD2 3.01Å; T30-H35 PolarHBondContact O-CE1 3.23Å; V33-H35 PolarHBondContact O-N 3.48Å; V33-H35 PolarHBondContact O-ND1 3.42Å
36	S	97.4	Very high	96.8	Very high	26 Å²	26	40.1 Å²	40.1	18%	0.182	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	-180	176.1	50.5	0	0	0	0	110.9	V12 D14	V12-S36 PolarHBondContact N-O 2.99Å; V12-S36 PolarHBondContact O-N 3.23Å; D14-S36 WeakPolarHBondContact CA-OG 3.41Å; D14-S36 WeakPolarHBondContact CB-OG 3.36Å; D14-S36 PolarHBondContact OD2-OG 3.01Å
37	M	98.6	Very high	97.1	Very high	7 Å²	7	36.5 Å²	36.5	3%	0.034	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	137.8	171.8	-171.9	176.7	-60.2	0	0	108.7	V9 C41 E42 V45 T73 T76 A77	V9-M37 HydrophobicContact CB-CE 4.32Å; V9-M37 HydrophobicContact CB-CG 4.43Å; V9-M37 HydrophobicContact CB-SD 4.23Å; V9-M37 HydrophobicContact CG1-CE 4.19Å; V9-M37 HydrophobicContact CG1-SD 3.95Å; M37-C41 HydrophobicContact CG-CB 3.92Å; M37-C41 HydrophobicContact SD-CB 4.18Å; M37-E42 HydrophobicContact CB-CG 3.89Å; M37-E42 HydrophobicContact CG-CG 3.82Å; M37-E42 HydrophobicContact SD-CB 4.29Å; M37-E42 HydrophobicContact SD-CG 3.57Å; M37-E42 VanDerWaalsContact SD-CG 3.57Å; M37-V45 HydrophobicContact SD-CG2 4.29Å; M37-T73 HydrophobicContact CB-CG2 3.86Å; M37-T73 HydrophobicContact CE-CG2 3.84Å; M37-T73 WeakPolarHBondContact CE-O 3.44Å; M37-T73 HydrophobicContact CG-CG2 3.76Å; M37-T76 HydrophobicContact CE-CG2 3.87Å; M37-A77 HydrophobicContact CE-CB 3.88Å
38	N	98.6	Very high	97.2	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.214	C	C	.	.			trans	-53.6	129.7	171.7	174.7	57.7	0	0	0	110.4	K10 V12 F40 C41 E42 Q124 A125 I126	K10-N38 HydrophobicContact CB-CB 4.36Å; K10-N38 PolarHBondContact O-N 3.35Å; V12-N38 HydrophobicContact CG1-CB 4.09Å; V12-N38 HydrophobicContact CG2-CB 3.91Å; N38-F40 VanDerWaalsContact C-N 3.29Å; N38-F40 PolarHBondContact O-N 3.48Å; N38-C41 HydrophobicContact CB-CB 4.11Å; N38-C41 PolarHBondContact ND2-SG 3.38Å; N38-C41 VanDerWaalsContact ND2-SG 3.38Å; N38-C41 WeakPolarHBondContact O-CA 3.18Å; N38-C41 VanDerWaalsContact O-CB 3.23Å; N38-C41 WeakPolarHBondContact O-CB 3.49Å; N38-C41 PolarHBondContact O-N 3.41Å; N38-E42 PolarHBondContact O-N 3.36Å; N38-Q124 PolarHBondContact ND2-O 3.08Å; N38-A125 WeakPolarHBondContact OD1-CA 3.49Å; N38-I126 PolarHBondContact OD1-N 2.94Å
39	P	98.5	Very high	97.3	Very high	28 Å²	28	33.7 Å²	33.7	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-55.2	-40.3	-174.3	-30.1	36.2	0	0	0	114.1	Y15 C41 E42 I43 I126	Y15-P39 HydrophobicContact CD1-CG 4.06Å; Y15-P39 HydrophobicContact CG-CG 4.49Å; P39-C41 PolarHBondContact O-N 2.93Å; P39-E42 PolarHBondContact O-N 3.26Å; P39-I43 PolarHBondContact O-N 3.14Å; P39-I126 HydrophobicContact CG-CD1 4.39Å
40	F	98.7	Very high	97.4	Very high	13 Å²	13	34.8 Å²	34.8	6%	0.057	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-28.3	176.3	-59.9	-87	0	0	0	113	N38 A44 G122 K123 Q124 I126 L184	N38-F40 VanDerWaalsContact C-N 3.29Å; N38-F40 PolarHBondContact O-N 3.48Å; F40-A44 PolarHBondContact O-N 2.95Å; F40-A44 VanDerWaalsContact O-N 3.13Å; F40-G122 VanDerWaalsContact CB-CA 3.47Å; F40-K123 HydrophobicContact CD1-CB 3.82Å; F40-K123 HydrophobicContact CE1-CB 4.02Å; F40-K123 HydrophobicContact CE1-CD 4.12Å; F40-K123 HydrophobicContact CE1-CG 4.42Å; F40-K123 HydrophobicContact CG-CB 4.44Å; F40-Q124 HydrophobicContact CD2-CG 4.03Å; F40-Q124 WeakPolarHBondContact CD2-O 3.44Å; F40-Q124 HydrophobicContact CE2-CG 3.55Å; F40-Q124 HydrophobicContact CZ-CG 3.93Å; F40-I126 HydrophobicContact CD2-CG2 4.34Å; F40-I126 HydrophobicContact CE2-CG2 4.04Å; F40-L184 HydrophobicContact CD1-CD2 3.77Å; F40-L184 HydrophobicContact CD1-CG 4.09Å; F40-L184 HydrophobicContact CE1-CD1 4.31Å; F40-L184 HydrophobicContact CE1-CD2 3.63Å; F40-L184 HydrophobicContact CE1-CG 3.52Å; F40-L184 HydrophobicContact CG-CD2 4.34Å; F40-L184 HydrophobicContact CZ-CD1 4.35Å; F40-L184 HydrophobicContact CZ-CD2 4.05Å; F40-L184 HydrophobicContact CZ-CG 4.01Å
41	C	98.7	Very high	97.5	Very high	7 Å²	7	32 Å²	32	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-72.8	-33.4	175.5	-67.6	0	0	0	0	111.9	G8 V9 M37 N38 P39 I43 A44 V45	G8-C41 PolarHBondContact O-SG 3.5Å; V9-C41 HydrophobicContact CB-CB 4.22Å; V9-C41 HydrophobicContact CG1-CB 4.16Å; M37-C41 HydrophobicContact CG-CB 3.92Å; M37-C41 HydrophobicContact SD-CB 4.18Å; N38-C41 HydrophobicContact CB-CB 4.11Å; N38-C41 PolarHBondContact ND2-SG 3.38Å; N38-C41 VanDerWaalsContact ND2-SG 3.38Å; N38-C41 WeakPolarHBondContact O-CA 3.18Å; N38-C41 VanDerWaalsContact O-CB 3.23Å; N38-C41 WeakPolarHBondContact O-CB 3.49Å; N38-C41 PolarHBondContact O-N 3.41Å; P39-C41 PolarHBondContact O-N 2.93Å; C41-I43 VanDerWaalsContact C-N 3.27Å; C41-I43 PolarHBondContact O-N 2.88Å; C41-A44 PolarHBondContact O-N 3.23Å; C41-V45 WeakPolarHBondContact O-CG2 3.2Å; C41-V45 PolarHBondContact O-N 2.99Å
42	E	98.6	Very high	97.7	Very high	65 Å²	65	27.6 Å²	27.6	30%	0.304	16%	0.159	S	C	.	.	H	α-helix	trans	-61.1	-40.6	173.9	-65.1	-172.9	167.5	0	0	111.1	M37 N38 P39 V45 E46 M80 P189	M37-E42 HydrophobicContact CB-CG 3.89Å; M37-E42 HydrophobicContact CG-CG 3.82Å; M37-E42 HydrophobicContact SD-CB 4.29Å; M37-E42 HydrophobicContact SD-CG 3.57Å; M37-E42 VanDerWaalsContact SD-CG 3.57Å; N38-E42 PolarHBondContact O-N 3.36Å; P39-E42 PolarHBondContact O-N 3.26Å; E42-V45 PolarHBondContact O-N 3.4Å; E42-E46 PolarHBondContact O-N 3.26Å; E42-M80 HydrophobicContact CB-CE 4.28Å; E42-M80 WeakPolarHBondContact O-CE 3.34Å; E42-P189 HydrophobicContact CB-CB 3.96Å; E42-P189 HydrophobicContact CB-CG 3.79Å
43	I	98.8	Very high	97.8	Very high	7 Å²	7	28.4 Å²	28.4	4%	0.036	14%	0.137	C	C	.	.	H	α-helix	trans	-66.4	-41.5	177	-61.5	176.4	0	0	0	111.4	P39 C41 V45 E46 E47 A182 L184 L186 N187 P189	P39-I43 PolarHBondContact O-N 3.14Å; C41-I43 VanDerWaalsContact C-N 3.27Å; C41-I43 PolarHBondContact O-N 2.88Å; I43-V45 VanDerWaalsContact C-N 3.34Å; I43-V45 PolarHBondContact O-N 3.26Å; I43-E46 PolarHBondContact O-N 3.24Å; I43-E47 PolarHBondContact O-N 3.1Å; I43-A182 HydrophobicContact CB-CB 4.36Å; I43-A182 HydrophobicContact CG2-CB 3.85Å; I43-L184 VanDerWaalsContact CD1-CA 3.46Å; I43-L184 HydrophobicContact CD1-CB 4.37Å; I43-L184 HydrophobicContact CD1-CD2 3.72Å; I43-L186 HydrophobicContact CG2-CB 3.7Å; I43-L186 HydrophobicContact CG2-CD2 4.16Å; I43-L186 HydrophobicContact CG2-CG 4.31Å; I43-N187 WeakPolarHBondContact CG2-OD1 3.42Å; I43-N187 PolarHBondContact O-ND2 3.1Å; I43-P189 HydrophobicContact CB-CG 4.45Å; I43-P189 HydrophobicContact CG1-CG 3.62Å
44	A	98.8	Very high	97.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-41.2	174.6	0	0	0	0	0	112.1	V7 F40 C41 A48 I120 A182	V7-A44 HydrophobicContact CG1-CB 3.94Å; F40-A44 PolarHBondContact O-N 2.95Å; F40-A44 VanDerWaalsContact O-N 3.13Å; C41-A44 PolarHBondContact O-N 3.23Å; A44-A48 PolarHBondContact O-N 3.15Å; A44-A48 VanDerWaalsContact O-N 3.13Å; A44-I120 HydrophobicContact CB-CB 4.43Å; A44-I120 HydrophobicContact CB-CG2 3.67Å; A44-A182 HydrophobicContact CB-CB 4.27Å
45	V	98.8	Very high	97.7	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-47	175.5	172.9	0	0	0	0	110.9	V7 V9 M37 C41 E42 I43 E47 A48 V49 A77 M80	V7-V45 HydrophobicContact CG1-CB 4.43Å; V7-V45 HydrophobicContact CG1-CG2 3.66Å; V9-V45 HydrophobicContact CG1-CG2 3.45Å; V9-V45 VanDerWaalsContact CG1-CG2 3.45Å; M37-V45 HydrophobicContact SD-CG2 4.29Å; C41-V45 WeakPolarHBondContact O-CG2 3.2Å; C41-V45 PolarHBondContact O-N 2.99Å; E42-V45 PolarHBondContact O-N 3.4Å; I43-V45 VanDerWaalsContact C-N 3.34Å; I43-V45 PolarHBondContact O-N 3.26Å; V45-E47 VanDerWaalsContact C-N 3.31Å; V45-E47 PolarHBondContact O-N 3.16Å; V45-A48 PolarHBondContact O-N 2.91Å; V45-V49 HydrophobicContact CG1-CG2 4.35Å; V45-V49 VanDerWaalsContact O-CG2 3.3Å; V45-V49 WeakPolarHBondContact O-CG2 3.34Å; V45-V49 PolarHBondContact O-N 2.99Å; V45-A77 HydrophobicContact CG1-CB 4.24Å; V45-A77 HydrophobicContact CG2-CB 3.94Å; V45-M80 HydrophobicContact CB-CE 4.11Å; V45-M80 HydrophobicContact CB-SD 4.26Å; V45-M80 HydrophobicContact CG1-CB 3.83Å; V45-M80 HydrophobicContact CG1-CE 3.95Å; V45-M80 HydrophobicContact CG1-CG 4.49Å; V45-M80 HydrophobicContact CG1-SD 3.84Å
46	E	98.6	Very high	97.6	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.028	17%	0.174	C	C	.	.	H	α-helix	trans	-58	-44.9	178	178.1	60.6	-148.1	0	0	111.3	E42 I43 A48 V49 K50 N187 P189 R190	E42-E46 PolarHBondContact O-N 3.26Å; I43-E46 PolarHBondContact O-N 3.24Å; E46-A48 PolarHBondContact O-N 3.09Å; E46-V49 PolarHBondContact O-N 3.36Å; E46-K50 HydrophobicContact CG-CD 4.26Å; E46-K50 HydrophobicContact CG-CG 4.46Å; E46-K50 WeakPolarHBondContact O-CG 3.49Å; E46-K50 PolarHBondContact O-N 2.64Å; E46-K50 WeakPolarHBondContact OE1-CE 3.24Å; E46-K50 WeakPolarHBondContact OE1-CG 3.44Å; E46-N187 WeakPolarHBondContact CB-OD1 3.16Å; E46-N187 HydrophobicContact CG-CB 4.28Å; E46-N187 WeakPolarHBondContact CG-OD1 3.41Å; E46-P189 HydrophobicContact CB-CB 4.39Å; E46-R190 IonicContact OE1-CZ 3.59Å; E46-R190 IonicContact OE1-NE 3.61Å; E46-R190 PolarHBondContact OE1-NE 3.42Å; E46-R190 IonicContact OE1-NH2 2.79Å; E46-R190 PolarHBondContact OE1-NH2 3.37Å; E46-R190 WeakPolarHBondContact OE2-CB 3.36Å; E46-R190 WeakPolarHBondContact OE2-CG 3.43Å; E46-R190 IonicContact OE2-CZ 3.61Å; E46-R190 PolarHBondContact OE2-N 3.11Å; E46-R190 VanDerWaalsContact OE2-N 3.11Å; E46-R190 IonicContact OE2-NE 2.75Å; E46-R190 PolarHBondContact OE2-NE 2.91Å; E46-R190 IonicContact OE2-NH2 2.83Å
47	E	98.6	Very high	97.4	Very high	11 Å²	11	36 Å²	36	5%	0.051	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-46.4	179.9	-167.2	57.3	-147.3	0	0	111.4	I43 V45 V49 K50 L51 L186 N187	I43-E47 PolarHBondContact O-N 3.1Å; V45-E47 VanDerWaalsContact C-N 3.31Å; V45-E47 PolarHBondContact O-N 3.16Å; E47-V49 VanDerWaalsContact C-N 3.27Å; E47-V49 PolarHBondContact O-N 3.37Å; E47-K50 PolarHBondContact O-N 2.99Å; E47-L51 WeakPolarHBondContact O-CG 3.48Å; E47-L51 PolarHBondContact O-N 2.92Å; E47-L186 HydrophobicContact CB-CD2 3.97Å; E47-L186 HydrophobicContact CG-CD2 3.94Å; E47-L186 HydrophobicContact CG-CG 4.41Å; E47-N187 PolarHBondContact N-ND2 3.26Å; E47-N187 PolarHBondContact OE2-ND2 2.79Å; E47-N187 VanDerWaalsContact OE2-ND2 3.1Å
48	A	98.3	Very high	97.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-39.7	176.7	0	0	0	0	0	112.3	V5 V7 A44 V45 E46 L51 K52 V60 I120	V5-A48 HydrophobicContact CG1-CB 4.03Å; V7-A48 HydrophobicContact CG2-CB 3.37Å; A44-A48 PolarHBondContact O-N 3.15Å; A44-A48 VanDerWaalsContact O-N 3.13Å; V45-A48 PolarHBondContact O-N 2.91Å; E46-A48 PolarHBondContact O-N 3.09Å; A48-L51 PolarHBondContact O-N 2.67Å; A48-K52 PolarHBondContact O-N 2.82Å; A48-K52 VanDerWaalsContact O-N 3.11Å; A48-V60 HydrophobicContact CB-CG1 3.77Å; A48-V60 HydrophobicContact CB-CG2 4.03Å; A48-V60 WeakPolarHBondContact O-CG2 3.36Å; A48-I120 HydrophobicContact CB-CD1 4.14Å
49	V	97.9	Very high	97.2	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-67.2	-43.4	176.6	173.5	0	0	0	0	111.2	V45 E46 E47 L51 K52 E53	V45-V49 HydrophobicContact CG1-CG2 4.35Å; V45-V49 VanDerWaalsContact O-CG2 3.3Å; V45-V49 WeakPolarHBondContact O-CG2 3.34Å; V45-V49 PolarHBondContact O-N 2.99Å; E46-V49 PolarHBondContact O-N 3.36Å; E47-V49 VanDerWaalsContact C-N 3.27Å; E47-V49 PolarHBondContact O-N 3.37Å; V49-L51 VanDerWaalsContact C-N 3.33Å; V49-L51 PolarHBondContact O-N 3.13Å; V49-K52 WeakPolarHBondContact O-CA 3.47Å; V49-K52 WeakPolarHBondContact O-CB 3.27Å; V49-K52 PolarHBondContact O-N 2.88Å; V49-K52 VanDerWaalsContact O-N 3.08Å; V49-E53 HydrophobicContact CG1-CG 4.42Å; V49-E53 WeakPolarHBondContact O-CG 3.48Å; V49-E53 PolarHBondContact O-N 2.9Å
50	K	97.6	Very high	97.2	Very high	63 Å²	63	43.9 Å²	43.9	27%	0.274	20%	0.199	S	C	.	.	H	α-helix	trans	-59.5	-42.8	174.9	-75.3	179.7	177.1	-177.3	0	112.1	E46 E47 K52 E53 K54	E46-K50 HydrophobicContact CG-CD 4.26Å; E46-K50 HydrophobicContact CG-CG 4.46Å; E46-K50 WeakPolarHBondContact O-CG 3.49Å; E46-K50 PolarHBondContact O-N 2.64Å; E46-K50 WeakPolarHBondContact OE1-CE 3.24Å; E46-K50 WeakPolarHBondContact OE1-CG 3.44Å; E47-K50 PolarHBondContact O-N 2.99Å; K50-K52 PolarHBondContact O-N 3Å; K50-E53 PolarHBondContact O-N 2.74Å; K50-K54 WeakPolarHBondContact O-CG 3.43Å; K50-K54 PolarHBondContact O-N 3.09Å
51	L	96.4	Very high	97.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-37.9	175.1	-67.5	179.4	0	0	0	111.5	E47 A48 V49 K55 L56 V57 I120 L154	E47-L51 WeakPolarHBondContact O-CG 3.48Å; E47-L51 PolarHBondContact O-N 2.92Å; A48-L51 PolarHBondContact O-N 2.67Å; V49-L51 VanDerWaalsContact C-N 3.33Å; V49-L51 PolarHBondContact O-N 3.13Å; L51-K55 PolarHBondContact O-N 2.91Å; L51-L56 HydrophobicContact CD2-CD1 4.08Å; L51-L56 WeakPolarHBondContact O-CB 3.45Å; L51-L56 PolarHBondContact O-N 3.29Å; L51-V57 HydrophobicContact CB-CG1 4.16Å; L51-V57 HydrophobicContact CB-CG2 3.85Å; L51-V57 PolarHBondContact O-N 3.31Å; L51-I120 HydrophobicContact CD1-CD1 4.21Å; L51-L154 HydrophobicContact CD1-CD1 3.89Å; L51-L154 HydrophobicContact CD1-CD2 4.43Å; L51-L154 HydrophobicContact CD2-CD1 3.7Å; L51-L154 HydrophobicContact CD2-CD2 4.44Å; L51-L154 HydrophobicContact CG-CD1 4.46Å
52	K	96.4	Very high	97.2	Very high	45 Å²	45	42.9 Å²	42.9	20%	0.196	19%	0.194	C	C	.	.	H	α-helix	trans	-68.6	-43.3	176.5	-174.3	176.8	64.5	179.8	0	111.9	A48 V49 K50 K54 K55 V57 V60 G81 D83	A48-K52 PolarHBondContact O-N 2.82Å; A48-K52 VanDerWaalsContact O-N 3.11Å; V49-K52 WeakPolarHBondContact O-CA 3.47Å; V49-K52 WeakPolarHBondContact O-CB 3.27Å; V49-K52 PolarHBondContact O-N 2.88Å; V49-K52 VanDerWaalsContact O-N 3.08Å; K50-K52 PolarHBondContact O-N 3Å; K52-K54 VanDerWaalsContact C-N 3.26Å; K52-K54 PolarHBondContact O-N 2.87Å; K52-K55 WeakPolarHBondContact O-CA 3.47Å; K52-K55 PolarHBondContact O-N 3.23Å; K52-V57 HydrophobicContact CB-CG2 3.79Å; K52-V60 HydrophobicContact CB-CG2 4.08Å; K52-V60 HydrophobicContact CD-CG2 4.2Å; K52-G81 PolarHBondContact NZ-O 2.85Å; K52-D83 WeakPolarHBondContact CD-OD2 3.38Å; K52-D83 IonicContact NZ-OD1 3.19Å; K52-D83 PolarHBondContact NZ-OD1 2.95Å; K52-D83 IonicContact NZ-OD2 2.78Å; K52-D83 PolarHBondContact NZ-OD2 3.01Å
53	E	95.8	Very high	97.2	Very high	112 Å²	112	39.9 Å²	39.9	52%	0.523	18%	0.18	S	C	.	.	H	α-helix	trans	-62.3	-35.3	177.6	-71.9	175.3	156.6	0	0	111.9	V49 K50 K55 R190	V49-E53 HydrophobicContact CG1-CG 4.42Å; V49-E53 WeakPolarHBondContact O-CG 3.48Å; V49-E53 PolarHBondContact O-N 2.9Å; K50-E53 PolarHBondContact O-N 2.74Å; E53-K55 PolarHBondContact O-N 3.38Å; E53-R190 IonicContact OE1-CZ 2.79Å; E53-R190 IonicContact OE1-NH1 3.23Å; E53-R190 PolarHBondContact OE1-NH1 3.27Å; E53-R190 IonicContact OE1-NH2 2.74Å; E53-R190 IonicContact OE2-CZ 3.41Å; E53-R190 IonicContact OE2-NH1 2.77Å; E53-R190 IonicContact OE2-NH2 2.73Å; E53-R190 PolarHBondContact OE2-NH2 2.79Å
54	K	95.3	Very high	97.2	Very high	132 Å²	132	39.7 Å²	39.7	57%	0.574	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	0.6	170.8	-67.2	174.7	-178.3	176.7	0	113.8	K50 K52 L56	K50-K54 WeakPolarHBondContact O-CG 3.43Å; K50-K54 PolarHBondContact O-N 3.09Å; K52-K54 VanDerWaalsContact C-N 3.26Å; K52-K54 PolarHBondContact O-N 2.87Å; K54-L56 HydrophobicContact CB-CD1 3.81Å; K54-L56 HydrophobicContact CB-CG 3.84Å; K54-L56 HydrophobicContact CD-CD1 4.04Å; K54-L56 PolarHBondContact O-N 3.1Å
55	K	94.4	Very high	97.2	Very high	185 Å²	185	40.6 Å²	40.6	80%	0.804	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	25.7	-176.4	-53	177.7	-178.3	176.1	0	113.6	L51 K52 E53	L51-K55 PolarHBondContact O-N 2.91Å; K52-K55 WeakPolarHBondContact O-CA 3.47Å; K52-K55 PolarHBondContact O-N 3.23Å; E53-K55 PolarHBondContact O-N 3.38Å
56	L	94.1	Very high	97.1	Very high	62 Å²	62	40.5 Å²	40.5	33%	0.325	19%	0.185	S	C	.	.	S	Bend	trans	-86.4	-23.5	177.8	-61.2	172	0	0	0	111.8	M1 L51 K54 L154	M1-L56 VanDerWaalsContact O-O 3.1Å; L51-L56 HydrophobicContact CD2-CD1 4.08Å; L51-L56 WeakPolarHBondContact O-CB 3.45Å; L51-L56 PolarHBondContact O-N 3.29Å; K54-L56 HydrophobicContact CB-CD1 3.81Å; K54-L56 HydrophobicContact CB-CG 3.84Å; K54-L56 HydrophobicContact CD-CD1 4.04Å; K54-L56 PolarHBondContact O-N 3.1Å; L56-L154 HydrophobicContact CB-CD2 4.08Å; L56-L154 HydrophobicContact CD1-CB 4.34Å
57	V	94.3	Very high	97.1	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.048	19%	0.189	C	C	.	.			trans	-130.2	149.2	173.9	-56.6	0	0	0	0	110.1	V5 L51 K52 V60 L154	V5-V57 HydrophobicContact CG2-CB 3.72Å; V5-V57 HydrophobicContact CG2-CG1 3.5Å; V5-V57 VanDerWaalsContact CG2-CG1 3.5Å; V5-V57 HydrophobicContact CG2-CG2 3.87Å; L51-V57 HydrophobicContact CB-CG1 4.16Å; L51-V57 HydrophobicContact CB-CG2 3.85Å; L51-V57 PolarHBondContact O-N 3.31Å; K52-V57 HydrophobicContact CB-CG2 3.79Å; V57-V60 HydrophobicContact CG2-CG2 4.37Å; V57-L154 HydrophobicContact CG1-CD2 4.13Å
58	K	95.4	Very high	97	Very high	159 Å²	159	44.4 Å²	44.4	69%	0.691	21%	0.205	S	C	*	.	S	Bend	trans	-89	-37.5	-173	-177	-179.6	176.1	-175.9	0	112.7	G3	G3-K58 PolarHBondContact O-N 2.92Å
59	E	97	Very high	96.9	Very high	42 Å²	42	49 Å²	49	20%	0.196	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	136.5	-171.4	-171.9	-178.5	-165.9	0	0	110.4	R4 V5 V61 D83 R84	R4-E59 HydrophobicContact CG-CB 4.41Å; R4-E59 IonicContact CZ-OE2 2.66Å; R4-E59 IonicContact NE-OE2 3.91Å; R4-E59 PolarHBondContact NE-OE2 2.83Å; R4-E59 IonicContact NH2-OE2 3.4Å; R4-E59 PolarHBondContact NH2-OE2 2.77Å; V5-E59 PolarHBondContact N-O 2.92Å; E59-V61 HydrophobicContact CG-CG2 4.11Å; E59-D83 HydrophobicContact CG-CB 4.03Å; E59-R84 IonicContact OE1-CZ 3.84Å; E59-R84 IonicContact OE1-NE 3.72Å; E59-R84 PolarHBondContact OE1-NE 3.4Å; E59-R84 IonicContact OE1-NH2 4Å; E59-R84 PolarHBondContact OE1-NH2 2.97Å; E59-R84 IonicContact OE2-NH2 3.09Å
60	V	98.4	Very high	96.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.4	174.7	178.1	0	0	0	0	108.9	V7 A48 K52 V57 A82 D83	V7-V60 HydrophobicContact CG2-CG1 3.87Å; A48-V60 HydrophobicContact CB-CG1 3.77Å; A48-V60 HydrophobicContact CB-CG2 4.03Å; A48-V60 WeakPolarHBondContact O-CG2 3.36Å; K52-V60 HydrophobicContact CB-CG2 4.08Å; K52-V60 HydrophobicContact CD-CG2 4.2Å; V57-V60 HydrophobicContact CG2-CG2 4.37Å; V60-A82 HydrophobicContact CG1-CB 4Å; V60-D83 PolarHBondContact N-OD2 3.18Å; V60-D83 PolarHBondContact O-N 3.11Å
61	V	98.6	Very high	96.9	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.6	179.6	-176.5	0	0	0	0	109.2	R4 V5 L6 V7 E59 V63 R84 I86	R4-V61 HydrophobicContact CG-CG2 3.98Å; V5-V61 PolarHBondContact O-N 2.83Å; L6-V61 WeakPolarHBondContact CA-O 3.28Å; L6-V61 HydrophobicContact CD2-CB 3.72Å; L6-V61 HydrophobicContact CD2-CG1 4.07Å; L6-V61 HydrophobicContact CD2-CG2 4.34Å; V7-V61 PolarHBondContact N-O 2.91Å; E59-V61 HydrophobicContact CG-CG2 4.11Å; V61-V63 HydrophobicContact CG1-CG2 4.45Å; V61-R84 WeakPolarHBondContact CA-O 3.31Å; V61-R84 HydrophobicContact CG1-CG 4.34Å; V61-R84 HydrophobicContact CG2-CG 4.14Å; V61-I86 HydrophobicContact CG1-CD1 3.73Å; V61-I86 HydrophobicContact CG1-CG1 3.78Å
62	A	98.8	Very high	96.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	132.9	176.7	0	0	0	0	0	110.4	V7 I74 A77 A82 R84 G85 I86	V7-A62 CarbonylContact O-C 3.55Å; A62-I74 HydrophobicContact CB-CG2 4.49Å; A62-A77 HydrophobicContact CB-CB 3.67Å; A62-A82 HydrophobicContact CB-CB 3.98Å; A62-R84 PolarHBondContact N-O 3.48Å; A62-G85 CarbonylContact O-C 3.55Å; A62-G85 VanDerWaalsContact O-CA 3.25Å; A62-G85 WeakPolarHBondContact O-CA 3.21Å; A62-I86 PolarHBondContact O-N 3.32Å
63	V	98.8	Very high	97	Very high	2 Å²	2	52 Å²	52	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131	-177.7	-173.7	0	0	0	0	109.7	L6 V7 V9 V61 I86 V88 M107 L110	L6-V63 HydrophobicContact CD2-CG2 4.42Å; V7-V63 PolarHBondContact O-N 2.92Å; V9-V63 PolarHBondContact N-O 3.13Å; V61-V63 HydrophobicContact CG1-CG2 4.45Å; V63-I86 WeakPolarHBondContact CA-O 3.36Å; V63-I86 HydrophobicContact CG1-CB 4.49Å; V63-I86 HydrophobicContact CG2-CB 4.29Å; V63-V88 HydrophobicContact CG1-CG2 4.38Å; V63-M107 HydrophobicContact CB-CE 4.48Å; V63-M107 HydrophobicContact CB-SD 4.08Å; V63-M107 HydrophobicContact CG1-SD 3.85Å; V63-L110 HydrophobicContact CG1-CD1 3.46Å; V63-L110 VanDerWaalsContact CG1-CD1 3.46Å; V63-L110 HydrophobicContact CG2-CD1 4.31Å
64	S	98.8	Very high	97.2	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.1	170.9	-163.2	0	0	0	0	110.2	V9 I86 V88	V9-S64 WeakPolarHBondContact O-CA 3.34Å; V9-S64 WeakPolarHBondContact O-CB 3.36Å; V9-S64 PolarHBondContact O-OG 2.9Å; S64-I86 PolarHBondContact N-O 3.48Å; S64-I86 VanDerWaalsContact N-O 3.09Å; S64-V88 PolarHBondContact O-N 3.28Å
65	C	98.5	Very high	97.3	Very high	19 Å²	19	44.1 Å²	44.1	13%	0.128	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.6	178.3	-51.6	0	0	0	0	108.4	V88 L98 I106	C65-V88 WeakPolarHBondContact CA-O 3.34Å; C65-V88 HydrophobicContact CB-CB 4.28Å; C65-L98 HydrophobicContact CB-CD2 4.07Å; C65-I106 HydrophobicContact CB-CD1 4.46Å
66	G	97.7	Very high	97.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.2	-163.6	-178.8	0	0	0	0	0	113	H87 V88 V90	G66-H87 PolarHBondContact O-NE2 2.88Å; G66-V88 PolarHBondContact N-O 2.92Å; G66-V90 CarbonylContact C-O 3.55Å; G66-V90 PolarHBondContact O-N 3.42Å
67	P	97.1	Very high	97.7	Very high	19 Å²	19	35.3 Å²	35.3	12%	0.123	17%	0.168	C	C	.	.	S	Bend	trans	-73.7	172.4	-177.4	34.3	-40.4	0	0	0	110	Q69 S70 H87 V90 Y95	P67-Q69 PolarHBondContact O-N 3.38Å; P67-S70 WeakPolarHBondContact CD-OG 3.48Å; P67-S70 WeakPolarHBondContact O-CB 3.41Å; P67-S70 PolarHBondContact O-N 3.08Å; P67-S70 PolarHBondContact O-OG 2.96Å; P67-H87 PolarHBondContact O-NE2 2.65Å; P67-V90 VanDerWaalsContact CA-O 3.27Å; P67-V90 WeakPolarHBondContact CA-O 3.25Å; P67-Y95 HydrophobicContact CG-CD1 4.34Å; P67-Y95 HydrophobicContact CG-CE1 3.99Å; P67-Y95 HydrophobicContact CG-CE2 4.36Å
68	Q	97.1	Very high	97.9	Very high	79 Å²	79	35 Å²	35	37%	0.369	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-32.3	-177.3	-72.6	-66.7	-3.8	0	0	114.6	S70 Q71 E89	Q68-S70 PolarHBondContact O-N 3Å; Q68-Q71 WeakPolarHBondContact O-CB 3.3Å; Q68-Q71 WeakPolarHBondContact O-CG 3.35Å; Q68-Q71 PolarHBondContact O-N 3.45Å; Q68-Q71 VanDerWaalsContact O-N 3.1Å; Q68-E89 PolarHBondContact NE2-OE1 3.2Å; Q68-E89 PolarHBondContact NE2-OE2 3.14Å; Q68-E89 VanDerWaalsContact NE2-OE2 3.17Å
69	Q	96.7	Very high	98	Very high	96 Å²	96	27.6 Å²	27.6	45%	0.449	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.9	176.9	-63.7	78.6	5	0	0	112.9	P67 Q71 E72	P67-Q69 PolarHBondContact O-N 3.38Å; Q69-Q71 PolarHBondContact O-N 3.15Å; Q69-E72 WeakPolarHBondContact O-CB 3.49Å; Q69-E72 PolarHBondContact O-N 3.43Å
70	S	97.8	Very high	98.1	Very high	1 Å²	1	26 Å²	26	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-21.6	175.4	-50.8	0	0	0	0	112.5	P67 Q68 E72 T73 I74	P67-S70 WeakPolarHBondContact CD-OG 3.48Å; P67-S70 WeakPolarHBondContact O-CB 3.41Å; P67-S70 PolarHBondContact O-N 3.08Å; P67-S70 PolarHBondContact O-OG 2.96Å; Q68-S70 PolarHBondContact O-N 3Å; S70-E72 PolarHBondContact O-N 2.86Å; S70-T73 WeakPolarHBondContact O-CB 3.43Å; S70-T73 PolarHBondContact O-N 3.38Å; S70-I74 PolarHBondContact O-N 2.86Å
71	Q	97.8	Very high	98	Very high	43 Å²	43	26.7 Å²	26.7	20%	0.201	14%	0.135	C	C	.	.	H	α-helix	trans	-60.2	-31.3	172.1	-67.8	-164.5	43.7	0	0	112.5	Q68 Q69 T73 I74 R75 H87 I205	Q68-Q71 WeakPolarHBondContact O-CB 3.3Å; Q68-Q71 WeakPolarHBondContact O-CG 3.35Å; Q68-Q71 PolarHBondContact O-N 3.45Å; Q68-Q71 VanDerWaalsContact O-N 3.1Å; Q69-Q71 PolarHBondContact O-N 3.15Å; Q71-T73 VanDerWaalsContact C-N 3.32Å; Q71-T73 PolarHBondContact O-N 3.47Å; Q71-I74 PolarHBondContact O-N 2.76Å; Q71-R75 VanDerWaalsContact O-CG 3.3Å; Q71-R75 WeakPolarHBondContact O-CG 3.07Å; Q71-R75 PolarHBondContact O-N 3.43Å; Q71-H87 HydrophobicContact CG-CB 4.11Å; Q71-I205 HydrophobicContact CB-CD1 4.47Å
72	E	96.9	Very high	98	Very high	126 Å²	126	26.7 Å²	26.7	59%	0.589	14%	0.135	S	C	*	.	H	α-helix	trans	-62.1	-42.4	176.5	-62.5	178.5	169	0	0	111	Q69 S70 I74 R75 T76	Q69-E72 WeakPolarHBondContact O-CB 3.49Å; Q69-E72 PolarHBondContact O-N 3.43Å; S70-E72 PolarHBondContact O-N 2.86Å; E72-I74 VanDerWaalsContact C-N 3.35Å; E72-I74 PolarHBondContact O-N 2.96Å; E72-R75 WeakPolarHBondContact O-CB 3.38Å; E72-R75 PolarHBondContact O-N 3.4Å; E72-R75 VanDerWaalsContact O-N 3.13Å; E72-T76 PolarHBondContact O-N 3.45Å; E72-T76 PolarHBondContact O-OG1 3.31Å
73	T	98.3	Very high	97.9	Very high	6 Å²	6	29.5 Å²	29.5	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-40.2	175.6	-53.5	0	0	0	0	111.6	V9 R11 M37 S70 Q71 R75 T76 A77	V9-T73 HydrophobicContact CB-CG2 4.11Å; V9-T73 HydrophobicContact CG2-CG2 3.97Å; R11-T73 WeakPolarHBondContact CB-OG1 3.33Å; M37-T73 HydrophobicContact CB-CG2 3.86Å; M37-T73 HydrophobicContact CE-CG2 3.84Å; M37-T73 WeakPolarHBondContact CE-O 3.44Å; M37-T73 HydrophobicContact CG-CG2 3.76Å; S70-T73 WeakPolarHBondContact O-CB 3.43Å; S70-T73 PolarHBondContact O-N 3.38Å; Q71-T73 VanDerWaalsContact C-N 3.32Å; Q71-T73 PolarHBondContact O-N 3.47Å; T73-R75 VanDerWaalsContact C-N 3.33Å; T73-R75 PolarHBondContact O-N 3.29Å; T73-T76 WeakPolarHBondContact O-CB 3.39Å; T73-T76 PolarHBondContact O-N 2.92Å; T73-A77 PolarHBondContact O-N 3.11Å; T73-A77 VanDerWaalsContact O-N 3.12Å
74	I	98.6	Very high	97.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-42.6	173	-62.9	171.2	0	0	0	110.3	V9 A62 S70 Q71 E72 T76 A77 L78 I86 H87 I205	V9-I74 HydrophobicContact CG2-CG1 4.39Å; A62-I74 HydrophobicContact CB-CG2 4.49Å; S70-I74 PolarHBondContact O-N 2.86Å; Q71-I74 PolarHBondContact O-N 2.76Å; E72-I74 VanDerWaalsContact C-N 3.35Å; E72-I74 PolarHBondContact O-N 2.96Å; I74-T76 VanDerWaalsContact C-N 3.27Å; I74-T76 PolarHBondContact O-N 3.37Å; I74-A77 WeakPolarHBondContact O-CB 3.35Å; I74-A77 PolarHBondContact O-N 3.12Å; I74-A77 VanDerWaalsContact O-N 3.1Å; I74-L78 HydrophobicContact CG2-CD1 4.02Å; I74-L78 HydrophobicContact CG2-CG 4.22Å; I74-L78 VanDerWaalsContact O-CG 3.25Å; I74-L78 WeakPolarHBondContact O-CG 3.38Å; I74-L78 PolarHBondContact O-N 2.97Å; I74-I86 WeakPolarHBondContact CD1-O 3.44Å; I74-H87 HydrophobicContact CD1-CB 3.64Å; I74-I205 HydrophobicContact CB-CD1 4.16Å; I74-I205 HydrophobicContact CD1-CG2 4.21Å; I74-I205 HydrophobicContact CG2-CD1 3.76Å; I74-I205 HydrophobicContact CG2-CG1 3.95Å; I74-I205 HydrophobicContact CG2-CG2 4.46Å
75	R	98.2	Very high	97.9	Very high	78 Å²	78	31.7 Å²	31.7	29%	0.294	16%	0.158	S	C	.	.	H	α-helix	trans	-59.8	-37.6	176.8	-67.8	-71.7	-175.9	-171.5	-0.7	112	Q71 E72 T73 L78 A79 A200 K201 K203 I205	Q71-R75 VanDerWaalsContact O-CG 3.3Å; Q71-R75 WeakPolarHBondContact O-CG 3.07Å; Q71-R75 PolarHBondContact O-N 3.43Å; E72-R75 WeakPolarHBondContact O-CB 3.38Å; E72-R75 PolarHBondContact O-N 3.4Å; E72-R75 VanDerWaalsContact O-N 3.13Å; T73-R75 VanDerWaalsContact C-N 3.33Å; T73-R75 PolarHBondContact O-N 3.29Å; R75-L78 WeakPolarHBondContact O-CB 3.43Å; R75-L78 PolarHBondContact O-N 2.89Å; R75-A79 WeakPolarHBondContact O-CB 3.5Å; R75-A79 PolarHBondContact O-N 3.28Å; R75-A200 PolarHBondContact NH1-O 3.45Å; R75-K201 PolarHBondContact NH1-O 3.28Å; R75-K203 PolarHBondContact NH1-O 2.98Å; R75-I205 HydrophobicContact CG-CD1 4.01Å
76	T	98.2	Very high	97.9	Very high	61 Å²	61	30.9 Å²	30.9	37%	0.374	15%	0.153	S	C	.	.	H	α-helix	trans	-61	-48.3	172.3	-58.5	0	0	0	0	111.2	M37 E72 T73 I74 L78 A79 M80	M37-T76 HydrophobicContact CE-CG2 3.87Å; E72-T76 PolarHBondContact O-N 3.45Å; E72-T76 PolarHBondContact O-OG1 3.31Å; T73-T76 WeakPolarHBondContact O-CB 3.39Å; T73-T76 PolarHBondContact O-N 2.92Å; I74-T76 VanDerWaalsContact C-N 3.27Å; I74-T76 PolarHBondContact O-N 3.37Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.42Å; T76-A79 WeakPolarHBondContact O-CB 3.4Å; T76-A79 PolarHBondContact O-N 2.73Å; T76-M80 HydrophobicContact CG2-SD 4.38Å; T76-M80 WeakPolarHBondContact O-CG 3.43Å; T76-M80 PolarHBondContact O-N 3.43Å
77	A	98.5	Very high	98	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-39	176.5	0	0	0	0	0	112.6	V9 M37 V45 A62 T73 I74 A79 M80 G81 A82	V9-A77 HydrophobicContact CG1-CB 4.33Å; M37-A77 HydrophobicContact CE-CB 3.88Å; V45-A77 HydrophobicContact CG1-CB 4.24Å; V45-A77 HydrophobicContact CG2-CB 3.94Å; A62-A77 HydrophobicContact CB-CB 3.67Å; T73-A77 PolarHBondContact O-N 3.11Å; T73-A77 VanDerWaalsContact O-N 3.12Å; I74-A77 WeakPolarHBondContact O-CB 3.35Å; I74-A77 PolarHBondContact O-N 3.12Å; I74-A77 VanDerWaalsContact O-N 3.1Å; A77-A79 VanDerWaalsContact C-N 3.3Å; A77-A79 PolarHBondContact O-N 2.65Å; A77-M80 PolarHBondContact O-N 2.85Å; A77-G81 PolarHBondContact O-N 3.43Å; A77-G81 VanDerWaalsContact O-N 3.08Å; A77-A82 HydrophobicContact CB-CB 4.47Å; A77-A82 WeakPolarHBondContact O-CB 3.43Å; A77-A82 PolarHBondContact O-N 2.89Å
78	L	98.5	Very high	98	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-33.3	174.9	-68.6	174.7	0	0	0	113.1	I74 R75 T76 A82 R84 A200 K203 I205	I74-L78 HydrophobicContact CG2-CD1 4.02Å; I74-L78 HydrophobicContact CG2-CG 4.22Å; I74-L78 VanDerWaalsContact O-CG 3.25Å; I74-L78 WeakPolarHBondContact O-CG 3.38Å; I74-L78 PolarHBondContact O-N 2.97Å; R75-L78 WeakPolarHBondContact O-CB 3.43Å; R75-L78 PolarHBondContact O-N 2.89Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.42Å; L78-A82 HydrophobicContact CD2-CB 4.12Å; L78-R84 VanDerWaalsContact CD2-C 3.41Å; L78-R84 VanDerWaalsContact CD2-CA 3.46Å; L78-A200 HydrophobicContact CB-CB 3.89Å; L78-K203 HydrophobicContact CB-CD 4.06Å; L78-K203 HydrophobicContact CD1-CB 4.04Å; L78-K203 HydrophobicContact CD2-CB 4.26Å; L78-K203 HydrophobicContact CD2-CD 3.97Å; L78-K203 HydrophobicContact CG-CD 4.48Å; L78-K203 PolarHBondContact O-NZ 2.82Å; L78-I205 HydrophobicContact CD1-CD1 4.1Å; L78-I205 HydrophobicContact CD1-CG1 3.85Å
79	A	98.1	Very high	98.1	Very high	4 Å²	4	29 Å²	29	3%	0.033	14%	0.142	C	C	.	.	H	α-helix	trans	-77.3	-29.8	176.5	0	0	0	0	0	112.3	R75 T76 A77 A192 N196 I197 A200	R75-A79 WeakPolarHBondContact O-CB 3.5Å; R75-A79 PolarHBondContact O-N 3.28Å; T76-A79 WeakPolarHBondContact O-CB 3.4Å; T76-A79 PolarHBondContact O-N 2.73Å; A77-A79 VanDerWaalsContact C-N 3.3Å; A77-A79 PolarHBondContact O-N 2.65Å; A79-A192 HydrophobicContact CB-CB 3.64Å; A79-N196 WeakPolarHBondContact O-CB 3.32Å; A79-I197 HydrophobicContact CB-CG1 4.02Å; A79-A200 HydrophobicContact CB-CB 3.74Å
80	M	97.9	Very high	98.1	Very high	8 Å²	8	24.7 Å²	24.7	4%	0.039	12%	0.122	C	C	.	.	H	α-helix	trans	-69.7	-35.4	171.7	-66.8	171.5	74.3	0	0	112	E42 V45 T76 A77 P189 R190	E42-M80 HydrophobicContact CB-CE 4.28Å; E42-M80 WeakPolarHBondContact O-CE 3.34Å; V45-M80 HydrophobicContact CB-CE 4.11Å; V45-M80 HydrophobicContact CB-SD 4.26Å; V45-M80 HydrophobicContact CG1-CB 3.83Å; V45-M80 HydrophobicContact CG1-CE 3.95Å; V45-M80 HydrophobicContact CG1-CG 4.49Å; V45-M80 HydrophobicContact CG1-SD 3.84Å; T76-M80 HydrophobicContact CG2-SD 4.38Å; T76-M80 WeakPolarHBondContact O-CG 3.43Å; T76-M80 PolarHBondContact O-N 3.43Å; A77-M80 PolarHBondContact O-N 2.85Å; M80-P189 HydrophobicContact CE-CB 4Å; M80-R190 WeakPolarHBondContact O-CD 3.34Å
81	G	97	Very high	98	Very high	16 Å²	16	28.1 Å²	28.1	17%	0.165	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	153.1	-2.3	174.3	0	0	0	0	0	116.1	K52 A77	K52-G81 PolarHBondContact NZ-O 2.85Å; A77-G81 PolarHBondContact O-N 3.43Å; A77-G81 VanDerWaalsContact O-N 3.08Å
82	A	98.1	Very high	97.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.			trans	-59	145.2	175	0	0	0	0	0	111.4	V60 A62 A77 L78 K203	V60-A82 HydrophobicContact CG1-CB 4Å; A62-A82 HydrophobicContact CB-CB 3.98Å; A77-A82 HydrophobicContact CB-CB 4.47Å; A77-A82 WeakPolarHBondContact O-CB 3.43Å; A77-A82 PolarHBondContact O-N 2.89Å; L78-A82 HydrophobicContact CD2-CB 4.12Å; A82-K203 PolarHBondContact O-NZ 3.17Å
83	D	98.1	Very high	97.4	Very high	58 Å²	58	27.8 Å²	27.8	31%	0.31	16%	0.161	S	C	.	.	S	Bend	trans	-78.6	-43.2	-173.2	-63.6	-69.1	0	0	0	111.8	K52 E59 V60	K52-D83 WeakPolarHBondContact CD-OD2 3.38Å; K52-D83 IonicContact NZ-OD1 3.19Å; K52-D83 PolarHBondContact NZ-OD1 2.95Å; K52-D83 IonicContact NZ-OD2 2.78Å; K52-D83 PolarHBondContact NZ-OD2 3.01Å; E59-D83 HydrophobicContact CG-CB 4.03Å; V60-D83 PolarHBondContact N-OD2 3.18Å; V60-D83 PolarHBondContact O-N 3.11Å
84	R	98.3	Very high	97.2	Very high	50 Å²	50	31.2 Å²	31.2	19%	0.189	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	167.6	175.9	60.6	170	168.5	104	3	111.7	R4 E59 V61 A62 L78 E114	R4-R84 VanDerWaalsContact CZ-NH2 3.26Å; E59-R84 IonicContact OE1-CZ 3.84Å; E59-R84 IonicContact OE1-NE 3.72Å; E59-R84 PolarHBondContact OE1-NE 3.4Å; E59-R84 IonicContact OE1-NH2 4Å; E59-R84 PolarHBondContact OE1-NH2 2.97Å; E59-R84 IonicContact OE2-NH2 3.09Å; V61-R84 WeakPolarHBondContact CA-O 3.31Å; V61-R84 HydrophobicContact CG1-CG 4.34Å; V61-R84 HydrophobicContact CG2-CG 4.14Å; A62-R84 PolarHBondContact N-O 3.48Å; L78-R84 VanDerWaalsContact CD2-C 3.41Å; L78-R84 VanDerWaalsContact CD2-CA 3.46Å; R84-E114 IonicContact CZ-OE2 3.56Å; R84-E114 VanDerWaalsContact CZ-OE2 3.23Å; R84-E114 IonicContact NH1-OE1 3.53Å; R84-E114 IonicContact NH1-OE2 2.7Å; R84-E114 PolarHBondContact NH1-OE2 2.83Å; R84-E114 IonicContact NH2-OE2 2.71Å; R84-E114 PolarHBondContact NH2-OE2 2.8Å
85	G	98.6	Very high	97	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	152.9	-178	0	0	0	0	0	113.1	A62 K204 I205 A206	A62-G85 CarbonylContact O-C 3.55Å; A62-G85 VanDerWaalsContact O-CA 3.25Å; A62-G85 WeakPolarHBondContact O-CA 3.21Å; G85-K204 PolarHBondContact N-O 2.71Å; G85-I205 WeakPolarHBondContact O-CA 3.22Å; G85-A206 PolarHBondContact O-N 2.85Å
86	I	98.8	Very high	96.7	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.2	165.3	-57.4	176.4	0	0	0	107.3	V61 A62 V63 S64 I74 V88 L110 E114 A206 V208	V61-I86 HydrophobicContact CG1-CD1 3.73Å; V61-I86 HydrophobicContact CG1-CG1 3.78Å; A62-I86 PolarHBondContact O-N 3.32Å; V63-I86 WeakPolarHBondContact CA-O 3.36Å; V63-I86 HydrophobicContact CG1-CB 4.49Å; V63-I86 HydrophobicContact CG2-CB 4.29Å; S64-I86 PolarHBondContact N-O 3.48Å; S64-I86 VanDerWaalsContact N-O 3.09Å; I74-I86 WeakPolarHBondContact CD1-O 3.44Å; I86-V88 HydrophobicContact CG2-CG2 4.18Å; I86-L110 HydrophobicContact CD1-CD2 4.17Å; I86-L110 HydrophobicContact CG2-CD1 4.35Å; I86-L110 HydrophobicContact CG2-CD2 4.24Å; I86-E114 HydrophobicContact CD1-CG 4.03Å; I86-A206 CarbonylContact C-O 3.53Å; I86-A206 WeakPolarHBondContact CA-O 3.32Å; I86-V208 HydrophobicContact CG2-CB 4.49Å; I86-V208 HydrophobicContact CG2-CG2 3.98Å
87	H	98.8	Very high	96.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.9	171.8	174.6	-134.2	0	0	0	108.2	G66 P67 Q71 I74 E89 I205 A206 N207 V208	G66-H87 PolarHBondContact O-NE2 2.88Å; P67-H87 PolarHBondContact O-NE2 2.65Å; Q71-H87 HydrophobicContact CG-CB 4.11Å; I74-H87 HydrophobicContact CD1-CB 3.64Å; H87-E89 PolarHBondContact O-N 3.31Å; H87-I205 HydrophobicContact CB-CG2 3.73Å; H87-A206 PolarHBondContact N-O 3.06Å; H87-N207 WeakPolarHBondContact CB-OD1 3.38Å; H87-N207 PolarHBondContact ND1-OD1 2.87Å; H87-N207 WeakPolarHBondContact O-CA 3.17Å; H87-V208 PolarHBondContact O-N 3.08Å
88	V	98.5	Very high	96.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	100.5	171.8	-174	0	0	0	0	107.5	V63 S64 C65 G66 I86 V90 I106 L110 V208 P210 L213	V63-V88 HydrophobicContact CG1-CG2 4.38Å; S64-V88 PolarHBondContact O-N 3.28Å; C65-V88 WeakPolarHBondContact CA-O 3.34Å; C65-V88 HydrophobicContact CB-CB 4.28Å; G66-V88 PolarHBondContact N-O 2.92Å; I86-V88 HydrophobicContact CG2-CG2 4.18Å; V88-V90 HydrophobicContact CG1-CG2 4.48Å; V88-V90 PolarHBondContact O-N 3.06Å; V88-I106 HydrophobicContact CB-CG2 4.23Å; V88-I106 HydrophobicContact CG1-CD1 4.03Å; V88-I106 HydrophobicContact CG1-CG1 4.48Å; V88-I106 HydrophobicContact CG1-CG2 4.03Å; V88-I106 HydrophobicContact CG2-CG2 3.75Å; V88-L110 HydrophobicContact CG2-CD1 3.92Å; V88-V208 CarbonylContact C-O 3.58Å; V88-V208 VanDerWaalsContact CA-O 3.27Å; V88-V208 WeakPolarHBondContact CA-O 3.48Å; V88-P210 HydrophobicContact CG1-CG 3.71Å; V88-L213 HydrophobicContact CG2-CD1 4.43Å
89	E	98	Very high	96.4	Very high	59 Å²	59	40.1 Å²	40.1	28%	0.276	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	118.6	-172.5	-175.2	176.2	-173.2	0	0	110.4	Q68 H87 V208 P210	Q68-E89 PolarHBondContact NE2-OE1 3.2Å; Q68-E89 PolarHBondContact NE2-OE2 3.14Å; Q68-E89 VanDerWaalsContact NE2-OE2 3.17Å; H87-E89 PolarHBondContact O-N 3.31Å; E89-V208 PolarHBondContact N-O 3.05Å; E89-P210 WeakPolarHBondContact O-CD 3.38Å
90	V	97.4	Very high	96.4	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.03	23%	0.23	C	C	.	.			trans	-134.9	128.2	175.4	-170.7	0	0	0	0	107.9	G66 P67 V88 D94 L98 P210 L217	G66-V90 CarbonylContact C-O 3.55Å; G66-V90 PolarHBondContact O-N 3.42Å; P67-V90 VanDerWaalsContact CA-O 3.27Å; P67-V90 WeakPolarHBondContact CA-O 3.25Å; V88-V90 HydrophobicContact CG1-CG2 4.48Å; V88-V90 PolarHBondContact O-N 3.06Å; V90-D94 HydrophobicContact CG1-CB 3.66Å; V90-L98 HydrophobicContact CB-CD2 4.4Å; V90-L98 HydrophobicContact CG1-CD1 4.4Å; V90-L98 HydrophobicContact CG2-CD1 4.48Å; V90-L98 HydrophobicContact CG2-CD2 4.42Å; V90-P210 HydrophobicContact CG2-CG 3.75Å; V90-L217 HydrophobicContact CG1-CD1 3.93Å; V90-L217 HydrophobicContact CG2-CD1 4.4Å
91	S	94.8	Very high	96.4	Very high	72 Å²	72	43.6 Å²	43.6	50%	0.503	25%	0.246	S	C	.	.			trans	-143.7	169.3	-175.9	61.7	0	0	0	0	111.6
92	G	92.2	Very high	96.5	Very high	50 Å²	50	43.1 Å²	43.1	52%	0.515	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-142	-178.5	0	0	0	0	0	112.5	D94 Y95 E96	G92-D94 VanDerWaalsContact C-N 3.25Å; G92-D94 PolarHBondContact O-N 3.41Å; G92-Y95 WeakPolarHBondContact O-CB 3.4Å; G92-Y95 PolarHBondContact O-N 3.37Å; G92-E96 PolarHBondContact O-N 2.91Å
93	N	90.3	Very high	96.5	Very high	112 Å²	112	44.6 Å²	44.6	60%	0.599	25%	0.248	S	C	*	.	H	α-helix	trans	-60.3	-32.4	-176.2	-170.2	64	0	0	0	113.6	Y95 E96 T97	N93-Y95 PolarHBondContact O-N 2.96Å; N93-E96 PolarHBondContact O-N 3.49Å; N93-T97 PolarHBondContact O-N 3.32Å; N93-T97 VanDerWaalsContact O-N 3.15Å; N93-T97 PolarHBondContact O-OG1 3.29Å
94	D	93.8	Very high	96.5	Very high	79 Å²	79	41.8 Å²	41.8	42%	0.422	23%	0.233	S	C	.	.	H	α-helix	trans	-66.9	-29.2	176.5	-74.9	-15.1	0	0	0	111.8	V90 G92 L98 L217	V90-D94 HydrophobicContact CG1-CB 3.66Å; G92-D94 VanDerWaalsContact C-N 3.25Å; G92-D94 PolarHBondContact O-N 3.41Å; D94-L98 WeakPolarHBondContact O-CB 3.35Å; D94-L98 PolarHBondContact O-N 2.97Å; D94-L217 HydrophobicContact CB-CD1 3.8Å
95	Y	95	Very high	96.6	Very high	76 Å²	76	42.7 Å²	42.7	30%	0.298	24%	0.238	S	C	.	.	H	α-helix	trans	-78.7	-40.4	175.8	178.5	-116	0	0	0	111.8	P67 G92 N93 T97 L98	P67-Y95 HydrophobicContact CG-CD1 4.34Å; P67-Y95 HydrophobicContact CG-CE1 3.99Å; P67-Y95 HydrophobicContact CG-CE2 4.36Å; G92-Y95 WeakPolarHBondContact O-CB 3.4Å; G92-Y95 PolarHBondContact O-N 3.37Å; N93-Y95 PolarHBondContact O-N 2.96Å; Y95-T97 PolarHBondContact O-N 2.95Å; Y95-L98 HydrophobicContact CD2-CB 4.46Å; Y95-L98 HydrophobicContact CD2-CD2 4.1Å; Y95-L98 HydrophobicContact CE2-CD2 4.47Å; Y95-L98 VanDerWaalsContact O-CB 3.26Å; Y95-L98 WeakPolarHBondContact O-CB 3.36Å; Y95-L98 PolarHBondContact O-N 2.83Å; Y95-L98 VanDerWaalsContact O-N 3.1Å
96	E	91.7	Very high	96.6	Very high	154 Å²	154	42.7 Å²	42.7	72%	0.72	24%	0.238	S	C	*	.	H	α-helix	trans	-61	-30.7	177.1	-67.6	178.5	-178.3	0	0	112.4	G92 N93	G92-E96 PolarHBondContact O-N 2.91Å; N93-E96 PolarHBondContact O-N 3.49Å
97	T	94	Very high	96.6	Very high	47 Å²	47	42.7 Å²	42.7	29%	0.288	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	8.5	177.9	59.8	0	0	0	0	113.7	N93 Y95 G99	N93-T97 PolarHBondContact O-N 3.32Å; N93-T97 VanDerWaalsContact O-N 3.15Å; N93-T97 PolarHBondContact O-OG1 3.29Å; Y95-T97 PolarHBondContact O-N 2.95Å; T97-G99 PolarHBondContact O-N 2.8Å
98	L	97.2	Very high	96.6	Very high	30 Å²	30	43.1 Å²	43.1	16%	0.157	24%	0.241	C	C	.	.			trans	-72.9	102	-178	-170.5	71	0	0	0	110.7	C65 V90 D94 Y95 Q102 V103 L217	C65-L98 HydrophobicContact CB-CD2 4.07Å; V90-L98 HydrophobicContact CB-CD2 4.4Å; V90-L98 HydrophobicContact CG1-CD1 4.4Å; V90-L98 HydrophobicContact CG2-CD1 4.48Å; V90-L98 HydrophobicContact CG2-CD2 4.42Å; D94-L98 WeakPolarHBondContact O-CB 3.35Å; D94-L98 PolarHBondContact O-N 2.97Å; Y95-L98 HydrophobicContact CD2-CB 4.46Å; Y95-L98 HydrophobicContact CD2-CD2 4.1Å; Y95-L98 HydrophobicContact CE2-CD2 4.47Å; Y95-L98 VanDerWaalsContact O-CB 3.26Å; Y95-L98 WeakPolarHBondContact O-CB 3.36Å; Y95-L98 PolarHBondContact O-N 2.83Å; Y95-L98 VanDerWaalsContact O-N 3.1Å; L98-Q102 HydrophobicContact CD1-CB 3.58Å; L98-Q102 HydrophobicContact CD1-CG 4.32Å; L98-V103 HydrophobicContact CD1-CG2 4.34Å; L98-V103 HydrophobicContact CD2-CG2 4.24Å; L98-V103 HydrophobicContact CG-CG2 4.03Å; L98-L217 HydrophobicContact CD1-CD2 4.19Å
99	G	97.5	Very high	96.6	Very high	19 Å²	19	44.2 Å²	44.2	20%	0.196	25%	0.25	C	S	.	.			trans	-107.8	-179.2	179.1	0	0	0	0	0	114.7	T97 L101 Q102 V103	T97-G99 PolarHBondContact O-N 2.8Å; G99-L101 PolarHBondContact O-N 3.11Å; G99-L101 VanDerWaalsContact O-N 3.17Å; G99-Q102 PolarHBondContact O-N 2.78Å; G99-Q102 VanDerWaalsContact O-N 3.16Å; G99-Q102 PolarHBondContact O-OE1 3.22Å; G99-V103 WeakPolarHBondContact O-CG2 3.3Å; G99-V103 PolarHBondContact O-N 2.77Å; G99-V103 VanDerWaalsContact O-N 3.11Å
100	P	98.5	Very high	96.6	Very high	14 Å²	14	41.4 Å²	41.4	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-54.4	-33.1	177.4	-30.2	37.8	0	0	0	114.5	S104 C130 Q132 T133 M136	P100-S104 VanDerWaalsContact O-CB 3.22Å; P100-S104 WeakPolarHBondContact O-CB 3.38Å; P100-S104 PolarHBondContact O-N 2.75Å; P100-S104 PolarHBondContact O-OG 2.71Å; P100-C130 HydrophobicContact CG-CB 3.75Å; P100-Q132 HydrophobicContact CB-CB 3.68Å; P100-Q132 HydrophobicContact CG-CB 4.04Å; P100-T133 WeakPolarHBondContact CB-OG1 3.5Å; P100-M136 HydrophobicContact CB-SD 3.91Å
101	L	98.5	Very high	96.6	Very high	72 Å²	72	41.2 Å²	41.2	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-46.1	178	179.1	60.4	0	0	0	112.2	G99 S104 K105 M136	G99-L101 PolarHBondContact O-N 3.11Å; G99-L101 VanDerWaalsContact O-N 3.17Å; L101-S104 WeakPolarHBondContact CA-OG 3.28Å; L101-S104 PolarHBondContact O-OG 3.25Å; L101-K105 WeakPolarHBondContact O-CG 3.32Å; L101-K105 PolarHBondContact O-N 3.17Å; L101-K105 VanDerWaalsContact O-N 3.15Å; L101-M136 HydrophobicContact CB-CE 3.77Å; L101-M136 HydrophobicContact CD1-CE 3.47Å; L101-M136 VanDerWaalsContact CD1-CE 3.47Å; L101-M136 HydrophobicContact CG-CE 4.18Å
102	Q	98.4	Very high	96.7	Very high	5 Å²	5	45 Å²	45	2%	0.023	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-46.3	179.2	-69.3	77.7	7.2	0	0	110.4	L98 G99 S104 K105 I106 L217	L98-Q102 HydrophobicContact CD1-CB 3.58Å; L98-Q102 HydrophobicContact CD1-CG 4.32Å; G99-Q102 PolarHBondContact O-N 2.78Å; G99-Q102 VanDerWaalsContact O-N 3.16Å; G99-Q102 PolarHBondContact O-OE1 3.22Å; Q102-S104 VanDerWaalsContact C-N 3.34Å; Q102-S104 PolarHBondContact O-N 2.79Å; Q102-K105 PolarHBondContact O-N 3.11Å; Q102-I106 WeakPolarHBondContact O-CG1 3.31Å; Q102-I106 PolarHBondContact O-N 3.23Å; Q102-L217 HydrophobicContact CB-CD2 3.97Å; Q102-L217 HydrophobicContact CG-CB 4.26Å; Q102-L217 HydrophobicContact CG-CD2 4.09Å; Q102-L217 VanDerWaalsContact CG-O 3.24Å; Q102-L217 WeakPolarHBondContact CG-O 3.43Å; Q102-L217 PolarHBondContact NE2-O 3.2Å
103	V	98.6	Very high	96.9	Very high	31 Å²	31	48.5 Å²	48.5	19%	0.188	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-42.4	178.7	179.2	0	0	0	0	111	L98 G99 K105 I106 M107 T133	L98-V103 HydrophobicContact CD1-CG2 4.34Å; L98-V103 HydrophobicContact CD2-CG2 4.24Å; L98-V103 HydrophobicContact CG-CG2 4.03Å; G99-V103 WeakPolarHBondContact O-CG2 3.3Å; G99-V103 PolarHBondContact O-N 2.77Å; G99-V103 VanDerWaalsContact O-N 3.11Å; V103-K105 PolarHBondContact O-N 3.16Å; V103-I106 WeakPolarHBondContact O-CB 3.32Å; V103-I106 PolarHBondContact O-N 3.44Å; V103-M107 HydrophobicContact CG1-CG 4.23Å; V103-M107 WeakPolarHBondContact O-CB 3.47Å; V103-M107 VanDerWaalsContact O-CG 3.3Å; V103-M107 WeakPolarHBondContact O-CG 3.4Å; V103-M107 PolarHBondContact O-N 3.29Å; V103-T133 HydrophobicContact CB-CG2 4.01Å; V103-T133 HydrophobicContact CG1-CG2 3.57Å
104	S	98.6	Very high	97.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-37.4	178.1	54.9	0	0	0	0	113.4	P100 L101 Q102 M107 A108 M136 T137	P100-S104 VanDerWaalsContact O-CB 3.22Å; P100-S104 WeakPolarHBondContact O-CB 3.38Å; P100-S104 PolarHBondContact O-N 2.75Å; P100-S104 PolarHBondContact O-OG 2.71Å; L101-S104 WeakPolarHBondContact CA-OG 3.28Å; L101-S104 PolarHBondContact O-OG 3.25Å; Q102-S104 VanDerWaalsContact C-N 3.34Å; Q102-S104 PolarHBondContact O-N 2.79Å; S104-M107 PolarHBondContact O-N 2.72Å; S104-A108 VanDerWaalsContact O-CB 3.31Å; S104-A108 WeakPolarHBondContact O-CB 3.41Å; S104-A108 PolarHBondContact O-N 2.73Å; S104-M136 WeakPolarHBondContact OG-CB 3.42Å; S104-T137 WeakPolarHBondContact CA-OG1 3.25Å; S104-T137 WeakPolarHBondContact CB-OG1 3.44Å
105	K	98.6	Very high	97.3	Very high	69 Å²	69	46.2 Å²	46.2	30%	0.3	23%	0.231	S	C	.	.	H	α-helix	trans	-62.5	-43.5	171.3	-71.6	173.7	-178.4	176.1	0	112.1	L101 Q102 V103 A108 A109 L140 V215	L101-K105 WeakPolarHBondContact O-CG 3.32Å; L101-K105 PolarHBondContact O-N 3.17Å; L101-K105 VanDerWaalsContact O-N 3.15Å; Q102-K105 PolarHBondContact O-N 3.11Å; V103-K105 PolarHBondContact O-N 3.16Å; K105-A108 PolarHBondContact O-N 2.87Å; K105-A109 WeakPolarHBondContact O-CB 3.21Å; K105-A109 PolarHBondContact O-N 3.02Å; K105-L140 HydrophobicContact CB-CD1 4.46Å; K105-L140 HydrophobicContact CG-CD1 3.85Å; K105-V215 HydrophobicContact CB-CG1 3.63Å; K105-V215 HydrophobicContact CB-CG2 4.18Å; K105-V215 HydrophobicContact CD-CG1 4.18Å
106	I	98.7	Very high	97.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-49.2	175.5	-70	163.9	0	0	0	110.4	C65 V88 Q102 V103 A108 A109 L110 P210 L213 V215 L217	C65-I106 HydrophobicContact CB-CD1 4.46Å; V88-I106 HydrophobicContact CB-CG2 4.23Å; V88-I106 HydrophobicContact CG1-CD1 4.03Å; V88-I106 HydrophobicContact CG1-CG1 4.48Å; V88-I106 HydrophobicContact CG1-CG2 4.03Å; V88-I106 HydrophobicContact CG2-CG2 3.75Å; Q102-I106 WeakPolarHBondContact O-CG1 3.31Å; Q102-I106 PolarHBondContact O-N 3.23Å; V103-I106 WeakPolarHBondContact O-CB 3.32Å; V103-I106 PolarHBondContact O-N 3.44Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.41Å; I106-A109 PolarHBondContact O-N 3.27Å; I106-L110 HydrophobicContact CG2-CD1 3.87Å; I106-L110 HydrophobicContact CG2-CG 4.41Å; I106-L110 WeakPolarHBondContact O-CB 3.47Å; I106-L110 WeakPolarHBondContact O-CG 3.3Å; I106-L110 PolarHBondContact O-N 3Å; I106-P210 HydrophobicContact CD1-CG 4.19Å; I106-L213 HydrophobicContact CG2-CD1 3.87Å; I106-V215 HydrophobicContact CG1-CB 4.36Å; I106-V215 HydrophobicContact CG1-CG1 4.06Å; I106-V215 HydrophobicContact CG1-CG2 4.37Å; I106-L217 HydrophobicContact CD1-CD2 4.11Å
107	M	98.7	Very high	97.6	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-41	179.2	-70.2	-57.8	-64	0	0	111.8	L6 V63 V103 S104 L110 A111 I119 T137	L6-M107 HydrophobicContact CB-CE 4.19Å; V63-M107 HydrophobicContact CB-CE 4.48Å; V63-M107 HydrophobicContact CB-SD 4.08Å; V63-M107 HydrophobicContact CG1-SD 3.85Å; V103-M107 HydrophobicContact CG1-CG 4.23Å; V103-M107 WeakPolarHBondContact O-CB 3.47Å; V103-M107 VanDerWaalsContact O-CG 3.3Å; V103-M107 WeakPolarHBondContact O-CG 3.4Å; V103-M107 PolarHBondContact O-N 3.29Å; S104-M107 PolarHBondContact O-N 2.72Å; M107-L110 PolarHBondContact O-N 3Å; M107-A111 VanDerWaalsContact O-CB 3.32Å; M107-A111 WeakPolarHBondContact O-CB 3.45Å; M107-A111 PolarHBondContact O-N 3.07Å; M107-I119 HydrophobicContact CE-CG2 3.67Å; M107-T137 HydrophobicContact CB-CG2 3.77Å
108	A	98.6	Very high	97.8	Very high	8 Å²	8	35.8 Å²	35.8	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-43.4	175.8	0	0	0	0	0	112.4	S104 K105 I106 A111 K112 L140 L141	S104-A108 VanDerWaalsContact O-CB 3.31Å; S104-A108 WeakPolarHBondContact O-CB 3.41Å; S104-A108 PolarHBondContact O-N 2.73Å; K105-A108 PolarHBondContact O-N 2.87Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.41Å; A108-A111 PolarHBondContact O-N 3.18Å; A108-K112 PolarHBondContact O-N 2.95Å; A108-L140 HydrophobicContact CB-CB 4.07Å; A108-L141 HydrophobicContact CB-CD1 4.41Å; A108-L141 HydrophobicContact CB-CD2 3.79Å; A108-L141 HydrophobicContact CB-CG 3.79Å
109	A	98.5	Very high	97.8	Very high	23 Å²	23	34.4 Å²	34.4	19%	0.19	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-42.7	176.3	0	0	0	0	0	111.8	K105 I106 K112 K113 L213 V215	K105-A109 WeakPolarHBondContact O-CB 3.21Å; K105-A109 PolarHBondContact O-N 3.02Å; I106-A109 PolarHBondContact O-N 3.27Å; A109-K112 PolarHBondContact O-N 2.87Å; A109-K113 WeakPolarHBondContact O-CB 3.3Å; A109-K113 PolarHBondContact O-N 3.29Å; A109-L213 HydrophobicContact CB-CB 3.95Å; A109-V215 HydrophobicContact CB-CG2 4.1Å
110	L	98.4	Very high	97.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-39.6	175.8	-74.3	174.5	0	0	0	112.3	L6 V63 I86 V88 I106 M107 K112 K113 E114 L213	L6-L110 HydrophobicContact CD1-CB 4.04Å; V63-L110 HydrophobicContact CG1-CD1 3.46Å; V63-L110 VanDerWaalsContact CG1-CD1 3.46Å; V63-L110 HydrophobicContact CG2-CD1 4.31Å; I86-L110 HydrophobicContact CD1-CD2 4.17Å; I86-L110 HydrophobicContact CG2-CD1 4.35Å; I86-L110 HydrophobicContact CG2-CD2 4.24Å; V88-L110 HydrophobicContact CG2-CD1 3.92Å; I106-L110 HydrophobicContact CG2-CD1 3.87Å; I106-L110 HydrophobicContact CG2-CG 4.41Å; I106-L110 WeakPolarHBondContact O-CB 3.47Å; I106-L110 WeakPolarHBondContact O-CG 3.3Å; I106-L110 PolarHBondContact O-N 3Å; M107-L110 PolarHBondContact O-N 3Å; L110-K112 VanDerWaalsContact C-N 3.28Å; L110-K112 PolarHBondContact O-N 3.09Å; L110-K113 PolarHBondContact O-N 2.84Å; L110-E114 WeakPolarHBondContact O-CB 3.42Å; L110-E114 VanDerWaalsContact O-CG 3.32Å; L110-E114 WeakPolarHBondContact O-CG 3.21Å; L110-E114 PolarHBondContact O-N 3.31Å; L110-L213 HydrophobicContact CD1-CD1 4.43Å; L110-L213 HydrophobicContact CD2-CD1 3.98Å; L110-L213 HydrophobicContact CD2-CD2 3.72Å; L110-L213 HydrophobicContact CG-CD1 3.88Å; L110-L213 HydrophobicContact CG-CD2 4.27Å
111	A	97.9	Very high	97.9	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-42.6	177.3	0	0	0	0	0	111.9	L6 M107 A108 D115 A116 I119 L141 W143	L6-A111 HydrophobicContact CD1-CB 4.12Å; M107-A111 VanDerWaalsContact O-CB 3.32Å; M107-A111 WeakPolarHBondContact O-CB 3.45Å; M107-A111 PolarHBondContact O-N 3.07Å; A108-A111 PolarHBondContact O-N 3.18Å; A111-D115 PolarHBondContact O-N 2.79Å; A111-D115 VanDerWaalsContact O-N 3.09Å; A111-A116 HydrophobicContact CB-CB 4.23Å; A111-A116 PolarHBondContact O-N 3Å; A111-I119 HydrophobicContact CB-CD1 3.67Å; A111-I119 HydrophobicContact CB-CG1 4.36Å; A111-L141 HydrophobicContact CB-CD1 3.91Å; A111-L141 HydrophobicContact CB-CD2 4.32Å; A111-W143 HydrophobicContact CB-CH2 4.02Å
112	K	96.9	Very high	97.9	Very high	151 Å²	151	30.5 Å²	30.5	66%	0.657	15%	0.152	S	C	*	.	H	α-helix	trans	-68.1	-47.7	174.8	-64.5	179	-174.3	-178	0	111.9	A108 A109 L110 E114 D115 L141	A108-K112 PolarHBondContact O-N 2.95Å; A109-K112 PolarHBondContact O-N 2.87Å; L110-K112 VanDerWaalsContact C-N 3.28Å; L110-K112 PolarHBondContact O-N 3.09Å; K112-E114 VanDerWaalsContact C-N 3.28Å; K112-E114 PolarHBondContact O-N 3.19Å; K112-D115 PolarHBondContact O-N 3.38Å; K112-L141 HydrophobicContact CG-CD2 4.2Å
113	K	96.9	Very high	97.9	Very high	123 Å²	123	32.9 Å²	32.9	54%	0.535	16%	0.162	S	C	.	.	H	α-helix	trans	-61.9	-36.2	-179.3	-177	175	-178.8	173.7	0	112.7	A109 L110 L213	A109-K113 WeakPolarHBondContact O-CB 3.3Å; A109-K113 PolarHBondContact O-N 3.29Å; L110-K113 PolarHBondContact O-N 2.84Å; K113-L213 HydrophobicContact CD-CD2 3.94Å
114	E	96.3	Very high	97.9	Very high	26 Å²	26	33.8 Å²	33.8	12%	0.121	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	4	-178.3	-62.3	-70.3	151.5	0	0	112.5	R4 L6 R84 I86 L110 K112 A116	R4-E114 VanDerWaalsContact CD-O 3.28Å; R4-E114 WeakPolarHBondContact CD-O 3.41Å; R4-E114 IonicContact CZ-OE2 3.7Å; R4-E114 PolarHBondContact NH1-O 3.13Å; R4-E114 IonicContact NH1-OE2 2.64Å; R4-E114 PolarHBondContact NH1-OE2 3.26Å; L6-E114 HydrophobicContact CD2-CB 4.17Å; L6-E114 HydrophobicContact CD2-CG 4.33Å; R84-E114 IonicContact CZ-OE2 3.56Å; R84-E114 VanDerWaalsContact CZ-OE2 3.23Å; R84-E114 IonicContact NH1-OE1 3.53Å; R84-E114 IonicContact NH1-OE2 2.7Å; R84-E114 PolarHBondContact NH1-OE2 2.83Å; R84-E114 IonicContact NH2-OE2 2.71Å; R84-E114 PolarHBondContact NH2-OE2 2.8Å; I86-E114 HydrophobicContact CD1-CG 4.03Å; L110-E114 WeakPolarHBondContact O-CB 3.42Å; L110-E114 VanDerWaalsContact O-CG 3.32Å; L110-E114 WeakPolarHBondContact O-CG 3.21Å; L110-E114 PolarHBondContact O-N 3.31Å; K112-E114 VanDerWaalsContact C-N 3.28Å; K112-E114 PolarHBondContact O-N 3.19Å; E114-A116 PolarHBondContact O-N 2.89Å; E114-A116 VanDerWaalsContact O-N 3.15Å
115	D	95.5	Very high	97.9	Very high	117 Å²	117	34.2 Å²	34.2	63%	0.626	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	44.1	-176.3	-169.2	32.9	0	0	0	112.6	A111 K112	A111-D115 PolarHBondContact O-N 2.79Å; A111-D115 VanDerWaalsContact O-N 3.09Å; K112-D115 PolarHBondContact O-N 3.38Å
116	A	96.8	Very high	97.9	Very high	3 Å²	3	33.5 Å²	33.5	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	142.7	-178	0	0	0	0	0	110.4	L6 A111 E114 W143	L6-A116 HydrophobicContact CD1-CB 3.95Å; L6-A116 HydrophobicContact CD2-CB 4.43Å; L6-A116 HydrophobicContact CG-CB 3.65Å; A111-A116 HydrophobicContact CB-CB 4.23Å; A111-A116 PolarHBondContact O-N 3Å; E114-A116 PolarHBondContact O-N 2.89Å; E114-A116 VanDerWaalsContact O-N 3.15Å; A116-W143 WeakPolarHBondContact O-CH2 3.35Å
117	Q	96.3	Very high	97.8	Very high	52 Å²	52	37.3 Å²	37.3	24%	0.243	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-23.3	176.5	-61.6	-60	-54	0	0	111.7	R4 P177 A178	R4-Q117 PolarHBondContact O-N 3.41Å; Q117-P177 CarbonylContact O-C 3.6Å; Q117-P177 WeakPolarHBondContact O-CA 3.39Å; Q117-P177 WeakPolarHBondContact O-CB 3.46Å; Q117-A178 PolarHBondContact O-N 2.93Å; Q117-A178 VanDerWaalsContact O-N 3.12Å
118	I	97.9	Very high	97.8	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	136.5	178.4	-55.5	176.4	0	0	0	108.3	R4 V5 L6 I120 L154 I159 T176 A178 L180	R4-I118 PolarHBondContact O-N 3.19Å; V5-I118 CarbonylContact C-O 3.58Å; V5-I118 VanDerWaalsContact CA-O 3.3Å; V5-I118 WeakPolarHBondContact CA-O 3.24Å; V5-I118 HydrophobicContact CG1-CB 4.46Å; V5-I118 HydrophobicContact CG2-CB 4.25Å; L6-I118 PolarHBondContact N-O 3.43Å; I118-I120 HydrophobicContact CG2-CD1 4.34Å; I118-I120 HydrophobicContact CG2-CG1 3.8Å; I118-L154 HydrophobicContact CD1-CD1 4.44Å; I118-L154 HydrophobicContact CD1-CD2 3.75Å; I118-L154 HydrophobicContact CD1-CG 4.27Å; I118-I159 HydrophobicContact CD1-CD1 3.86Å; I118-I159 HydrophobicContact CG1-CD1 4.12Å; I118-T176 HydrophobicContact CG1-CG2 4.37Å; I118-A178 WeakPolarHBondContact CA-O 3.47Å; I118-L180 HydrophobicContact CG2-CD1 4.15Å; I118-L180 HydrophobicContact CG2-CG 4.42Å
119	I	98.8	Very high	97.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.1	166	-53.9	174	0	0	0	107.7	L6 M107 A111 L121 T137 L141 W143 A178 V179 L180	L6-I119 HydrophobicContact CB-CG1 4.32Å; L6-I119 HydrophobicContact CB-CG2 4.44Å; L6-I119 CarbonylContact O-C 3.57Å; L6-I119 VanDerWaalsContact O-CA 3.31Å; L6-I119 WeakPolarHBondContact O-CA 3.49Å; M107-I119 HydrophobicContact CE-CG2 3.67Å; A111-I119 HydrophobicContact CB-CD1 3.67Å; A111-I119 HydrophobicContact CB-CG1 4.36Å; I119-L121 HydrophobicContact CB-CD1 4.45Å; I119-L121 HydrophobicContact CG2-CD1 3.56Å; I119-L121 HydrophobicContact CG2-CG 4.04Å; I119-T137 HydrophobicContact CD1-CG2 3.69Å; I119-L141 HydrophobicContact CD1-CD1 3.6Å; I119-W143 HydrophobicContact CD1-CZ3 4.01Å; I119-W143 HydrophobicContact CG1-CZ3 3.99Å; I119-A178 PolarHBondContact N-O 3.31Å; I119-V179 HydrophobicContact CB-CG1 4.33Å; I119-V179 HydrophobicContact CB-CG2 4.28Å; I119-V179 HydrophobicContact CD1-CG2 4.2Å; I119-V179 CarbonylContact O-C 3.45Å; I119-V179 WeakPolarHBondContact O-CA 3.41Å; I119-L180 PolarHBondContact O-N 3.43Å
120	I	98.8	Very high	97.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.3	173.9	-47	-175.1	0	0	0	108.4	V5 L6 V7 G8 A44 A48 L51 I118 L180	V5-I120 HydrophobicContact CG1-CD1 4.02Å; V5-I120 HydrophobicContact CG1-CG1 3.89Å; L6-I120 PolarHBondContact O-N 2.89Å; V7-I120 VanDerWaalsContact CA-O 3.3Å; V7-I120 WeakPolarHBondContact CA-O 3.37Å; G8-I120 PolarHBondContact N-O 3.35Å; G8-I120 VanDerWaalsContact N-O 3.08Å; A44-I120 HydrophobicContact CB-CB 4.43Å; A44-I120 HydrophobicContact CB-CG2 3.67Å; A48-I120 HydrophobicContact CB-CD1 4.14Å; L51-I120 HydrophobicContact CD1-CD1 4.21Å; I118-I120 HydrophobicContact CG2-CD1 4.34Å; I118-I120 HydrophobicContact CG2-CG1 3.8Å; I120-L180 WeakPolarHBondContact CA-O 3.27Å; I120-L180 HydrophobicContact CG1-CB 4.47Å; I120-L180 HydrophobicContact CG1-CD1 4.48Å; I120-L180 HydrophobicContact CG2-CB 4.45Å
121	L	98.9	Very high	97.8	Very high	11 Å²	11	46.2 Å²	46.2	6%	0.058	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	165.2	175	-51.3	98.6	0	0	0	109.9	I119 T133 V179 L180 T181 A182	I119-L121 HydrophobicContact CB-CD1 4.45Å; I119-L121 HydrophobicContact CG2-CD1 3.56Å; I119-L121 HydrophobicContact CG2-CG 4.04Å; L121-T133 HydrophobicContact CD2-CG2 3.82Å; L121-V179 HydrophobicContact CD1-CG1 3.46Å; L121-V179 VanDerWaalsContact CD1-CG1 3.46Å; L121-L180 PolarHBondContact N-O 2.79Å; L121-T181 CarbonylContact O-C 3.55Å; L121-T181 VanDerWaalsContact O-CA 3.28Å; L121-T181 WeakPolarHBondContact O-CA 3.46Å; L121-A182 PolarHBondContact O-N 3.37Å
122	G	98.6	Very high	97.8	Very high	10 Å²	10	50.4 Å²	50.4	10%	0.103	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	151.9	162.8	0	0	0	0	0	111.2	F40 Q124	F40-G122 VanDerWaalsContact CB-CA 3.47Å; G122-Q124 VanDerWaalsContact C-N 3.3Å; G122-Q124 PolarHBondContact O-N 3.32Å
123	K	98.3	Very high	97.9	Very high	55 Å²	55	44.7 Å²	44.7	24%	0.239	23%	0.231	C	C	.	.	S	Bend	trans	-50.6	-48.9	172.4	163.4	177.3	164.8	178.7	0	112.7	F40 N131 F148 A182	F40-K123 HydrophobicContact CD1-CB 3.82Å; F40-K123 HydrophobicContact CE1-CB 4.02Å; F40-K123 HydrophobicContact CE1-CD 4.12Å; F40-K123 HydrophobicContact CE1-CG 4.42Å; F40-K123 HydrophobicContact CG-CB 4.44Å; K123-N131 WeakPolarHBondContact CE-OD1 3.37Å; K123-N131 VanDerWaalsContact CG-OD1 3.25Å; K123-N131 WeakPolarHBondContact CG-OD1 3.33Å; K123-N131 WeakPolarHBondContact O-CA 3.23Å; K123-N131 PolarHBondContact O-ND2 3.48Å; K123-F148 HydrophobicContact CB-CD1 4.38Å; K123-F148 HydrophobicContact CD-CD1 3.64Å; K123-F148 HydrophobicContact CD-CE1 3.97Å; K123-F148 HydrophobicContact CG-CD1 3.69Å; K123-F148 HydrophobicContact CG-CE1 3.77Å; K123-A182 WeakPolarHBondContact CB-O 3.5Å; K123-A182 PolarHBondContact N-O 3.07Å
124	Q	98.6	Very high	98	Very high	50 Å²	50	39 Å²	39	23%	0.234	21%	0.207	C	C	.	.			trans	-149.4	167.7	177.9	66.9	-172.3	-6.9	0	0	110.1	N38 F40 G122 N131	N38-Q124 PolarHBondContact ND2-O 3.08Å; F40-Q124 HydrophobicContact CD2-CG 4.03Å; F40-Q124 WeakPolarHBondContact CD2-O 3.44Å; F40-Q124 HydrophobicContact CE2-CG 3.55Å; F40-Q124 HydrophobicContact CZ-CG 3.93Å; G122-Q124 VanDerWaalsContact C-N 3.3Å; G122-Q124 PolarHBondContact O-N 3.32Å; Q124-N131 HydrophobicContact CB-CB 4.02Å
125	A	98.5	Very high	98.1	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.212	C	C	.	.			trans	-102.3	134.9	166.2	0	0	0	0	0	109.1	K10 N38 D127 D129	K10-A125 HydrophobicContact CD-CB 3.55Å; N38-A125 WeakPolarHBondContact OD1-CA 3.49Å; A125-D127 WeakPolarHBondContact CB-OD1 3.36Å; A125-D127 PolarHBondContact O-N 3.3Å; A125-D127 VanDerWaalsContact O-N 3.14Å; A125-D129 VanDerWaalsContact O-CA 3.29Å; A125-D129 WeakPolarHBondContact O-CA 3.36Å; A125-D129 PolarHBondContact O-N 2.86Å
126	I	98.3	Very high	98.3	Very high	53 Å²	53	37.3 Å²	37.3	27%	0.272	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-5.1	-173.2	60.9	170.1	0	0	0	114.8	V12 N38 P39 F40	V12-I126 HydrophobicContact CB-CG1 4.24Å; V12-I126 HydrophobicContact CG2-CD1 3.87Å; V12-I126 HydrophobicContact CG2-CG1 3.77Å; N38-I126 PolarHBondContact OD1-N 2.94Å; P39-I126 HydrophobicContact CG-CD1 4.39Å; F40-I126 HydrophobicContact CD2-CG2 4.34Å; F40-I126 HydrophobicContact CE2-CG2 4.04Å
127	D	97.3	Very high	98.4	Very high	81 Å²	81	37.1 Å²	37.1	43%	0.433	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-40.6	179.4	57.7	-18.8	0	0	0	112.3	K10 V12 A125	K10-D127 VanDerWaalsContact CE-OD2 3.23Å; K10-D127 WeakPolarHBondContact CE-OD2 3.43Å; K10-D127 IonicContact NZ-OD1 3.56Å; K10-D127 PolarHBondContact NZ-OD1 2.84Å; K10-D127 IonicContact NZ-OD2 3.66Å; K10-D127 PolarHBondContact NZ-OD2 2.84Å; V12-D127 HydrophobicContact CB-CB 4.39Å; V12-D127 HydrophobicContact CG1-CB 4.28Å; V12-D127 WeakPolarHBondContact CG1-OD2 3.48Å; A125-D127 WeakPolarHBondContact CB-OD1 3.36Å; A125-D127 PolarHBondContact O-N 3.3Å; A125-D127 VanDerWaalsContact O-N 3.14Å
128	D	97.4	Very high	98.5	Very high	56 Å²	56	34.7 Å²	34.7	30%	0.299	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-15.8	177.8	65.1	38.1	0	0	0	114.1	K10 C130	K10-D128 IonicContact NZ-OD2 3.21Å; K10-D128 PolarHBondContact NZ-OD2 2.72Å; D128-C130 PolarHBondContact O-N 3Å; D128-C130 PolarHBondContact O-SG 3.4Å; D128-C130 WeakPolarHBondContact OD1-CB 3.17Å; D128-C130 PolarHBondContact OD1-N 3.45Å
129	D	98.1	Very high	98.5	Very high	99 Å²	99	38 Å²	38	53%	0.529	21%	0.211	S	C	.	.			trans	43.5	29.9	-176.3	-79	-36.6	0	0	0	114.2	A125	A125-D129 VanDerWaalsContact O-CA 3.29Å; A125-D129 WeakPolarHBondContact O-CA 3.36Å; A125-D129 PolarHBondContact O-N 2.86Å
130	C	98.4	Very high	98.5	Very high	38 Å²	38	41.7 Å²	41.7	26%	0.257	23%	0.231	S	C	.	.			trans	-76.5	-32.7	-167.3	-83	0	0	0	0	113.4	P100 D128 Q132	P100-C130 HydrophobicContact CG-CB 3.75Å; D128-C130 PolarHBondContact O-N 3Å; D128-C130 PolarHBondContact O-SG 3.4Å; D128-C130 WeakPolarHBondContact OD1-CB 3.17Å; D128-C130 PolarHBondContact OD1-N 3.45Å; C130-Q132 VanDerWaalsContact C-N 3.29Å; C130-Q132 HydrophobicContact CB-CB 4.29Å; C130-Q132 HydrophobicContact CB-CG 4.31Å; C130-Q132 VanDerWaalsContact O-CG 3.24Å; C130-Q132 WeakPolarHBondContact O-CG 3.4Å; C130-Q132 PolarHBondContact O-N 3Å; C130-Q132 PolarHBondContact O-NE2 3.19Å
131	N	98.8	Very high	98.5	Very high	29 Å²	29	42.4 Å²	42.4	16%	0.155	23%	0.234	C	C	.	.			trans	47.7	49.1	-173	-160.2	138	0	0	0	112.1	K123 Q124 Q135 F148	K123-N131 WeakPolarHBondContact CE-OD1 3.37Å; K123-N131 VanDerWaalsContact CG-OD1 3.25Å; K123-N131 WeakPolarHBondContact CG-OD1 3.33Å; K123-N131 WeakPolarHBondContact O-CA 3.23Å; K123-N131 PolarHBondContact O-ND2 3.48Å; Q124-N131 HydrophobicContact CB-CB 4.02Å; N131-Q135 PolarHBondContact ND2-NE2 3.07Å; N131-Q135 PolarHBondContact O-NE2 3.28Å; N131-Q135 PolarHBondContact O-OE1 3.15Å; N131-F148 WeakPolarHBondContact ND2-CE1 3.38Å; N131-F148 WeakPolarHBondContact OD1-CE1 3.25Å
132	Q	98.8	Very high	98.5	Very high	88 Å²	88	49.1 Å²	49.1	41%	0.411	27%	0.27	S	S	.	.			trans	-125.6	-39.6	-172.3	-80.1	156.2	29.2	0	0	114	P100 C130 G134 Q135 M136	P100-Q132 HydrophobicContact CB-CB 3.68Å; P100-Q132 HydrophobicContact CG-CB 4.04Å; C130-Q132 VanDerWaalsContact C-N 3.29Å; C130-Q132 HydrophobicContact CB-CB 4.29Å; C130-Q132 HydrophobicContact CB-CG 4.31Å; C130-Q132 VanDerWaalsContact O-CG 3.24Å; C130-Q132 WeakPolarHBondContact O-CG 3.4Å; C130-Q132 PolarHBondContact O-N 3Å; C130-Q132 PolarHBondContact O-NE2 3.19Å; Q132-G134 VanDerWaalsContact C-N 3.28Å; Q132-G134 PolarHBondContact O-N 3.06Å; Q132-G134 VanDerWaalsContact O-N 3.12Å; Q132-Q135 PolarHBondContact O-N 3.28Å; Q132-Q135 VanDerWaalsContact O-N 3.11Å; Q132-Q135 PolarHBondContact O-OE1 3.02Å; Q132-M136 HydrophobicContact CB-CG 4.43Å; Q132-M136 HydrophobicContact CB-SD 4.05Å; Q132-M136 WeakPolarHBondContact O-CG 3.46Å; Q132-M136 PolarHBondContact O-N 3Å
133	T	98.8	Very high	98.5	Very high	32 Å²	32	50.8 Å²	50.8	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-53.6	-41.9	-167.1	-53.2	0	0	0	0	113.2	P100 V103 L121 T137	P100-T133 WeakPolarHBondContact CB-OG1 3.5Å; V103-T133 HydrophobicContact CB-CG2 4.01Å; V103-T133 HydrophobicContact CG1-CG2 3.57Å; L121-T133 HydrophobicContact CD2-CG2 3.82Å; T133-T137 WeakPolarHBondContact O-CB 3.38Å; T133-T137 PolarHBondContact O-N 2.84Å; T133-T137 PolarHBondContact O-OG1 2.9Å
134	G	98.7	Very high	98.5	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-49.3	179.8	0	0	0	0	0	112.8	Q132 M136 T137 A138	Q132-G134 VanDerWaalsContact C-N 3.28Å; Q132-G134 PolarHBondContact O-N 3.06Å; Q132-G134 VanDerWaalsContact O-N 3.12Å; G134-M136 VanDerWaalsContact C-N 3.35Å; G134-M136 PolarHBondContact O-N 3.19Å; G134-T137 PolarHBondContact O-N 3Å; G134-A138 PolarHBondContact O-N 2.9Å
135	Q	98.8	Very high	98.5	Very high	49 Å²	49	51.8 Å²	51.8	23%	0.229	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-39.2	-179.5	-54.3	101	-77.8	0	0	112	N131 Q132 A138 A139 T147	N131-Q135 PolarHBondContact ND2-NE2 3.07Å; N131-Q135 PolarHBondContact O-NE2 3.28Å; N131-Q135 PolarHBondContact O-OE1 3.15Å; Q132-Q135 PolarHBondContact O-N 3.28Å; Q132-Q135 VanDerWaalsContact O-N 3.11Å; Q132-Q135 PolarHBondContact O-OE1 3.02Å; Q135-A138 PolarHBondContact O-N 3.31Å; Q135-A139 PolarHBondContact O-N 2.99Å; Q135-T147 HydrophobicContact CG-CG2 3.69Å
136	M	98.8	Very high	98.5	Very high	58 Å²	58	51.3 Å²	51.3	29%	0.286	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-40	175.4	-64	-176.7	84.5	0	0	111.6	P100 L101 S104 Q132 G134 A138 A139 L140	P100-M136 HydrophobicContact CB-SD 3.91Å; L101-M136 HydrophobicContact CB-CE 3.77Å; L101-M136 HydrophobicContact CD1-CE 3.47Å; L101-M136 VanDerWaalsContact CD1-CE 3.47Å; L101-M136 HydrophobicContact CG-CE 4.18Å; S104-M136 WeakPolarHBondContact OG-CB 3.42Å; Q132-M136 HydrophobicContact CB-CG 4.43Å; Q132-M136 HydrophobicContact CB-SD 4.05Å; Q132-M136 WeakPolarHBondContact O-CG 3.46Å; Q132-M136 PolarHBondContact O-N 3Å; G134-M136 VanDerWaalsContact C-N 3.35Å; G134-M136 PolarHBondContact O-N 3.19Å; M136-A138 VanDerWaalsContact C-N 3.34Å; M136-A138 PolarHBondContact O-N 3.23Å; M136-A139 PolarHBondContact O-N 3.06Å; M136-L140 WeakPolarHBondContact O-CB 3.39Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.33Å; M136-L140 PolarHBondContact O-N 3.39Å
137	T	98.8	Very high	98.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-43.7	176.1	-56.2	0	0	0	0	110.8	S104 M107 I119 T133 G134 L140 L141 V179	S104-T137 WeakPolarHBondContact CA-OG1 3.25Å; S104-T137 WeakPolarHBondContact CB-OG1 3.44Å; M107-T137 HydrophobicContact CB-CG2 3.77Å; I119-T137 HydrophobicContact CD1-CG2 3.69Å; T133-T137 WeakPolarHBondContact O-CB 3.38Å; T133-T137 PolarHBondContact O-N 2.84Å; T133-T137 PolarHBondContact O-OG1 2.9Å; G134-T137 PolarHBondContact O-N 3Å; T137-L140 PolarHBondContact O-N 2.96Å; T137-L141 HydrophobicContact CG2-CD1 3.97Å; T137-L141 WeakPolarHBondContact O-CB 3.46Å; T137-L141 WeakPolarHBondContact O-CG 3.39Å; T137-L141 PolarHBondContact O-N 2.85Å; T137-L141 VanDerWaalsContact O-N 3.14Å; T137-V179 HydrophobicContact CG2-CG2 4.39Å
138	A	98.8	Very high	98.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-47.4	176.4	0	0	0	0	0	111.5	G134 Q135 M136 L140 L141 D142 W143 Q145 V179	G134-A138 PolarHBondContact O-N 2.9Å; Q135-A138 PolarHBondContact O-N 3.31Å; M136-A138 VanDerWaalsContact C-N 3.34Å; M136-A138 PolarHBondContact O-N 3.23Å; A138-L140 PolarHBondContact O-N 2.92Å; A138-L141 PolarHBondContact O-N 2.7Å; A138-D142 PolarHBondContact O-N 2.93Å; A138-W143 PolarHBondContact O-N 3.26Å; A138-Q145 HydrophobicContact CB-CB 3.82Å; A138-V179 HydrophobicContact CB-CB 3.9Å; A138-V179 HydrophobicContact CB-CG2 3.88Å
139	A	98.8	Very high	98.6	Very high	73 Å²	73	45.1 Å²	45.1	60%	0.603	25%	0.245	S	C	*	.	H	α-helix	trans	-62.5	-41.9	178.3	0	0	0	0	0	112.9	Q135 M136 L141 D142	Q135-A139 PolarHBondContact O-N 2.99Å; M136-A139 PolarHBondContact O-N 3.06Å; A139-L141 VanDerWaalsContact C-N 3.26Å; A139-L141 PolarHBondContact O-N 2.83Å; A139-D142 PolarHBondContact O-N 2.84Å
140	L	98.6	Very high	98.6	Very high	79 Å²	79	41.3 Å²	41.3	41%	0.414	23%	0.226	S	C	.	.	H	α-helix	trans	-67.6	-26.1	178.5	-72.1	170.2	0	0	0	113.5	K105 A108 M136 T137 A138	K105-L140 HydrophobicContact CB-CD1 4.46Å; K105-L140 HydrophobicContact CG-CD1 3.85Å; A108-L140 HydrophobicContact CB-CB 4.07Å; M136-L140 WeakPolarHBondContact O-CB 3.39Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.33Å; M136-L140 PolarHBondContact O-N 3.39Å; T137-L140 PolarHBondContact O-N 2.96Å; A138-L140 PolarHBondContact O-N 2.92Å
141	L	98.4	Very high	98.6	Very high	16 Å²	16	44 Å²	44	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-92	-11	176.8	-72.1	172.8	0	0	0	113.4	A108 A111 K112 I119 T137 A138 A139 W143	A108-L141 HydrophobicContact CB-CD1 4.41Å; A108-L141 HydrophobicContact CB-CD2 3.79Å; A108-L141 HydrophobicContact CB-CG 3.79Å; A111-L141 HydrophobicContact CB-CD1 3.91Å; A111-L141 HydrophobicContact CB-CD2 4.32Å; K112-L141 HydrophobicContact CG-CD2 4.2Å; I119-L141 HydrophobicContact CD1-CD1 3.6Å; T137-L141 HydrophobicContact CG2-CD1 3.97Å; T137-L141 WeakPolarHBondContact O-CB 3.46Å; T137-L141 WeakPolarHBondContact O-CG 3.39Å; T137-L141 PolarHBondContact O-N 2.85Å; T137-L141 VanDerWaalsContact O-N 3.14Å; A138-L141 PolarHBondContact O-N 2.7Å; A139-L141 VanDerWaalsContact C-N 3.26Å; A139-L141 PolarHBondContact O-N 2.83Å; L141-W143 HydrophobicContact CB-CB 4.15Å; L141-W143 HydrophobicContact CB-CD2 3.81Å; L141-W143 HydrophobicContact CB-CG 3.62Å; L141-W143 HydrophobicContact CD1-CD2 3.8Å; L141-W143 HydrophobicContact CD1-CE3 3.72Å; L141-W143 HydrophobicContact CD1-CG 4.43Å; L141-W143 HydrophobicContact CD1-CH2 4.08Å; L141-W143 HydrophobicContact CD1-CZ2 4.17Å; L141-W143 HydrophobicContact CD1-CZ3 3.89Å; L141-W143 HydrophobicContact CD2-CZ2 4.43Å; L141-W143 HydrophobicContact CG-CD2 4.37Å; L141-W143 PolarHBondContact O-NE1 2.75Å
142	D	98.5	Very high	98.6	Very high	153 Å²	153	43.1 Å²	43.1	82%	0.818	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	42.8	-165.8	-163.3	35.4	0	0	0	111.9	A138 A139	A138-D142 PolarHBondContact O-N 2.93Å; A139-D142 PolarHBondContact O-N 2.84Å
143	W	98.5	Very high	98.5	Very high	45 Å²	45	41.9 Å²	41.9	17%	0.17	23%	0.229	C	C	.	.			trans	-105.1	146.8	179.9	-71.4	6.9	0	0	0	111.2	A111 A116 I119 A138 L141 P177 V179	A111-W143 HydrophobicContact CB-CH2 4.02Å; A116-W143 WeakPolarHBondContact O-CH2 3.35Å; I119-W143 HydrophobicContact CD1-CZ3 4.01Å; I119-W143 HydrophobicContact CG1-CZ3 3.99Å; A138-W143 PolarHBondContact O-N 3.26Å; L141-W143 HydrophobicContact CB-CB 4.15Å; L141-W143 HydrophobicContact CB-CD2 3.81Å; L141-W143 HydrophobicContact CB-CG 3.62Å; L141-W143 HydrophobicContact CD1-CD2 3.8Å; L141-W143 HydrophobicContact CD1-CE3 3.72Å; L141-W143 HydrophobicContact CD1-CG 4.43Å; L141-W143 HydrophobicContact CD1-CH2 4.08Å; L141-W143 HydrophobicContact CD1-CZ2 4.17Å; L141-W143 HydrophobicContact CD1-CZ3 3.89Å; L141-W143 HydrophobicContact CD2-CZ2 4.43Å; L141-W143 HydrophobicContact CG-CD2 4.37Å; L141-W143 PolarHBondContact O-NE1 2.75Å; W143-P177 HydrophobicContact CD2-CB 3.74Å; W143-P177 HydrophobicContact CD2-CG 3.86Å; W143-P177 VanDerWaalsContact CE2-CG 3.44Å; W143-P177 HydrophobicContact CE3-CB 3.83Å; W143-P177 HydrophobicContact CE3-CG 4.46Å; W143-P177 HydrophobicContact CG-CB 4.5Å; W143-P177 HydrophobicContact CG-CG 4.24Å; W143-P177 HydrophobicContact CH2-CB 3.71Å; W143-P177 HydrophobicContact CH2-CG 4.4Å; W143-P177 HydrophobicContact CZ2-CB 3.6Å; W143-P177 HydrophobicContact CZ2-CG 3.77Å; W143-P177 HydrophobicContact CZ3-CB 3.8Å; W143-V179 HydrophobicContact CB-CG2 4.41Å; W143-V179 HydrophobicContact CE3-CG2 4Å
144	P	98.5	Very high	98.3	Very high	51 Å²	51	41.5 Å²	41.5	33%	0.331	23%	0.226	S	C	.	.			trans	-62.4	151.9	169.1	29.4	-36.6	0	0	0	111.1	I174 N175 P177 A178 V179	P144-I174 HydrophobicContact CB-CB 3.87Å; P144-I174 HydrophobicContact CB-CG2 4.05Å; P144-I174 HydrophobicContact CG-CB 4.19Å; P144-N175 WeakPolarHBondContact CG-O 3.46Å; P144-P177 VanDerWaalsContact CD-O 3.28Å; P144-P177 WeakPolarHBondContact CD-O 3.26Å; P144-A178 HydrophobicContact CG-CB 4.18Å; P144-A178 WeakPolarHBondContact O-CA 3.24Å; P144-V179 PolarHBondContact O-N 3.33Å
145	Q	98.6	Very high	97.9	Very high	75 Å²	75	45.7 Å²	45.7	35%	0.35	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.3	-178.7	65.8	-174.5	-85.4	0	0	112.5	A138 T147 V179	A138-Q145 HydrophobicContact CB-CB 3.82Å; Q145-T147 HydrophobicContact CG-CG2 4.46Å; Q145-V179 CarbonylContact C-O 3.56Å; Q145-V179 WeakPolarHBondContact CA-O 3.42Å
146	G	98.4	Very high	97.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	88.3	169.1	0	0	0	0	0	109.9	V179 L180 T181	G146-V179 PolarHBondContact N-O 3.14Å; G146-L180 WeakPolarHBondContact O-CA 3.48Å; G146-T181 PolarHBondContact O-N 3.2Å
147	T	98.8	Very high	97	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	151.9	-178.4	55.7	0	0	0	0	112.2	Q135 Q145 A149 R163 T181	Q135-T147 HydrophobicContact CG-CG2 3.69Å; Q145-T147 HydrophobicContact CG-CG2 4.46Å; T147-A149 PolarHBondContact O-N 2.73Å; T147-R163 VanDerWaalsContact O-CG 3.26Å; T147-R163 WeakPolarHBondContact O-CG 3.34Å; T147-R163 PolarHBondContact O-NE 3.34Å; T147-R163 PolarHBondContact OG1-NH2 3.03Å; T147-T181 VanDerWaalsContact CA-OG1 3.24Å; T147-T181 WeakPolarHBondContact CA-OG1 3.29Å; T147-T181 HydrophobicContact CG2-CG2 4.24Å
148	F	98.5	Very high	96.8	Very high	49 Å²	49	51.2 Å²	51.2	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60	36.6	177.5	-42	-35.5	0	0	0	112.5	K123 N131 S150 R163 E164 T181	K123-F148 HydrophobicContact CB-CD1 4.38Å; K123-F148 HydrophobicContact CD-CD1 3.64Å; K123-F148 HydrophobicContact CD-CE1 3.97Å; K123-F148 HydrophobicContact CG-CD1 3.69Å; K123-F148 HydrophobicContact CG-CE1 3.77Å; N131-F148 WeakPolarHBondContact ND2-CE1 3.38Å; N131-F148 WeakPolarHBondContact OD1-CE1 3.25Å; F148-S150 PolarHBondContact O-N 2.91Å; F148-R163 WeakPolarHBondContact O-CA 3.23Å; F148-E164 HydrophobicContact CB-CB 4.36Å; F148-E164 WeakPolarHBondContact CB-O 3.41Å; F148-E164 WeakPolarHBondContact CD2-O 3.43Å; F148-E164 PolarHBondContact O-N 3.13Å; F148-T181 PolarHBondContact N-O 3.05Å; F148-T181 VanDerWaalsContact N-O 3.16Å; F148-T181 PolarHBondContact N-OG1 2.86Å; F148-T181 VanDerWaalsContact N-OG1 3.1Å
149	A	98.8	Very high	96.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	123.4	-176.5	0	0	0	0	0	110.4	T147 V152 V161 V162 T181 D183 L186	T147-A149 PolarHBondContact O-N 2.73Å; A149-V152 HydrophobicContact CB-CG2 3.88Å; A149-V161 HydrophobicContact CB-CG1 3.57Å; A149-V162 CarbonylContact C-O 3.51Å; A149-V162 WeakPolarHBondContact CA-O 3.5Å; A149-T181 WeakPolarHBondContact CB-O 3.26Å; A149-T181 PolarHBondContact N-O 3.27Å; A149-D183 WeakPolarHBondContact O-CB 3.44Å; A149-D183 PolarHBondContact O-N 3.5Å; A149-L186 WeakPolarHBondContact O-CB 3.27Å
150	S	98.4	Very high	96.7	Very high	19 Å²	19	52.1 Å²	52.1	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-11.9	168.2	54.6	0	0	0	0	112.9	F148 V162 E164 L186	F148-S150 PolarHBondContact O-N 2.91Å; S150-V162 PolarHBondContact N-O 3.1Å; S150-V162 PolarHBondContact OG-O 3.25Å; S150-E164 WeakPolarHBondContact CB-OE1 3.43Å; S150-E164 PolarHBondContact OG-OE1 2.9Å; S150-E164 VanDerWaalsContact OG-OE1 3.13Å; S150-L186 WeakPolarHBondContact O-CA 3.48Å
151	E	98.5	Very high	96.7	Very high	96 Å²	96	48.4 Å²	48.4	45%	0.449	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.6	166.2	-165.5	-170.4	126	0	0	110.3	V161 V162	E151-V161 WeakPolarHBondContact O-CA 3.14Å; E151-V162 HydrophobicContact CB-CB 3.76Å; E151-V162 HydrophobicContact CB-CG2 3.8Å; E151-V162 PolarHBondContact N-O 3.48Å; E151-V162 PolarHBondContact O-N 3.12Å
152	V	97.9	Very high	96.7	Very high	9 Å²	9	48.3 Å²	48.3	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	124.9	176.5	177.6	0	0	0	0	109.9	A149 L154 I159 L180 L186	A149-V152 HydrophobicContact CB-CG2 3.88Å; V152-L154 HydrophobicContact CG1-CD1 3.84Å; V152-I159 HydrophobicContact CG1-CG2 3.74Å; V152-L180 HydrophobicContact CG1-CD1 3.85Å; V152-L180 HydrophobicContact CG2-CD1 4.13Å; V152-L186 HydrophobicContact CG2-CD1 3.98Å
153	T	97.2	Very high	96.7	Very high	63 Å²	63	43.2 Å²	43.2	39%	0.387	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.1	173.8	-64.1	0	0	0	0	110.1	I159 K160	T153-I159 WeakPolarHBondContact O-CA 3.26Å; T153-K160 PolarHBondContact N-O 2.8Å; T153-K160 PolarHBondContact O-N 2.97Å
154	L	94.4	Very high	96.7	Very high	23 Å²	23	42.5 Å²	42.5	12%	0.12	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.3	173.2	-81.1	61.2	0	0	0	109.5	L51 L56 V57 I118 V152 I159	L51-L154 HydrophobicContact CD1-CD1 3.89Å; L51-L154 HydrophobicContact CD1-CD2 4.43Å; L51-L154 HydrophobicContact CD2-CD1 3.7Å; L51-L154 HydrophobicContact CD2-CD2 4.44Å; L51-L154 HydrophobicContact CG-CD1 4.46Å; L56-L154 HydrophobicContact CB-CD2 4.08Å; L56-L154 HydrophobicContact CD1-CB 4.34Å; V57-L154 HydrophobicContact CG1-CD2 4.13Å; I118-L154 HydrophobicContact CD1-CD1 4.44Å; I118-L154 HydrophobicContact CD1-CD2 3.75Å; I118-L154 HydrophobicContact CD1-CG 4.27Å; V152-L154 HydrophobicContact CG1-CD1 3.84Å; L154-I159 HydrophobicContact CD1-CG2 4.25Å; L154-I159 HydrophobicContact CG-CG1 4.4Å
155	D	89.4	Confident	96.7	Very high	91 Å²	91	43.3 Å²	43.3	49%	0.487	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	92.3	-179.2	173	32.1	0	0	0	108.8	D157 K158 K173	D155-D157 PolarHBondContact O-N 3.25Å; D155-K158 CarbonylContact C-O 3.57Å; D155-K158 PolarHBondContact N-O 3.21Å; D155-K158 PolarHBondContact O-N 2.94Å; D155-K173 IonicContact OD2-NZ 2.83Å; D155-K173 PolarHBondContact OD2-NZ 3.48Å
156	G	88.2	Confident	96.6	Very high	54 Å²	54	48.4 Å²	48.4	56%	0.557	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	-126.2	-174.6	0	0	0	0	0	111.2	M1 K158	M1-G156 VanDerWaalsContact CE-C 3.49Å; M1-G156 WeakPolarHBondContact CE-O 3.42Å; G156-K158 PolarHBondContact O-N 3.38Å
157	D	90.8	Very high	96.6	Very high	95 Å²	95	52.3 Å²	52.3	51%	0.508	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	7.4	177.4	67.7	-28.6	0	0	0	114.5	M1 D155 N175 T176	M1-D157 VanDerWaalsContact CE-CA 3.41Å; M1-D157 HydrophobicContact CE-CB 4.3Å; D155-D157 PolarHBondContact O-N 3.25Å; D157-N175 CarbonylContact O-C 3.54Å; D157-N175 WeakPolarHBondContact O-CA 3.47Å; D157-T176 PolarHBondContact O-N 2.97Å; D157-T176 PolarHBondContact O-OG1 2.95Å; D157-T176 VanDerWaalsContact O-OG1 3.09Å
158	K	95.4	Very high	96.5	Very high	74 Å²	74	53.3 Å²	53.3	32%	0.322	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153	-176.7	-66	176.7	-173.8	-180	0	111.5	D155 G156 K173 I174 N175	D155-K158 CarbonylContact C-O 3.57Å; D155-K158 PolarHBondContact N-O 3.21Å; D155-K158 PolarHBondContact O-N 2.94Å; G156-K158 PolarHBondContact O-N 3.38Å; K158-K173 HydrophobicContact CB-CD 4.3Å; K158-K173 HydrophobicContact CB-CG 4.07Å; K158-K173 HydrophobicContact CD-CD 3.95Å; K158-K173 VanDerWaalsContact CD-CE 3.43Å; K158-K173 HydrophobicContact CD-CG 4.24Å; K158-I174 CarbonylContact C-O 3.49Å; K158-I174 VanDerWaalsContact CA-O 3.24Å; K158-I174 WeakPolarHBondContact CA-O 3.47Å; K158-N175 WeakPolarHBondContact CE-OD1 3.48Å; K158-N175 WeakPolarHBondContact CG-OD1 3.47Å
159	I	97.2	Very high	96.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.1	173.6	-48.3	-177.5	0	0	0	107.3	I118 V152 T153 L154 V161 K173 I174 T176 A178 L180	I118-I159 HydrophobicContact CD1-CD1 3.86Å; I118-I159 HydrophobicContact CG1-CD1 4.12Å; V152-I159 HydrophobicContact CG1-CG2 3.74Å; T153-I159 WeakPolarHBondContact O-CA 3.26Å; L154-I159 HydrophobicContact CD1-CG2 4.25Å; L154-I159 HydrophobicContact CG-CG1 4.4Å; I159-V161 HydrophobicContact CB-CG2 4.41Å; I159-V161 HydrophobicContact CG2-CG2 3.67Å; I159-K173 WeakPolarHBondContact O-CA 3.43Å; I159-I174 HydrophobicContact CB-CG1 3.92Å; I159-I174 PolarHBondContact N-O 2.69Å; I159-I174 PolarHBondContact O-N 3.3Å; I159-T176 HydrophobicContact CD1-CG2 3.87Å; I159-T176 HydrophobicContact CG1-CG2 3.78Å; I159-A178 HydrophobicContact CD1-CB 3.93Å; I159-L180 HydrophobicContact CD1-CD1 4.32Å; I159-L180 HydrophobicContact CG2-CD1 4.41Å
160	K	98.4	Very high	96.5	Very high	93 Å²	93	59.7 Å²	59.7	40%	0.404	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.4	165.1	-174.9	-173.5	178.7	-164.9	0	107.7	T153 T171 I172	T153-K160 PolarHBondContact N-O 2.8Å; T153-K160 PolarHBondContact O-N 2.97Å; K160-T171 HydrophobicContact CD-CG2 4.25Å; K160-T171 HydrophobicContact CG-CG2 3.86Å; K160-I172 WeakPolarHBondContact CA-O 3.46Å
161	V	98.6	Very high	96.5	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.1	-179.4	-173.6	0	0	0	0	108.4	A149 E151 I159 R163 T171 I172 I174 L180	A149-V161 HydrophobicContact CB-CG1 3.57Å; E151-V161 WeakPolarHBondContact O-CA 3.14Å; I159-V161 HydrophobicContact CB-CG2 4.41Å; I159-V161 HydrophobicContact CG2-CG2 3.67Å; V161-R163 HydrophobicContact CG1-CG 3.99Å; V161-T171 WeakPolarHBondContact O-CA 3.46Å; V161-I172 HydrophobicContact CB-CG1 3.99Å; V161-I172 PolarHBondContact N-O 3.31Å; V161-I172 PolarHBondContact O-N 3.02Å; V161-I174 HydrophobicContact CG2-CD1 4.16Å; V161-I174 HydrophobicContact CG2-CG1 4.43Å; V161-L180 HydrophobicContact CG2-CD2 3.72Å
162	V	98.7	Very high	96.5	Very high	14 Å²	14	60 Å²	60	9%	0.085	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.8	166.4	-174.2	0	0	0	0	107.3	A149 S150 E151 L169 E170	A149-V162 CarbonylContact C-O 3.51Å; A149-V162 WeakPolarHBondContact CA-O 3.5Å; S150-V162 PolarHBondContact N-O 3.1Å; S150-V162 PolarHBondContact OG-O 3.25Å; E151-V162 HydrophobicContact CB-CB 3.76Å; E151-V162 HydrophobicContact CB-CG2 3.8Å; E151-V162 PolarHBondContact N-O 3.48Å; E151-V162 PolarHBondContact O-N 3.12Å; V162-L169 HydrophobicContact CG1-CB 4.06Å; V162-L169 HydrophobicContact CG1-CD1 4.21Å; V162-L169 HydrophobicContact CG1-CD2 4.19Å; V162-L169 HydrophobicContact CG1-CG 4.39Å; V162-E170 CarbonylContact C-O 3.54Å; V162-E170 WeakPolarHBondContact CA-O 3.2Å
163	R	98.6	Very high	96.5	Very high	46 Å²	46	65.1 Å²	65.1	17%	0.174	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.6	-173.1	-55.5	174.7	59.8	-142.6	-0.9	110.2	T147 F148 V161 L169 E170 I172	T147-R163 VanDerWaalsContact O-CG 3.26Å; T147-R163 WeakPolarHBondContact O-CG 3.34Å; T147-R163 PolarHBondContact O-NE 3.34Å; T147-R163 PolarHBondContact OG1-NH2 3.03Å; F148-R163 WeakPolarHBondContact O-CA 3.23Å; V161-R163 HydrophobicContact CG1-CG 3.99Å; R163-L169 WeakPolarHBondContact O-CA 3.19Å; R163-E170 IonicContact CZ-OE1 3.31Å; R163-E170 PolarHBondContact N-O 3.36Å; R163-E170 IonicContact NH1-OE1 3.54Å; R163-E170 PolarHBondContact NH1-OE1 3.3Å; R163-E170 PolarHBondContact O-N 3.26Å; R163-I172 HydrophobicContact CG-CG1 4.46Å
164	E	98.4	Very high	96.5	Very high	30 Å²	30	62.9 Å²	62.9	14%	0.14	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	121.2	165.1	-63	-66.4	161.5	0	0	109.5	F148 S150 L169 D183 R185	F148-E164 HydrophobicContact CB-CB 4.36Å; F148-E164 WeakPolarHBondContact CB-O 3.41Å; F148-E164 WeakPolarHBondContact CD2-O 3.43Å; F148-E164 PolarHBondContact O-N 3.13Å; S150-E164 WeakPolarHBondContact CB-OE1 3.43Å; S150-E164 PolarHBondContact OG-OE1 2.9Å; S150-E164 VanDerWaalsContact OG-OE1 3.13Å; E164-L169 HydrophobicContact CG-CD2 4.43Å; E164-L169 WeakPolarHBondContact OE1-CD2 3.42Å; E164-L169 WeakPolarHBondContact OE2-CD2 3.44Å; E164-D183 HydrophobicContact CG-CB 4.39Å; E164-R185 WeakPolarHBondContact OE1-CD 3.4Å; E164-R185 IonicContact OE1-CZ 3.69Å; E164-R185 IonicContact OE1-NE 2.79Å; E164-R185 IonicContact OE1-NH1 3.2Å; E164-R185 PolarHBondContact OE1-NH1 3.47Å; E164-R185 VanDerWaalsContact OE1-NH1 3.09Å; E164-R185 IonicContact OE2-CZ 3.79Å; E164-R185 IonicContact OE2-NH1 2.78Å; E164-R185 PolarHBondContact OE2-NH1 3.25Å; E164-R185 IonicContact OE2-NH2 2.75Å
165	I	98.1	Very high	96.6	Very high	68 Å²	68	66.1 Å²	66.1	35%	0.349	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	166.2	174.3	59.6	161.5	0	0	0	109.3	G167 G168 E170	I165-G167 PolarHBondContact O-N 3.03Å; I165-G167 VanDerWaalsContact O-N 3.11Å; I165-G168 VanDerWaalsContact CG1-O 3.28Å; I165-G168 WeakPolarHBondContact CG1-O 3.46Å; I165-G168 PolarHBondContact N-O 2.79Å; I165-G168 PolarHBondContact O-N 2.96Å; I165-E170 HydrophobicContact CD1-CB 4Å; I165-E170 HydrophobicContact CG1-CB 4.31Å; I165-E170 HydrophobicContact CG2-CB 4.09Å
166	D	97.1	Very high	96.9	Very high	183 Å²	183	63 Å²	63	98%	0.979	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-36.3	-174.3	-62.5	-25.8	0	0	0	113.5
167	G	96.6	Very high	97.3	Very high	81 Å²	81	62.3 Å²	62.3	84%	0.835	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	2.9	-179.5	0	0	0	0	0	115.7	I165	I165-G167 PolarHBondContact O-N 3.03Å; I165-G167 VanDerWaalsContact O-N 3.11Å
168	G	97	Very high	97.7	Very high	31 Å²	31	57.8 Å²	57.8	32%	0.32	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134	-126.3	-177	0	0	0	0	0	113.1	I165	I165-G168 VanDerWaalsContact CG1-O 3.28Å; I165-G168 WeakPolarHBondContact CG1-O 3.46Å; I165-G168 PolarHBondContact N-O 2.79Å; I165-G168 PolarHBondContact O-N 2.96Å
169	L	98.5	Very high	97.8	Very high	110 Å²	110	54.3 Å²	54.3	58%	0.576	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.9	-174.7	-60.8	177.8	0	0	0	111.7	V162 R163 E164	V162-L169 HydrophobicContact CG1-CB 4.06Å; V162-L169 HydrophobicContact CG1-CD1 4.21Å; V162-L169 HydrophobicContact CG1-CD2 4.19Å; V162-L169 HydrophobicContact CG1-CG 4.39Å; R163-L169 WeakPolarHBondContact O-CA 3.19Å; E164-L169 HydrophobicContact CG-CD2 4.43Å; E164-L169 WeakPolarHBondContact OE1-CD2 3.42Å; E164-L169 WeakPolarHBondContact OE2-CD2 3.44Å
170	E	98.5	Very high	97.9	Very high	74 Å²	74	54.4 Å²	54.4	35%	0.346	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.8	171.5	-174.3	-171.6	74.4	0	0	110	V162 R163 I165 I172	V162-E170 CarbonylContact C-O 3.54Å; V162-E170 WeakPolarHBondContact CA-O 3.2Å; R163-E170 IonicContact CZ-OE1 3.31Å; R163-E170 PolarHBondContact N-O 3.36Å; R163-E170 IonicContact NH1-OE1 3.54Å; R163-E170 PolarHBondContact NH1-OE1 3.3Å; R163-E170 PolarHBondContact O-N 3.26Å; I165-E170 HydrophobicContact CD1-CB 4Å; I165-E170 HydrophobicContact CG1-CB 4.31Å; I165-E170 HydrophobicContact CG2-CB 4.09Å; E170-I172 HydrophobicContact CG-CG2 4.13Å; E170-I172 WeakPolarHBondContact OE1-CG2 3.28Å
171	T	98.6	Very high	97.9	Very high	80 Å²	80	50 Å²	50	49%	0.491	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.5	173.5	-61.5	0	0	0	0	110.3	K160 V161	K160-T171 HydrophobicContact CD-CG2 4.25Å; K160-T171 HydrophobicContact CG-CG2 3.86Å; V161-T171 WeakPolarHBondContact O-CA 3.46Å
172	I	98.4	Very high	97.9	Very high	40 Å²	40	50 Å²	50	21%	0.205	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	156.2	173.7	66	168.3	0	0	0	111	K160 V161 R163 E170 I174	K160-I172 WeakPolarHBondContact CA-O 3.46Å; V161-I172 HydrophobicContact CB-CG1 3.99Å; V161-I172 PolarHBondContact N-O 3.31Å; V161-I172 PolarHBondContact O-N 3.02Å; R163-I172 HydrophobicContact CG-CG1 4.46Å; E170-I172 HydrophobicContact CG-CG2 4.13Å; E170-I172 WeakPolarHBondContact OE1-CG2 3.28Å; I172-I174 HydrophobicContact CD1-CG2 3.85Å; I172-I174 HydrophobicContact CG1-CG2 4.38Å
173	K	98.3	Very high	97.9	Very high	117 Å²	117	50.1 Å²	50.1	51%	0.509	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.3	170.8	-163.9	170	-166.7	173.3	0	108.6	D155 K158 I159	D155-K173 IonicContact OD2-NZ 2.83Å; D155-K173 PolarHBondContact OD2-NZ 3.48Å; K158-K173 HydrophobicContact CB-CD 4.3Å; K158-K173 HydrophobicContact CB-CG 4.07Å; K158-K173 HydrophobicContact CD-CD 3.95Å; K158-K173 VanDerWaalsContact CD-CE 3.43Å; K158-K173 HydrophobicContact CD-CG 4.24Å; I159-K173 WeakPolarHBondContact O-CA 3.43Å
174	I	97.9	Very high	97.9	Very high	17 Å²	17	52.5 Å²	52.5	9%	0.087	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.9	-178	61.3	178.9	0	0	0	110.6	P144 K158 I159 V161 I172 A178 L180	P144-I174 HydrophobicContact CB-CB 3.87Å; P144-I174 HydrophobicContact CB-CG2 4.05Å; P144-I174 HydrophobicContact CG-CB 4.19Å; K158-I174 CarbonylContact C-O 3.49Å; K158-I174 VanDerWaalsContact CA-O 3.24Å; K158-I174 WeakPolarHBondContact CA-O 3.47Å; I159-I174 HydrophobicContact CB-CG1 3.92Å; I159-I174 PolarHBondContact N-O 2.69Å; I159-I174 PolarHBondContact O-N 3.3Å; V161-I174 HydrophobicContact CG2-CD1 4.16Å; V161-I174 HydrophobicContact CG2-CG1 4.43Å; I172-I174 HydrophobicContact CD1-CG2 3.85Å; I172-I174 HydrophobicContact CG1-CG2 4.38Å; I174-A178 HydrophobicContact CD1-CB 3.78Å; I174-A178 HydrophobicContact CG1-CB 4.35Å; I174-L180 HydrophobicContact CD1-CD2 3.89Å
175	N	96.9	Very high	97.8	Very high	90 Å²	90	59.1 Å²	59.1	48%	0.481	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	150.1	177.3	-59.3	-33.3	0	0	0	110.5	P144 D157 K158	P144-N175 WeakPolarHBondContact CG-O 3.46Å; D157-N175 CarbonylContact O-C 3.54Å; D157-N175 WeakPolarHBondContact O-CA 3.47Å; K158-N175 WeakPolarHBondContact CE-OD1 3.48Å; K158-N175 WeakPolarHBondContact CG-OD1 3.47Å
176	T	94.2	Very high	97.9	Very high	25 Å²	25	56.8 Å²	56.8	15%	0.153	31%	0.314	C	S	.	.	S	Bend	trans	-78.7	143.1	162.5	52.9	0	0	0	0	110.1	M1 I118 D157 I159	M1-T176 HydrophobicContact CE-CG2 4.2Å; M1-T176 WeakPolarHBondContact CE-OG1 3.37Å; M1-T176 HydrophobicContact SD-CG2 4.37Å; I118-T176 HydrophobicContact CG1-CG2 4.37Å; D157-T176 PolarHBondContact O-N 2.97Å; D157-T176 PolarHBondContact O-OG1 2.95Å; D157-T176 VanDerWaalsContact O-OG1 3.09Å; I159-T176 HydrophobicContact CD1-CG2 3.87Å; I159-T176 HydrophobicContact CG1-CG2 3.78Å
177	P	97.1	Very high	97.9	Very high	41 Å²	41	48.8 Å²	48.8	27%	0.266	27%	0.271	S	S	.	.	S	Bend	cis	-77.4	150.3	3.9	33.4	-37.9	0	0	0	113.5	Q117 W143 P144	Q117-P177 CarbonylContact O-C 3.6Å; Q117-P177 WeakPolarHBondContact O-CA 3.39Å; Q117-P177 WeakPolarHBondContact O-CB 3.46Å; W143-P177 HydrophobicContact CD2-CB 3.74Å; W143-P177 HydrophobicContact CD2-CG 3.86Å; W143-P177 VanDerWaalsContact CE2-CG 3.44Å; W143-P177 HydrophobicContact CE3-CB 3.83Å; W143-P177 HydrophobicContact CE3-CG 4.46Å; W143-P177 HydrophobicContact CG-CB 4.5Å; W143-P177 HydrophobicContact CG-CG 4.24Å; W143-P177 HydrophobicContact CH2-CB 3.71Å; W143-P177 HydrophobicContact CH2-CG 4.4Å; W143-P177 HydrophobicContact CZ2-CB 3.6Å; W143-P177 HydrophobicContact CZ2-CG 3.77Å; W143-P177 HydrophobicContact CZ3-CB 3.8Å; P144-P177 VanDerWaalsContact CD-O 3.28Å; P144-P177 WeakPolarHBondContact CD-O 3.26Å
178	A	98.2	Very high	98	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	159.8	-172.3	0	0	0	0	0	114.1	Q117 I118 I119 P144 I159 I174	Q117-A178 PolarHBondContact O-N 2.93Å; Q117-A178 VanDerWaalsContact O-N 3.12Å; I118-A178 WeakPolarHBondContact CA-O 3.47Å; I119-A178 PolarHBondContact N-O 3.31Å; P144-A178 HydrophobicContact CG-CB 4.18Å; P144-A178 WeakPolarHBondContact O-CA 3.24Å; I159-A178 HydrophobicContact CD1-CB 3.93Å; I174-A178 HydrophobicContact CD1-CB 3.78Å; I174-A178 HydrophobicContact CG1-CB 4.35Å
179	V	98.8	Very high	98	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.9	172.3	-175.4	0	0	0	0	110.4	I119 L121 T137 A138 W143 P144 Q145 G146	I119-V179 HydrophobicContact CB-CG1 4.33Å; I119-V179 HydrophobicContact CB-CG2 4.28Å; I119-V179 HydrophobicContact CD1-CG2 4.2Å; I119-V179 CarbonylContact O-C 3.45Å; I119-V179 WeakPolarHBondContact O-CA 3.41Å; L121-V179 HydrophobicContact CD1-CG1 3.46Å; L121-V179 VanDerWaalsContact CD1-CG1 3.46Å; T137-V179 HydrophobicContact CG2-CG2 4.39Å; A138-V179 HydrophobicContact CB-CB 3.9Å; A138-V179 HydrophobicContact CB-CG2 3.88Å; W143-V179 HydrophobicContact CB-CG2 4.41Å; W143-V179 HydrophobicContact CE3-CG2 4Å; P144-V179 PolarHBondContact O-N 3.33Å; Q145-V179 CarbonylContact C-O 3.56Å; Q145-V179 WeakPolarHBondContact CA-O 3.42Å; G146-V179 PolarHBondContact N-O 3.14Å
180	L	98.8	Very high	97.9	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.6	178.9	-56.5	178.9	0	0	0	110.2	I118 I119 I120 L121 G146 V152 I159 V161 I174	I118-L180 HydrophobicContact CG2-CD1 4.15Å; I118-L180 HydrophobicContact CG2-CG 4.42Å; I119-L180 PolarHBondContact O-N 3.43Å; I120-L180 WeakPolarHBondContact CA-O 3.27Å; I120-L180 HydrophobicContact CG1-CB 4.47Å; I120-L180 HydrophobicContact CG1-CD1 4.48Å; I120-L180 HydrophobicContact CG2-CB 4.45Å; L121-L180 PolarHBondContact N-O 2.79Å; G146-L180 WeakPolarHBondContact O-CA 3.48Å; V152-L180 HydrophobicContact CG1-CD1 3.85Å; V152-L180 HydrophobicContact CG2-CD1 4.13Å; I159-L180 HydrophobicContact CD1-CD1 4.32Å; I159-L180 HydrophobicContact CG2-CD1 4.41Å; V161-L180 HydrophobicContact CG2-CD2 3.72Å; I174-L180 HydrophobicContact CD1-CD2 3.89Å
181	T	98.9	Very high	97.6	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.1	167.6	76.2	0	0	0	0	111.1	L121 G146 T147 F148 A149	L121-T181 CarbonylContact O-C 3.55Å; L121-T181 VanDerWaalsContact O-CA 3.28Å; L121-T181 WeakPolarHBondContact O-CA 3.46Å; G146-T181 PolarHBondContact O-N 3.2Å; T147-T181 VanDerWaalsContact CA-OG1 3.24Å; T147-T181 WeakPolarHBondContact CA-OG1 3.29Å; T147-T181 HydrophobicContact CG2-CG2 4.24Å; F148-T181 PolarHBondContact N-O 3.05Å; F148-T181 VanDerWaalsContact N-O 3.16Å; F148-T181 PolarHBondContact N-OG1 2.86Å; F148-T181 VanDerWaalsContact N-OG1 3.1Å; A149-T181 WeakPolarHBondContact CB-O 3.26Å; A149-T181 PolarHBondContact N-O 3.27Å
182	A	98.8	Very high	97.2	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127	-174.1	0	0	0	0	0	111.7	I43 A44 L121 K123 L186	I43-A182 HydrophobicContact CB-CB 4.36Å; I43-A182 HydrophobicContact CG2-CB 3.85Å; A44-A182 HydrophobicContact CB-CB 4.27Å; L121-A182 PolarHBondContact O-N 3.37Å; K123-A182 WeakPolarHBondContact CB-O 3.5Å; K123-A182 PolarHBondContact N-O 3.07Å; A182-L186 HydrophobicContact CB-CD2 3.6Å
183	D	98.7	Very high	97	Very high	16 Å²	16	55.7 Å²	55.7	9%	0.086	28%	0.275	C	S	.	.			trans	-82.4	162.4	165.5	-174.6	-99.1	0	0	0	111.2	A149 E164 R185 L186	A149-D183 WeakPolarHBondContact O-CB 3.44Å; A149-D183 PolarHBondContact O-N 3.5Å; E164-D183 HydrophobicContact CG-CB 4.39Å; D183-R185 PolarHBondContact O-N 3Å; D183-R185 VanDerWaalsContact O-N 3.14Å; D183-R185 WeakPolarHBondContact OD1-CG 3.48Å; D183-R185 PolarHBondContact OD1-N 3.29Å; D183-L186 WeakPolarHBondContact O-CB 3.46Å; D183-L186 PolarHBondContact O-N 2.89Å
184	L	97.6	Very high	96.8	Very high	96 Å²	96	56.8 Å²	56.8	50%	0.503	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.3	176.3	-66.8	-178.9	0	0	0	113.7	F40 I43	F40-L184 HydrophobicContact CD1-CD2 3.77Å; F40-L184 HydrophobicContact CD1-CG 4.09Å; F40-L184 HydrophobicContact CE1-CD1 4.31Å; F40-L184 HydrophobicContact CE1-CD2 3.63Å; F40-L184 HydrophobicContact CE1-CG 3.52Å; F40-L184 HydrophobicContact CG-CD2 4.34Å; F40-L184 HydrophobicContact CZ-CD1 4.35Å; F40-L184 HydrophobicContact CZ-CD2 4.05Å; F40-L184 HydrophobicContact CZ-CG 4.01Å; I43-L184 VanDerWaalsContact CD1-CA 3.46Å; I43-L184 HydrophobicContact CD1-CB 4.37Å; I43-L184 HydrophobicContact CD1-CD2 3.72Å
185	R	97.9	Very high	96.7	Very high	168 Å²	168	59.7 Å²	59.7	63%	0.634	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-7.9	-176.5	-60.9	-177.5	-163.2	165.9	10.6	114.6	E164 D183 N187	E164-R185 WeakPolarHBondContact OE1-CD 3.4Å; E164-R185 IonicContact OE1-CZ 3.69Å; E164-R185 IonicContact OE1-NE 2.79Å; E164-R185 IonicContact OE1-NH1 3.2Å; E164-R185 PolarHBondContact OE1-NH1 3.47Å; E164-R185 VanDerWaalsContact OE1-NH1 3.09Å; E164-R185 IonicContact OE2-CZ 3.79Å; E164-R185 IonicContact OE2-NH1 2.78Å; E164-R185 PolarHBondContact OE2-NH1 3.25Å; E164-R185 IonicContact OE2-NH2 2.75Å; D183-R185 PolarHBondContact O-N 3Å; D183-R185 VanDerWaalsContact O-N 3.14Å; D183-R185 WeakPolarHBondContact OD1-CG 3.48Å; D183-R185 PolarHBondContact OD1-N 3.29Å; R185-N187 VanDerWaalsContact C-N 3.34Å; R185-N187 PolarHBondContact O-N 3.42Å
186	L	98.4	Very high	96.6	Very high	19 Å²	19	58.4 Å²	58.4	10%	0.099	30%	0.298	C	S	.	.	S	Bend	trans	-60.4	-42.9	-174.6	-176.1	57.2	0	0	0	113.1	I43 E47 A149 S150 V152 A182 D183	I43-L186 HydrophobicContact CG2-CB 3.7Å; I43-L186 HydrophobicContact CG2-CD2 4.16Å; I43-L186 HydrophobicContact CG2-CG 4.31Å; E47-L186 HydrophobicContact CB-CD2 3.97Å; E47-L186 HydrophobicContact CG-CD2 3.94Å; E47-L186 HydrophobicContact CG-CG 4.41Å; A149-L186 WeakPolarHBondContact O-CB 3.27Å; S150-L186 WeakPolarHBondContact O-CA 3.48Å; V152-L186 HydrophobicContact CG2-CD1 3.98Å; A182-L186 HydrophobicContact CB-CD2 3.6Å; D183-L186 WeakPolarHBondContact O-CB 3.46Å; D183-L186 PolarHBondContact O-N 2.89Å
187	N	98.3	Very high	96.7	Very high	16 Å²	16	60.5 Å²	60.5	9%	0.086	31%	0.308	C	S	.	.			trans	-164.5	175.1	178.6	58.3	61.2	0	0	0	111.1	I43 E46 E47 R185	I43-N187 WeakPolarHBondContact CG2-OD1 3.42Å; I43-N187 PolarHBondContact O-ND2 3.1Å; E46-N187 WeakPolarHBondContact CB-OD1 3.16Å; E46-N187 HydrophobicContact CG-CB 4.28Å; E46-N187 WeakPolarHBondContact CG-OD1 3.41Å; E47-N187 PolarHBondContact N-ND2 3.26Å; E47-N187 PolarHBondContact OE2-ND2 2.79Å; E47-N187 VanDerWaalsContact OE2-ND2 3.1Å; R185-N187 VanDerWaalsContact C-N 3.34Å; R185-N187 PolarHBondContact O-N 3.42Å
188	T	97.4	Very high	96.6	Very high	123 Å²	123	64 Å²	64	76%	0.755	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-103.2	117.5	165.4	-51.7	0	0	0	0	108.9
189	P	96.9	Very high	96.4	Very high	31 Å²	31	70.3 Å²	70.3	20%	0.201	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-60.3	138.8	178.6	-24	34	0	0	0	112.3	E42 I43 E46 M80	E42-P189 HydrophobicContact CB-CB 3.96Å; E42-P189 HydrophobicContact CB-CG 3.79Å; I43-P189 HydrophobicContact CB-CG 4.45Å; I43-P189 HydrophobicContact CG1-CG 3.62Å; E46-P189 HydrophobicContact CB-CB 4.39Å; M80-P189 HydrophobicContact CE-CB 4Å
190	R	96.4	Very high	96.3	Very high	79 Å²	79	70.4 Å²	70.4	30%	0.298	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-74.5	149.2	174.5	73.9	-171.4	67	-172.6	-5.3	111.7	E46 E53 M80	E46-R190 IonicContact OE1-CZ 3.59Å; E46-R190 IonicContact OE1-NE 3.61Å; E46-R190 PolarHBondContact OE1-NE 3.42Å; E46-R190 IonicContact OE1-NH2 2.79Å; E46-R190 PolarHBondContact OE1-NH2 3.37Å; E46-R190 WeakPolarHBondContact OE2-CB 3.36Å; E46-R190 WeakPolarHBondContact OE2-CG 3.43Å; E46-R190 IonicContact OE2-CZ 3.61Å; E46-R190 PolarHBondContact OE2-N 3.11Å; E46-R190 VanDerWaalsContact OE2-N 3.11Å; E46-R190 IonicContact OE2-NE 2.75Å; E46-R190 PolarHBondContact OE2-NE 2.91Å; E46-R190 IonicContact OE2-NH2 2.83Å; E53-R190 IonicContact OE1-CZ 2.79Å; E53-R190 IonicContact OE1-NH1 3.23Å; E53-R190 PolarHBondContact OE1-NH1 3.27Å; E53-R190 IonicContact OE1-NH2 2.74Å; E53-R190 IonicContact OE2-CZ 3.41Å; E53-R190 IonicContact OE2-NH1 2.77Å; E53-R190 IonicContact OE2-NH2 2.73Å; E53-R190 PolarHBondContact OE2-NH2 2.79Å; M80-R190 WeakPolarHBondContact O-CD 3.34Å
191	Y	92.3	Very high	96.1	Very high	222 Å²	222	76.8 Å²	76.8	87%	0.871	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-76.7	135.1	166.9	-68.2	-79.4	0	0	0	111	T193	Y191-T193 PolarHBondContact O-N 3.15Å
192	A	91.6	Very high	95.8	Very high	31 Å²	31	85.7 Å²	85.7	26%	0.256	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-72.6	121.8	173.5	0	0	0	0	0	110.7	A79 I197	A79-A192 HydrophobicContact CB-CB 3.64Å; A192-I197 HydrophobicContact CB-CD1 4.4Å; A192-I197 HydrophobicContact CB-CG1 4Å
193	T	93.5	Very high	95.7	Very high	75 Å²	75	88.6 Å²	88.6	46%	0.46	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-73.3	153.1	177.1	64.5	0	0	0	0	111.4	Y191 P195 N196 I197	Y191-T193 PolarHBondContact O-N 3.15Å; T193-P195 VanDerWaalsContact C-CD 3.49Å; T193-P195 VanDerWaalsContact C-N 3.33Å; T193-N196 WeakPolarHBondContact O-CA 3.38Å; T193-N196 WeakPolarHBondContact O-CB 3.23Å; T193-N196 PolarHBondContact O-N 3.39Å; T193-N196 PolarHBondContact OG1-ND2 2.82Å; T193-I197 WeakPolarHBondContact O-CG1 3.16Å; T193-I197 PolarHBondContact O-N 3.17Å
194	L	93.4	Very high	95.5	Very high	139 Å²	139	96.3 Å²	96.3	73%	0.728	46%	0.462	S	S	*	.	H	α-helix	trans	-50.7	-44.3	177	-71.3	172.8	0	0	0	113.4	N196 I197 M198	L194-N196 VanDerWaalsContact C-N 3.31Å; L194-N196 PolarHBondContact O-N 3.39Å; L194-I197 PolarHBondContact O-N 3.09Å; L194-M198 WeakPolarHBondContact O-CG 3.32Å; L194-M198 PolarHBondContact O-N 2.9Å
195	P	96.1	Very high	95.6	Very high	79 Å²	79	92.9 Å²	92.9	51%	0.513	44%	0.444	S	S	.	.	H	α-helix	trans	-59.7	-38.9	174.7	-25.2	35.7	0	0	0	113.4	T193 M198 K199	T193-P195 VanDerWaalsContact C-CD 3.49Å; T193-P195 VanDerWaalsContact C-N 3.33Å; P195-M198 PolarHBondContact O-N 3.33Å; P195-K199 WeakPolarHBondContact O-CG 3.36Å; P195-K199 PolarHBondContact O-N 3.41Å
196	N	95.7	Very high	95.6	Very high	62 Å²	62	87.1 Å²	87.1	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-70.8	-37.7	179.1	-74.2	-6.6	0	0	0	112	A79 T193 L194 M198 K199 A200	A79-N196 WeakPolarHBondContact O-CB 3.32Å; T193-N196 WeakPolarHBondContact O-CA 3.38Å; T193-N196 WeakPolarHBondContact O-CB 3.23Å; T193-N196 PolarHBondContact O-N 3.39Å; T193-N196 PolarHBondContact OG1-ND2 2.82Å; L194-N196 VanDerWaalsContact C-N 3.31Å; L194-N196 PolarHBondContact O-N 3.39Å; N196-M198 VanDerWaalsContact C-N 3.29Å; N196-M198 PolarHBondContact O-N 2.98Å; N196-K199 PolarHBondContact O-N 3.25Å; N196-A200 VanDerWaalsContact O-CB 3.28Å; N196-A200 WeakPolarHBondContact O-CB 3.36Å; N196-A200 PolarHBondContact O-N 2.93Å
197	I	95.5	Very high	95.5	Very high	70 Å²	70	90.4 Å²	90.4	36%	0.359	45%	0.45	S	S	.	.	H	α-helix	trans	-59.5	-43	173	-65.4	168.2	0	0	0	110.3	A79 A192 T193 L194 A200 K201	A79-I197 HydrophobicContact CB-CG1 4.02Å; A192-I197 HydrophobicContact CB-CD1 4.4Å; A192-I197 HydrophobicContact CB-CG1 4Å; T193-I197 WeakPolarHBondContact O-CG1 3.16Å; T193-I197 PolarHBondContact O-N 3.17Å; L194-I197 PolarHBondContact O-N 3.09Å; I197-A200 WeakPolarHBondContact O-CB 3.42Å; I197-A200 PolarHBondContact O-N 2.86Å; I197-K201 PolarHBondContact O-N 3.4Å
198	M	95.2	Very high	95.5	Very high	114 Å²	114	90.4 Å²	90.4	56%	0.562	45%	0.45	S	S	*	.	H	α-helix	trans	-67.4	-39.6	177.6	-66.8	-58.6	-73.6	0	0	112.6	L194 P195 N196 A200 K201	L194-M198 WeakPolarHBondContact O-CG 3.32Å; L194-M198 PolarHBondContact O-N 2.9Å; P195-M198 PolarHBondContact O-N 3.33Å; N196-M198 VanDerWaalsContact C-N 3.29Å; N196-M198 PolarHBondContact O-N 2.98Å; M198-A200 VanDerWaalsContact C-N 3.33Å; M198-K201 PolarHBondContact O-N 2.94Å; M198-K201 HydrophobicContact SD-CD 4.48Å
199	K	94.8	Very high	95.4	Very high	133 Å²	133	90.4 Å²	90.4	58%	0.578	44%	0.44	S	S	*	.	H	α-helix	trans	-65.2	-37.7	172.8	-71.5	174.1	-176.4	176.5	0	111.6	P195 N196 K201 K202 K203	P195-K199 WeakPolarHBondContact O-CG 3.36Å; P195-K199 PolarHBondContact O-N 3.41Å; N196-K199 PolarHBondContact O-N 3.25Å; K199-K201 VanDerWaalsContact C-N 3.26Å; K199-K201 PolarHBondContact O-N 3.3Å; K199-K202 PolarHBondContact O-N 2.92Å; K199-K203 PolarHBondContact O-N 3.18Å
200	A	96.1	Very high	95.4	Very high	3 Å²	3	89.4 Å²	89.4	3%	0.025	43%	0.434	C	S	.	.	H	α-helix	trans	-61.9	-32.4	-179.6	0	0	0	0	0	112.6	R75 L78 A79 N196 I197 M198 K202 K203	R75-A200 PolarHBondContact NH1-O 3.45Å; L78-A200 HydrophobicContact CB-CB 3.89Å; A79-A200 HydrophobicContact CB-CB 3.74Å; N196-A200 VanDerWaalsContact O-CB 3.28Å; N196-A200 WeakPolarHBondContact O-CB 3.36Å; N196-A200 PolarHBondContact O-N 2.93Å; I197-A200 WeakPolarHBondContact O-CB 3.42Å; I197-A200 PolarHBondContact O-N 2.86Å; M198-A200 VanDerWaalsContact C-N 3.33Å; A200-K202 PolarHBondContact O-N 3.27Å; A200-K203 PolarHBondContact O-N 2.85Å
201	K	93.8	Very high	95.4	Very high	135 Å²	135	89.6 Å²	89.6	59%	0.587	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.3	173.3	-69.4	-177.4	178.7	-179.2	0	113.7	R75 I197 M198 K199	R75-K201 PolarHBondContact NH1-O 3.28Å; I197-K201 PolarHBondContact O-N 3.4Å; M198-K201 PolarHBondContact O-N 2.94Å; M198-K201 HydrophobicContact SD-CD 4.48Å; K199-K201 VanDerWaalsContact C-N 3.26Å; K199-K201 PolarHBondContact O-N 3.3Å
202	K	94.3	Very high	95.5	Very high	188 Å²	188	83.9 Å²	83.9	82%	0.817	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-20.4	178.8	-61.2	-177.4	-179.8	-177.3	0	113.3	K199 A200	K199-K202 PolarHBondContact O-N 2.92Å; A200-K202 PolarHBondContact O-N 3.27Å
203	K	95.9	Very high	95.8	Very high	61 Å²	61	83.5 Å²	83.5	27%	0.265	43%	0.43	S	S	.	.	S	Bend	trans	-65.2	144.9	177.2	-70.6	-179.9	177.3	179.4	0	110.2	R75 L78 A82 K199 A200	R75-K203 PolarHBondContact NH1-O 2.98Å; L78-K203 HydrophobicContact CB-CD 4.06Å; L78-K203 HydrophobicContact CD1-CB 4.04Å; L78-K203 HydrophobicContact CD2-CB 4.26Å; L78-K203 HydrophobicContact CD2-CD 3.97Å; L78-K203 HydrophobicContact CG-CD 4.48Å; L78-K203 PolarHBondContact O-NZ 2.82Å; A82-K203 PolarHBondContact O-NZ 3.17Å; K199-K203 PolarHBondContact O-N 3.18Å; A200-K203 PolarHBondContact O-N 2.85Å
204	K	95.2	Very high	95.9	Very high	178 Å²	178	83.4 Å²	83.4	77%	0.774	44%	0.444	S	S	*	.			trans	-75.4	137	-177	-65.4	-176.2	178.9	-178.1	0	110.6	G85	G85-K204 PolarHBondContact N-O 2.71Å
205	I	98.3	Very high	96.1	Very high	25 Å²	25	77.6 Å²	77.6	13%	0.128	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115.6	165.5	-60.4	179.3	0	0	0	105.8	Q71 I74 R75 L78 G85 H87	Q71-I205 HydrophobicContact CB-CD1 4.47Å; I74-I205 HydrophobicContact CB-CD1 4.16Å; I74-I205 HydrophobicContact CD1-CG2 4.21Å; I74-I205 HydrophobicContact CG2-CD1 3.76Å; I74-I205 HydrophobicContact CG2-CG1 3.95Å; I74-I205 HydrophobicContact CG2-CG2 4.46Å; R75-I205 HydrophobicContact CG-CD1 4.01Å; L78-I205 HydrophobicContact CD1-CD1 4.1Å; L78-I205 HydrophobicContact CD1-CG1 3.85Å; G85-I205 WeakPolarHBondContact O-CA 3.22Å; H87-I205 HydrophobicContact CB-CG2 3.73Å
206	A	98.1	Very high	96	Very high	47 Å²	47	78.7 Å²	78.7	39%	0.388	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.4	172.8	0	0	0	0	0	108.7	G85 I86 H87	G85-A206 PolarHBondContact O-N 2.85Å; I86-A206 CarbonylContact C-O 3.53Å; I86-A206 WeakPolarHBondContact CA-O 3.32Å; H87-A206 PolarHBondContact N-O 3.06Å
207	N	97.6	Very high	96	Very high	88 Å²	88	76.4 Å²	76.4	47%	0.471	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.4	171	-69.7	-38.9	0	0	0	108.8	H87	H87-N207 WeakPolarHBondContact CB-OD1 3.38Å; H87-N207 PolarHBondContact ND1-OD1 2.87Å; H87-N207 WeakPolarHBondContact O-CA 3.17Å
208	V	97.2	Very high	96	Very high	15 Å²	15	77.5 Å²	77.5	9%	0.091	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145	-178.9	-176.3	0	0	0	0	108	I86 H87 V88 E89 D212 L213	I86-V208 HydrophobicContact CG2-CB 4.49Å; I86-V208 HydrophobicContact CG2-CG2 3.98Å; H87-V208 PolarHBondContact O-N 3.08Å; V88-V208 CarbonylContact C-O 3.58Å; V88-V208 VanDerWaalsContact CA-O 3.27Å; V88-V208 WeakPolarHBondContact CA-O 3.48Å; E89-V208 PolarHBondContact N-O 3.05Å; V208-D212 HydrophobicContact CG1-CB 3.89Å; V208-L213 HydrophobicContact CG1-CD1 4.19Å; V208-L213 HydrophobicContact CG1-CD2 4.01Å; V208-L213 HydrophobicContact CG1-CG 3.85Å
209	K	96.7	Very high	96	Very high	124 Å²	124	73.9 Å²	73.9	54%	0.539	40%	0.399	S	S	.	.			trans	-98.7	151.2	170.6	-63.3	-177.6	179	-176.6	0	110.2	A211 D212	K209-A211 PolarHBondContact O-N 3.4Å; K209-A211 VanDerWaalsContact O-N 3.15Å; K209-D212 WeakPolarHBondContact CB-OD2 3.4Å; K209-D212 PolarHBondContact N-OD2 2.93Å; K209-D212 WeakPolarHBondContact O-CB 3.4Å; K209-D212 PolarHBondContact O-N 3.04Å
210	P	96.5	Very high	96	Very high	10 Å²	10	77.6 Å²	77.6	7%	0.065	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-54.2	-33.2	173.7	-32.4	41.2	0	0	0	113.9	V88 E89 V90 I106 D212 L213 G214 V215 L217	V88-P210 HydrophobicContact CG1-CG 3.71Å; E89-P210 WeakPolarHBondContact O-CD 3.38Å; V90-P210 HydrophobicContact CG2-CG 3.75Å; I106-P210 HydrophobicContact CD1-CG 4.19Å; P210-D212 VanDerWaalsContact C-N 3.32Å; P210-D212 PolarHBondContact O-N 3.47Å; P210-L213 CarbonylContact O-C 2.93Å; P210-L213 WeakPolarHBondContact O-CA 3.41Å; P210-L213 WeakPolarHBondContact O-CB 3.3Å; P210-L213 PolarHBondContact O-N 3.21Å; P210-G214 PolarHBondContact O-N 3.21Å; P210-V215 HydrophobicContact CB-CB 4.44Å; P210-V215 PolarHBondContact O-N 3.3Å; P210-L217 HydrophobicContact CB-CD1 4.05Å; P210-L217 HydrophobicContact CB-CD2 3.82Å; P210-L217 HydrophobicContact CB-CG 3.96Å; P210-L217 HydrophobicContact CG-CD1 3.85Å; P210-L217 HydrophobicContact CG-CD2 3.98Å; P210-L217 HydrophobicContact CG-CG 4.22Å
211	A	95.6	Very high	95.9	Very high	82 Å²	82	84.5 Å²	84.5	68%	0.678	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-60.6	-37.5	174.2	0	0	0	0	0	113.1	K209 L213 G214	K209-A211 PolarHBondContact O-N 3.4Å; K209-A211 VanDerWaalsContact O-N 3.15Å; A211-L213 PolarHBondContact O-N 3.36Å; A211-G214 PolarHBondContact O-N 3.1Å
212	D	95.3	Very high	96	Very high	102 Å²	102	85.8 Å²	85.8	55%	0.545	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-68.1	-14.6	177.3	-52.1	-35.3	0	0	0	112.4	V208 K209 P210	V208-D212 HydrophobicContact CG1-CB 3.89Å; K209-D212 WeakPolarHBondContact CB-OD2 3.4Å; K209-D212 PolarHBondContact N-OD2 2.93Å; K209-D212 WeakPolarHBondContact O-CB 3.4Å; K209-D212 PolarHBondContact O-N 3.04Å; P210-D212 VanDerWaalsContact C-N 3.32Å; P210-D212 PolarHBondContact O-N 3.47Å
213	L	96.4	Very high	96	Very high	24 Å²	24	82.3 Å²	82.3	13%	0.126	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-101.7	0.3	176.1	-59.3	175.6	0	0	0	112.2	V88 I106 A109 L110 K113 V208 P210 A211 V215	V88-L213 HydrophobicContact CG2-CD1 4.43Å; I106-L213 HydrophobicContact CG2-CD1 3.87Å; A109-L213 HydrophobicContact CB-CB 3.95Å; L110-L213 HydrophobicContact CD1-CD1 4.43Å; L110-L213 HydrophobicContact CD2-CD1 3.98Å; L110-L213 HydrophobicContact CD2-CD2 3.72Å; L110-L213 HydrophobicContact CG-CD1 3.88Å; L110-L213 HydrophobicContact CG-CD2 4.27Å; K113-L213 HydrophobicContact CD-CD2 3.94Å; V208-L213 HydrophobicContact CG1-CD1 4.19Å; V208-L213 HydrophobicContact CG1-CD2 4.01Å; V208-L213 HydrophobicContact CG1-CG 3.85Å; P210-L213 CarbonylContact O-C 2.93Å; P210-L213 WeakPolarHBondContact O-CA 3.41Å; P210-L213 WeakPolarHBondContact O-CB 3.3Å; P210-L213 PolarHBondContact O-N 3.21Å; A211-L213 PolarHBondContact O-N 3.36Å; L213-V215 HydrophobicContact CB-CG2 3.99Å; L213-V215 PolarHBondContact O-N 3.47Å
214	G	96.4	Very high	96	Very high	73 Å²	73	86.5 Å²	86.5	75%	0.753	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	24.1	-174.7	0	0	0	0	0	113.6	P210 A211	P210-G214 PolarHBondContact O-N 3.21Å; A211-G214 PolarHBondContact O-N 3.1Å
215	V	96.8	Very high	96.1	Very high	17 Å²	17	85.8 Å²	85.8	10%	0.103	47%	0.471	C	S	.	.			trans	-99.3	122.7	-176.9	179	0	0	0	0	110.9	K105 I106 A109 P210 L213 L217	K105-V215 HydrophobicContact CB-CG1 3.63Å; K105-V215 HydrophobicContact CB-CG2 4.18Å; K105-V215 HydrophobicContact CD-CG1 4.18Å; I106-V215 HydrophobicContact CG1-CB 4.36Å; I106-V215 HydrophobicContact CG1-CG1 4.06Å; I106-V215 HydrophobicContact CG1-CG2 4.37Å; A109-V215 HydrophobicContact CB-CG2 4.1Å; P210-V215 HydrophobicContact CB-CB 4.44Å; P210-V215 PolarHBondContact O-N 3.3Å; L213-V215 HydrophobicContact CB-CG2 3.99Å; L213-V215 PolarHBondContact O-N 3.47Å; V215-L217 HydrophobicContact CG1-CD2 4.35Å
216	N	94.8	Very high	96	Very high	102 Å²	102	86.7 Å²	86.7	55%	0.545	48%	0.477	S	S	.	.			trans	-84.6	126.9	167.9	-175	-1.3	0	0	0	110.7	T218	N216-T218 PolarHBondContact ND2-OG1 3.18Å; N216-T218 PolarHBondContact OD1-N 3.2Å; N216-T218 PolarHBondContact OD1-OG1 3.18Å
217	L	95.9	Very high	96	Very high	14 Å²	14	89.1 Å²	89.1	7%	0.073	48%	0.48	C	S	.	.			trans	-86.3	-8.1	-179.8	-58.3	179.3	0	0	0	114.6	V90 D94 L98 Q102 I106 P210 V215 S219	V90-L217 HydrophobicContact CG1-CD1 3.93Å; V90-L217 HydrophobicContact CG2-CD1 4.4Å; D94-L217 HydrophobicContact CB-CD1 3.8Å; L98-L217 HydrophobicContact CD1-CD2 4.19Å; Q102-L217 HydrophobicContact CB-CD2 3.97Å; Q102-L217 HydrophobicContact CG-CB 4.26Å; Q102-L217 HydrophobicContact CG-CD2 4.09Å; Q102-L217 VanDerWaalsContact CG-O 3.24Å; Q102-L217 WeakPolarHBondContact CG-O 3.43Å; Q102-L217 PolarHBondContact NE2-O 3.2Å; I106-L217 HydrophobicContact CD1-CD2 4.11Å; P210-L217 HydrophobicContact CB-CD1 4.05Å; P210-L217 HydrophobicContact CB-CD2 3.82Å; P210-L217 HydrophobicContact CB-CG 3.96Å; P210-L217 HydrophobicContact CG-CD1 3.85Å; P210-L217 HydrophobicContact CG-CD2 3.98Å; P210-L217 HydrophobicContact CG-CG 4.22Å; V215-L217 HydrophobicContact CG1-CD2 4.35Å; L217-S219 PolarHBondContact O-N 3.07Å
218	T	95.8	Very high	95.9	Very high	93 Å²	93	90.3 Å²	90.3	57%	0.571	49%	0.487	S	S	*	.			trans	-46.9	118.3	-177.4	-55	0	0	0	0	111.8	N216	N216-T218 PolarHBondContact ND2-OG1 3.18Å; N216-T218 PolarHBondContact OD1-N 3.2Å; N216-T218 PolarHBondContact OD1-OG1 3.18Å
219	S	94.7	Very high	95.8	Very high	38 Å²	38	94.5 Å²	94.5	27%	0.266	51%	0.514	S	S	.	.			trans	-85.7	142.8	172.5	-175	0	0	0	0	110.5	L217 L221	L217-S219 PolarHBondContact O-N 3.07Å; S219-L221 PolarHBondContact OG-N 2.79Å; S219-L221 PolarHBondContact OG-O 3.07Å
220	K	94	Very high	95.7	Very high	210 Å²	210	94.8 Å²	94.8	91%	0.913	53%	0.529	S	S	*	.	S	Bend	trans	-102.9	8.6	166.3	-63	-175.1	179.7	-178.6	0	111.9
221	L	95.8	Very high	95.5	Very high	149 Å²	149	103.2 Å²	103.2	78%	0.78	57%	0.567	S	S	*	*			trans	-112.1	138.2	176.3	-63.1	177.8	0	0	0	108.7	S219	S219-L221 PolarHBondContact OG-N 2.79Å; S219-L221 PolarHBondContact OG-O 3.07Å
222	E	94.2	Very high	95.5	Very high	162 Å²	162	111 Å²	111	76%	0.757	58%	0.579	S	S	*	*			trans	-127.5	128.7	176.9	-175.8	178.7	-176.5	0	0	108.5	L224	E222-L224 HydrophobicContact CG-CD2 4.2Å; E222-L224 PolarHBondContact O-N 2.95Å
223	V	95.2	Very high	95.3	Very high	115 Å²	115	114.6 Å²	114.6	70%	0.697	59%	0.593	S	S	*	*			trans	-85.6	106.5	174.4	178.8	0	0	0	0	107.6	V226	V223-V226 HydrophobicContact CG1-CG2 3.78Å
224	L	96.3	Very high	95.2	Very high	148 Å²	148	118.4 Å²	118.4	78%	0.775	63%	0.627	S	S	*	*			trans	-73.6	-36.2	-177.8	-59.8	179.9	0	0	0	112.6	E222	E222-L224 HydrophobicContact CG-CD2 4.2Å; E222-L224 PolarHBondContact O-N 2.95Å
225	R	96.2	Very high	95	Very high	164 Å²	164	118.7 Å²	118.7	62%	0.619	63%	0.631	S	S	*	*			trans	-163.7	150.9	-178.2	59.9	-175.5	-178	158.5	-4	112	N25 E227	N25-R225 CarbonylContact O-C 3.54Å; N25-R225 WeakPolarHBondContact O-CA 3.47Å; R225-E227 WeakPolarHBondContact CD-OE1 3.32Å; R225-E227 IonicContact CZ-OE1 2.86Å; R225-E227 IonicContact CZ-OE2 3.51Å; R225-E227 IonicContact NE-OE1 2.92Å; R225-E227 IonicContact NE-OE2 2.72Å; R225-E227 IonicContact NH1-OE1 3.23Å; R225-E227 PolarHBondContact NH1-OE1 3.33Å; R225-E227 IonicContact NH1-OE2 2.65Å; R225-E227 PolarHBondContact NH1-OE2 3.48Å
226	V	97.3	Very high	94.8	Very high	43 Å²	43	124 Å²	124	26%	0.261	66%	0.656	S	S	.	*			trans	-124.9	123.2	169.2	-179.3	0	0	0	0	107.2	V21 N25 V223	V21-V226 HydrophobicContact CG1-CG1 4.22Å; V21-V226 WeakPolarHBondContact CG1-O 3.48Å; V21-V226 HydrophobicContact CG2-CG1 4.29Å; N25-V226 VanDerWaalsContact CA-O 3.29Å; N25-V226 WeakPolarHBondContact CA-O 3.33Å; N25-V226 VanDerWaalsContact CB-O 3.26Å; N25-V226 WeakPolarHBondContact CB-O 3.2Å; N25-V226 PolarHBondContact O-N 3.28Å; N25-V226 PolarHBondContact OD1-O 3.07Å; V223-V226 HydrophobicContact CG1-CG2 3.78Å
227	E	97.2	Very high	94.8	Very high	98 Å²	98	129 Å²	129	46%	0.458	67%	0.673	S	S	.	*			trans	-128.8	152.9	-174.6	-67.1	176.2	163.1	0	0	109.9	R225	R225-E227 WeakPolarHBondContact CD-OE1 3.32Å; R225-E227 IonicContact CZ-OE1 2.86Å; R225-E227 IonicContact CZ-OE2 3.51Å; R225-E227 IonicContact NE-OE1 2.92Å; R225-E227 IonicContact NE-OE2 2.72Å; R225-E227 IonicContact NH1-OE1 3.23Å; R225-E227 PolarHBondContact NH1-OE1 3.33Å; R225-E227 IonicContact NH1-OE2 2.65Å; R225-E227 PolarHBondContact NH1-OE2 3.48Å
228	D	95.3	Very high	94.8	Very high	114 Å²	114	130.8 Å²	130.8	61%	0.61	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-62.3	141.4	170.6	-79.1	-60.2	0	0	0	110.1
229	P	95.1	Very high	94.8	Very high	103 Å²	103	135.5 Å²	135.5	67%	0.669	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-62.9	155	173.1	28.8	-35	0	0	0	110.2	Q231	P229-Q231 PolarHBondContact O-N 3.39Å
230	P	94.3	Very high	94.9	Very high	130 Å²	130	136.5 Å²	136.5	84%	0.844	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-51.8	127.4	175.1	-25.8	33.7	0	0	0	111.3	R232	P230-R232 PolarHBondContact O-N 2.78Å
231	Q	94.1	Very high	95	Very high	187 Å²	187	131.4 Å²	131.4	87%	0.874	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-62.8	124.5	177.4	-69	-172.2	-6.4	0	0	109.6	P229 Q233	P229-Q231 PolarHBondContact O-N 3.39Å; Q231-Q233 PolarHBondContact O-N 3.21Å
232	R	93.8	Very high	95.1	Very high	244 Å²	244	131.1 Å²	131.1	92%	0.921	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-62.2	131.1	176	-171.2	-178	-177.4	179.7	2.2	109.1	P230	P230-R232 PolarHBondContact O-N 2.78Å
233	Q	93.1	Very high	95.1	Very high	179 Å²	179	127.1 Å²	127.1	84%	0.836	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.9	142.3	172.3	-67.4	-175.9	-2.4	0	0	110.5	Q231 G235	Q231-Q233 PolarHBondContact O-N 3.21Å; Q233-G235 PolarHBondContact O-N 2.72Å
234	A	94.1	Very high	95.2	Very high	103 Å²	103	125.6 Å²	125.6	85%	0.851	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-58	129.8	176.8	0	0	0	0	0	109.9
235	G	91.5	Very high	95.1	Very high	80 Å²	80	121.5 Å²	121.5	83%	0.825	64%	0.638	S	S	*	*			trans	-75.7	175.9	175.4	0	0	0	0	0	112.2	Q233	Q233-G235 PolarHBondContact O-N 2.72Å
236	M	92.1	Very high	95.1	Very high	128 Å²	128	115 Å²	115	63%	0.631	62%	0.621	S	S	*	*			trans	-108.6	151.5	170.3	73.6	-171.4	-65.9	0	0	111	V238 K247	M236-V238 HydrophobicContact CE-CG1 4.09Å; M236-V238 HydrophobicContact CG-CG1 4.27Å; M236-V238 HydrophobicContact SD-CG1 4.47Å; M236-K247 HydrophobicContact CE-CD 4.04Å; M236-K247 HydrophobicContact CE-CG 4.3Å; M236-K247 HydrophobicContact SD-CD 3.75Å; M236-K247 HydrophobicContact SD-CG 4.01Å
237	K	95.1	Very high	94.9	Very high	208 Å²	208	117 Å²	117	90%	0.904	63%	0.627	S	S	*	*			trans	-96.5	139.4	166.2	-64.5	-176.9	-179.5	-178.5	0	108.1
238	V	95.3	Very high	94.8	Very high	50 Å²	50	115.2 Å²	115.2	30%	0.303	62%	0.62	S	S	.	*			trans	-118.1	147.5	176.4	-66.2	0	0	0	0	108.9	M236 D243 L244 K247	M236-V238 HydrophobicContact CE-CG1 4.09Å; M236-V238 HydrophobicContact CG-CG1 4.27Å; M236-V238 HydrophobicContact SD-CG1 4.47Å; V238-D243 HydrophobicContact CB-CB 3.95Å; V238-D243 HydrophobicContact CG1-CB 4.24Å; V238-L244 HydrophobicContact CG2-CB 3.77Å; V238-L244 HydrophobicContact CG2-CD1 4.02Å; V238-L244 HydrophobicContact CG2-CG 4.42Å; V238-K247 HydrophobicContact CG1-CG 4.33Å
239	E	95.9	Very high	94.8	Very high	192 Å²	192	116.2 Å²	116.2	90%	0.897	62%	0.619	S	S	*	*	S	Bend	trans	-87.4	-29.2	-173	-62.1	-172.2	168.3	0	0	112.4
240	T	97.4	Very high	94.7	Very high	59 Å²	59	118 Å²	118	36%	0.362	62%	0.618	S	S	.	*	S	Bend	trans	-126.9	163	-173.9	69.5	0	0	0	0	112.5	E242 D243 L244	T240-E242 VanDerWaalsContact C-N 3.3Å; T240-D243 WeakPolarHBondContact OG1-CB 3.15Å; T240-D243 PolarHBondContact OG1-N 3.3Å; T240-D243 PolarHBondContact OG1-OD2 3.26Å; T240-L244 PolarHBondContact O-N 3.25Å
241	V	96.6	Very high	94.5	Very high	103 Å²	103	115.2 Å²	115.2	62%	0.624	60%	0.601	S	S	*	*	H	α-helix	trans	-68.6	-36	174.1	176.5	0	0	0	0	110	L244 V245	V241-L244 WeakPolarHBondContact O-CB 3.26Å; V241-L244 PolarHBondContact O-N 3.37Å; V241-V245 HydrophobicContact CG1-CG2 4.42Å; V241-V245 WeakPolarHBondContact O-CG2 3.44Å; V241-V245 PolarHBondContact O-N 3.22Å
242	E	96.7	Very high	94.2	Very high	144 Å²	144	109.3 Å²	109.3	67%	0.673	59%	0.591	S	S	*	*	H	α-helix	trans	-60.4	-46.2	176.5	-68.1	73.5	-164.5	0	0	111.3	T240 L244 V245 G246	T240-E242 VanDerWaalsContact C-N 3.3Å; E242-L244 VanDerWaalsContact C-N 3.33Å; E242-L244 PolarHBondContact O-N 3.2Å; E242-V245 PolarHBondContact O-N 3.38Å; E242-G246 PolarHBondContact O-N 2.74Å
243	D	95.3	Very high	93.8	Very high	78 Å²	78	105.6 Å²	105.6	42%	0.417	58%	0.582	S	S	.	*	H	α-helix	trans	-62.8	-40.5	175.7	-67.9	-38.1	0	0	0	111.7	V238 T240 G246 K247	V238-D243 HydrophobicContact CB-CB 3.95Å; V238-D243 HydrophobicContact CG1-CB 4.24Å; T240-D243 WeakPolarHBondContact OG1-CB 3.15Å; T240-D243 PolarHBondContact OG1-N 3.3Å; T240-D243 PolarHBondContact OG1-OD2 3.26Å; D243-G246 PolarHBondContact O-N 2.87Å; D243-K247 WeakPolarHBondContact O-CB 3.13Å; D243-K247 VanDerWaalsContact O-CG 3.26Å; D243-K247 WeakPolarHBondContact O-CG 3.29Å; D243-K247 PolarHBondContact O-N 2.8Å
244	L	96.3	Very high	93	Very high	83 Å²	83	103.7 Å²	103.7	44%	0.435	58%	0.582	S	S	.	*	H	α-helix	trans	-60.6	-51.4	176.6	-177.4	59.2	0	0	0	111.1	V238 T240 V241 E242 G246 K247 L248	V238-L244 HydrophobicContact CG2-CB 3.77Å; V238-L244 HydrophobicContact CG2-CD1 4.02Å; V238-L244 HydrophobicContact CG2-CG 4.42Å; T240-L244 PolarHBondContact O-N 3.25Å; V241-L244 WeakPolarHBondContact O-CB 3.26Å; V241-L244 PolarHBondContact O-N 3.37Å; E242-L244 VanDerWaalsContact C-N 3.33Å; E242-L244 PolarHBondContact O-N 3.2Å; L244-G246 VanDerWaalsContact C-N 3.31Å; L244-G246 PolarHBondContact O-N 3.02Å; L244-K247 PolarHBondContact O-N 3.33Å; L244-L248 HydrophobicContact CD1-CD1 4.28Å; L244-L248 HydrophobicContact CD1-CG 4.39Å; L244-L248 HydrophobicContact CG-CD1 4.09Å; L244-L248 VanDerWaalsContact O-CG 3.26Å; L244-L248 WeakPolarHBondContact O-CG 3.39Å; L244-L248 PolarHBondContact O-N 3.33Å
245	V	95.9	Very high	92.9	Very high	62 Å²	62	103.8 Å²	103.8	38%	0.376	57%	0.569	S	S	.	*	H	α-helix	trans	-63	-40.3	179.3	174.1	0	0	0	0	110.6	V241 E242 L248 K249	V241-V245 HydrophobicContact CG1-CG2 4.42Å; V241-V245 WeakPolarHBondContact O-CG2 3.44Å; V241-V245 PolarHBondContact O-N 3.22Å; E242-V245 PolarHBondContact O-N 3.38Å; V245-L248 PolarHBondContact O-N 2.96Å; V245-K249 HydrophobicContact CG1-CD 4.27Å; V245-K249 WeakPolarHBondContact O-CG 3.5Å; V245-K249 PolarHBondContact O-N 3.41Å
246	G	95.5	Very high	93	Very high	27 Å²	27	105 Å²	105	28%	0.278	56%	0.555	S	S	.	*	H	α-helix	trans	-56.7	-51.1	174	0	0	0	0	0	112.1	E242 D243 L244 L248 K249 E250	E242-G246 PolarHBondContact O-N 2.74Å; D243-G246 PolarHBondContact O-N 2.87Å; L244-G246 VanDerWaalsContact C-N 3.31Å; L244-G246 PolarHBondContact O-N 3.02Å; G246-L248 VanDerWaalsContact C-N 3.33Å; G246-L248 PolarHBondContact O-N 2.99Å; G246-K249 PolarHBondContact O-N 3.07Å; G246-E250 WeakPolarHBondContact O-CG 3.29Å; G246-E250 PolarHBondContact O-N 3Å
247	K	93.9	Very high	93	Very high	85 Å²	85	103.7 Å²	103.7	37%	0.37	55%	0.551	S	S	.	*	H	α-helix	trans	-65.1	-33.7	178.6	-68.1	-70.1	158.9	-150.5	0	113.3	M236 V238 D243 L244 E250 S251	M236-K247 HydrophobicContact CE-CD 4.04Å; M236-K247 HydrophobicContact CE-CG 4.3Å; M236-K247 HydrophobicContact SD-CD 3.75Å; M236-K247 HydrophobicContact SD-CG 4.01Å; V238-K247 HydrophobicContact CG1-CG 4.33Å; D243-K247 WeakPolarHBondContact O-CB 3.13Å; D243-K247 VanDerWaalsContact O-CG 3.26Å; D243-K247 WeakPolarHBondContact O-CG 3.29Å; D243-K247 PolarHBondContact O-N 2.8Å; L244-K247 PolarHBondContact O-N 3.33Å; K247-E250 WeakPolarHBondContact CD-OE2 3.38Å; K247-E250 IonicContact NZ-OE1 3.96Å; K247-E250 IonicContact NZ-OE2 3.84Å; K247-E250 PolarHBondContact NZ-OE2 2.66Å; K247-S251 WeakPolarHBondContact O-CB 3.33Å; K247-S251 PolarHBondContact O-N 3.33Å; K247-S251 VanDerWaalsContact O-N 3.09Å; K247-S251 PolarHBondContact O-OG 3.3Å
248	L	95	Very high	92.9	Very high	60 Å²	60	97.6 Å²	97.6	31%	0.314	53%	0.53	S	S	.	.	H	α-helix	trans	-68.6	-40	175.4	-71.3	173.5	0	0	0	112.2	L244 V245 G246 S251 G252 K253 V254	L244-L248 HydrophobicContact CD1-CD1 4.28Å; L244-L248 HydrophobicContact CD1-CG 4.39Å; L244-L248 HydrophobicContact CG-CD1 4.09Å; L244-L248 VanDerWaalsContact O-CG 3.26Å; L244-L248 WeakPolarHBondContact O-CG 3.39Å; L244-L248 PolarHBondContact O-N 3.33Å; V245-L248 PolarHBondContact O-N 2.96Å; G246-L248 VanDerWaalsContact C-N 3.33Å; G246-L248 PolarHBondContact O-N 2.99Å; L248-S251 WeakPolarHBondContact CA-OG 3.42Å; L248-S251 PolarHBondContact O-N 2.8Å; L248-S251 PolarHBondContact O-OG 3.11Å; L248-S251 VanDerWaalsContact O-OG 3.06Å; L248-G252 PolarHBondContact O-N 2.84Å; L248-K253 HydrophobicContact CD2-CB 4.22Å; L248-K253 PolarHBondContact O-N 3.29Å; L248-V254 HydrophobicContact CB-CB 4.39Å; L248-V254 HydrophobicContact CB-CG2 4.12Å; L248-V254 HydrophobicContact CD1-CG2 4.29Å
249	K	93.9	Very high	92.7	Very high	135 Å²	135	100.6 Å²	100.6	59%	0.587	54%	0.544	S	S	*	.	H	α-helix	trans	-66	-46.3	173.8	-73.5	178	176.9	-179.7	0	112.1	V245 G246 S251 G252 V254	V245-K249 HydrophobicContact CG1-CD 4.27Å; V245-K249 WeakPolarHBondContact O-CG 3.5Å; V245-K249 PolarHBondContact O-N 3.41Å; G246-K249 PolarHBondContact O-N 3.07Å; K249-S251 PolarHBondContact O-N 2.98Å; K249-G252 PolarHBondContact O-N 3.1Å; K249-V254 WeakPolarHBondContact CA-O 3.49Å
250	E	93.4	Very high	92.5	Very high	142 Å²	142	94.5 Å²	94.5	66%	0.664	52%	0.521	S	S	*	.	H	α-helix	trans	-57	-34.2	175.6	-75.1	174.5	-171.7	0	0	112.2	G246 K247	G246-E250 WeakPolarHBondContact O-CG 3.29Å; G246-E250 PolarHBondContact O-N 3Å; K247-E250 WeakPolarHBondContact CD-OE2 3.38Å; K247-E250 IonicContact NZ-OE1 3.96Å; K247-E250 IonicContact NZ-OE2 3.84Å; K247-E250 PolarHBondContact NZ-OE2 2.66Å
251	S	90	Very high	92.2	Very high	70 Å²	70	97 Å²	97	49%	0.49	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.6	178.2	60	0	0	0	0	114.6	K247 L248 K249 K253	K247-S251 WeakPolarHBondContact O-CB 3.33Å; K247-S251 PolarHBondContact O-N 3.33Å; K247-S251 VanDerWaalsContact O-N 3.09Å; K247-S251 PolarHBondContact O-OG 3.3Å; L248-S251 WeakPolarHBondContact CA-OG 3.42Å; L248-S251 PolarHBondContact O-N 2.8Å; L248-S251 PolarHBondContact O-OG 3.11Å; L248-S251 VanDerWaalsContact O-OG 3.06Å; K249-S251 PolarHBondContact O-N 2.98Å; S251-K253 PolarHBondContact O-N 2.88Å
252	G	88.5	Confident	91.9	Very high	64 Å²	64	96.5 Å²	96.5	66%	0.66	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	26.5	177.6	0	0	0	0	0	114.1	L248 K249	L248-G252 PolarHBondContact O-N 2.84Å; K249-G252 PolarHBondContact O-N 3.1Å
253	K	84.1	Confident	91.5	Very high	165 Å²	165	92.6 Å²	92.6	72%	0.717	51%	0.513	S	S	*	.			trans	-92.1	-20.1	179.1	-66.1	-61.3	-178.6	-174.4	0	113.1	L248 S251	L248-K253 HydrophobicContact CD2-CB 4.22Å; L248-K253 PolarHBondContact O-N 3.29Å; S251-K253 PolarHBondContact O-N 2.88Å
254	V	75.9	Confident	91.1	Very high	140 Å²	140	93.9 Å²	93.9	85%	0.848	52%	0.522	S	S	*	.			trans	-143.9	0	175.6	-172.4	0	0	0	0	108.7	L248 K249	L248-V254 HydrophobicContact CB-CB 4.39Å; L248-V254 HydrophobicContact CB-CG2 4.12Å; L248-V254 HydrophobicContact CD1-CG2 4.29Å; K249-V254 WeakPolarHBondContact CA-O 3.49Å

Retrieved 254 of 254 residues in 220.1 ms (Link to these results)

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