A0A060XDS4_ONCMY Loading...

Nucleoredoxin

AlphaFold DB , UniProt , Accession A0A060XDS4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110503929, Length 418 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.8	Low	82.8	Confident	125 Å²	125	60.8 Å²	60.8	62%	0.616	31%	0.311	S	S	*	.				0	-48.6	0	-69.1	-167	-67.6	0	0	111.8	E3 G27 S28 A124	M1-E3 PolarHBondContact O-N 2.74Å; M1-G27 WeakPolarHBondContact CB-O 3.09Å; M1-S28 VanDerWaalsContact CE-O 3.25Å; M1-S28 WeakPolarHBondContact CE-O 3.43Å; M1-A124 HydrophobicContact CG-CB 4.3Å
2	S	63.2	Low	83.7	Confident	47 Å²	47	65 Å²	65	33%	0.329	32%	0.32	S	S	.	.	H	α-helix	trans	-58.8	-40.3	179.1	54.4	0	0	0	0	114.5	F4 L5 V6	S2-F4 PolarHBondContact O-N 2.63Å; S2-L5 PolarHBondContact O-N 3.07Å; S2-V6 VanDerWaalsContact O-CG2 3.27Å; S2-V6 WeakPolarHBondContact O-CG2 3.32Å; S2-V6 PolarHBondContact O-N 3.23Å
3	E	78.9	Confident	84.6	Confident	145 Å²	145	60 Å²	60	68%	0.678	30%	0.295	S	S	*	.	H	α-helix	trans	-64.1	-39.8	-176	-168	176.6	-174.6	0	0	113.5	M1 V6 N7	M1-E3 PolarHBondContact O-N 2.74Å; E3-V6 PolarHBondContact O-N 2.83Å; E3-N7 VanDerWaalsContact O-CG 3.31Å; E3-N7 PolarHBondContact O-N 3.1Å; E3-N7 PolarHBondContact O-ND2 2.63Å
4	F	84.3	Confident	85.5	Confident	55 Å²	55	57.1 Å²	57.1	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-45.8	177.4	-179.6	-89.7	0	0	0	111.7	S2 V6 N7 L8 A124 T125 G126	S2-F4 PolarHBondContact O-N 2.63Å; F4-V6 VanDerWaalsContact C-N 3.29Å; F4-V6 PolarHBondContact O-N 3.01Å; F4-N7 WeakPolarHBondContact O-CB 3.43Å; F4-N7 PolarHBondContact O-N 3.3Å; F4-N7 VanDerWaalsContact O-N 3.15Å; F4-L8 HydrophobicContact CE1-CB 4.25Å; F4-L8 HydrophobicContact CE1-CD2 4.13Å; F4-L8 PolarHBondContact O-N 3.41Å; F4-A124 WeakPolarHBondContact CB-O 3.49Å; F4-A124 WeakPolarHBondContact CG-O 3.2Å; F4-T125 VanDerWaalsContact CE2-O 3.3Å; F4-T125 WeakPolarHBondContact CE2-O 3.22Å; F4-T125 WeakPolarHBondContact CZ-O 3.23Å; F4-G126 VanDerWaalsContact CZ-N 3.34Å
5	L	86.8	Confident	86.1	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-37.5	177.1	-71	178.5	0	0	0	111.9	S2 N7 L8 L9 V23 L30 V33 A123	S2-L5 PolarHBondContact O-N 3.07Å; L5-N7 VanDerWaalsContact C-N 3.35Å; L5-L8 PolarHBondContact O-N 3.48Å; L5-L9 WeakPolarHBondContact O-CB 3.36Å; L5-L9 PolarHBondContact O-N 3.39Å; L5-V23 HydrophobicContact CB-CG1 3.82Å; L5-L30 HydrophobicContact CD1-CD1 4.18Å; L5-V33 HydrophobicContact CD2-CG2 3.77Å; L5-A123 HydrophobicContact CD1-CB 4.37Å; L5-A123 HydrophobicContact CD2-CB 4.25Å; L5-A123 WeakPolarHBondContact CD2-O 3.25Å; L5-A123 WeakPolarHBondContact CG-O 3.27Å
6	V	89.3	Confident	86.5	Confident	21 Å²	21	55.4 Å²	55.4	13%	0.127	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-41.1	173.5	170.6	0	0	0	0	111.1	S2 E3 F4 L8 G10 E11 V23 Q24	S2-V6 VanDerWaalsContact O-CG2 3.27Å; S2-V6 WeakPolarHBondContact O-CG2 3.32Å; S2-V6 PolarHBondContact O-N 3.23Å; E3-V6 PolarHBondContact O-N 2.83Å; F4-V6 VanDerWaalsContact C-N 3.29Å; F4-V6 PolarHBondContact O-N 3.01Å; V6-L8 VanDerWaalsContact C-N 3.29Å; V6-L8 PolarHBondContact O-N 2.65Å; V6-G10 WeakPolarHBondContact CA-O 3.36Å; V6-G10 CarbonylContact O-C 3.58Å; V6-G10 WeakPolarHBondContact O-CA 3.43Å; V6-G10 PolarHBondContact O-N 2.94Å; V6-E11 HydrophobicContact CG1-CG 3.85Å; V6-V23 HydrophobicContact CG2-CB 4.14Å; V6-V23 HydrophobicContact CG2-CG1 3.97Å; V6-Q24 HydrophobicContact CG2-CG 3.58Å
7	N	87.4	Confident	86.7	Confident	122 Å²	122	61.1 Å²	61.1	65%	0.652	31%	0.306	S	S	*	.	H	α-helix	trans	-64.5	-36	174.4	-71	-21.6	0	0	0	112.1	E3 F4 L5	E3-N7 VanDerWaalsContact O-CG 3.31Å; E3-N7 PolarHBondContact O-N 3.1Å; E3-N7 PolarHBondContact O-ND2 2.63Å; F4-N7 WeakPolarHBondContact O-CB 3.43Å; F4-N7 PolarHBondContact O-N 3.3Å; F4-N7 VanDerWaalsContact O-N 3.15Å; L5-N7 VanDerWaalsContact C-N 3.35Å
8	L	88.8	Confident	86.6	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.052	32%	0.315	C	S	.	.	H	α-helix	trans	-75.4	-46.3	-179.4	-171.2	67.9	0	0	0	112.9	F4 L5 V6 L106 K109 Y110 V121	F4-L8 HydrophobicContact CE1-CB 4.25Å; F4-L8 HydrophobicContact CE1-CD2 4.13Å; F4-L8 PolarHBondContact O-N 3.41Å; L5-L8 PolarHBondContact O-N 3.48Å; V6-L8 VanDerWaalsContact C-N 3.29Å; V6-L8 PolarHBondContact O-N 2.65Å; L8-L106 HydrophobicContact CD1-CD2 3.58Å; L8-L106 HydrophobicContact CG-CD2 3.96Å; L8-K109 HydrophobicContact CD1-CD 4.2Å; L8-Y110 HydrophobicContact CD1-CE2 4.06Å; L8-Y110 WeakPolarHBondContact CD1-OH 3.25Å; L8-V121 HydrophobicContact CD2-CG2 4.35Å
9	L	92.7	Very high	86.9	Confident	3 Å²	3	61 Å²	61	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-108.3	-16.4	-168.7	-59.2	176.3	0	0	0	113.2	L5 L13 V23 L35 V72 L95 K102 L106	L5-L9 WeakPolarHBondContact O-CB 3.36Å; L5-L9 PolarHBondContact O-N 3.39Å; L9-L13 HydrophobicContact CB-CD2 4.25Å; L9-V23 HydrophobicContact CB-CG1 4.44Å; L9-V23 HydrophobicContact CB-CG2 4.35Å; L9-V23 HydrophobicContact CD1-CG1 4.45Å; L9-L35 HydrophobicContact CD2-CD2 3.87Å; L9-V72 HydrophobicContact CD1-CG2 3.94Å; L9-V72 HydrophobicContact CD2-CB 4.49Å; L9-V72 HydrophobicContact CD2-CG1 4.23Å; L9-V72 HydrophobicContact CD2-CG2 4.49Å; L9-L95 HydrophobicContact CB-CD2 4.49Å; L9-L95 WeakPolarHBondContact O-CD2 3.41Å; L9-K102 VanDerWaalsContact C-CD 3.43Å; L9-K102 WeakPolarHBondContact O-CD 3.49Å; L9-K102 PolarHBondContact O-NZ 3.15Å; L9-L106 HydrophobicContact CD2-CD1 4.32Å
10	G	91.5	Very high	87.2	Confident	8 Å²	8	64.7 Å²	64.7	8%	0.082	33%	0.333	C	S	.	.			trans	90.6	178.7	-167.1	0	0	0	0	0	112.9	V6 V23	V6-G10 WeakPolarHBondContact CA-O 3.36Å; V6-G10 CarbonylContact O-C 3.58Å; V6-G10 WeakPolarHBondContact O-CA 3.43Å; V6-G10 PolarHBondContact O-N 2.94Å; G10-V23 VanDerWaalsContact O-CB 3.27Å; G10-V23 WeakPolarHBondContact O-CB 3.5Å; G10-V23 WeakPolarHBondContact O-CG2 3.33Å
11	E	92	Very high	87.4	Confident	131 Å²	131	63.2 Å²	63.2	61%	0.612	33%	0.327	S	S	*	.	S	Bend	trans	-74.4	-27.8	179.5	-62.6	-179.3	175.9	0	0	112.9	V6 V23	V6-E11 HydrophobicContact CG1-CG 3.85Å; E11-V23 PolarHBondContact O-N 3.39Å
12	R	94.1	Very high	89.1	Confident	111 Å²	111	59.8 Å²	59.8	42%	0.419	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	133.2	-170.8	-56.9	-67.5	177	166.1	-5.3	111.7	E20 V21	R12-E20 WeakPolarHBondContact CD-OE2 3.5Å; R12-E20 IonicContact CZ-OE2 3.98Å; R12-E20 IonicContact NE-OE2 2.73Å; R12-E20 IonicContact NH1-OE2 2.62Å; R12-V21 WeakPolarHBondContact CA-O 3.33Å
13	L	95.6	Very high	90.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	175.4	163.6	-57.9	176.8	0	0	0	110.3	L9 E20 V21 V23 L26 V72 P93 A94 L95	L9-L13 HydrophobicContact CB-CD2 4.25Å; L13-E20 CarbonylContact O-C 3.55Å; L13-E20 WeakPolarHBondContact O-CA 3.42Å; L13-V21 HydrophobicContact CB-CB 4.28Å; L13-V21 PolarHBondContact N-O 2.88Å; L13-V21 PolarHBondContact O-N 3.42Å; L13-V23 HydrophobicContact CD1-CG2 4.07Å; L13-V23 HydrophobicContact CD2-CG2 4.33Å; L13-V23 HydrophobicContact CG-CG2 3.65Å; L13-L26 HydrophobicContact CD1-CD1 3.73Å; L13-V72 HydrophobicContact CD1-CG1 4.15Å; L13-V72 HydrophobicContact CD1-CG2 3.87Å; L13-V72 HydrophobicContact CD2-CG1 3.97Å; L13-P93 HydrophobicContact CB-CB 3.84Å; L13-P93 HydrophobicContact CB-CG 4.5Å; L13-P93 HydrophobicContact CD1-CB 3.93Å; L13-P93 HydrophobicContact CD1-CG 3.67Å; L13-A94 WeakPolarHBondContact CA-O 3.45Å; L13-A94 WeakPolarHBondContact CB-O 3.33Å; L13-L95 HydrophobicContact CD2-CD2 3.7Å; L13-L95 HydrophobicContact CD2-CG 4.47Å
14	V	96.2	Very high	90.8	Very high	19 Å²	19	56 Å²	56	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.8	178.6	-174.4	0	0	0	0	109.7	T18 A19 W83 L87 P93 A94 P96	V14-T18 VanDerWaalsContact CG1-CA 3.5Å; V14-A19 WeakPolarHBondContact CA-O 3.07Å; V14-W83 HydrophobicContact CB-CH2 3.97Å; V14-W83 HydrophobicContact CG1-CH2 3.88Å; V14-W83 HydrophobicContact CG2-CH2 4.32Å; V14-L87 HydrophobicContact CG1-CD2 4.1Å; V14-P93 CarbonylContact O-C 3.52Å; V14-P93 WeakPolarHBondContact O-CA 3.4Å; V14-A94 PolarHBondContact N-O 3Å; V14-A94 PolarHBondContact O-N 2.91Å; V14-P96 HydrophobicContact CG2-CB 4.17Å; V14-P96 HydrophobicContact CG2-CG 4.09Å
15	N	94.4	Very high	90.7	Very high	42 Å²	42	57 Å²	57	23%	0.225	31%	0.307	C	S	.	.			trans	-89.2	-178.2	176.5	72.9	6.2	0	0	0	112.7	E17 T18 A19 V21 L87	N15-E17 PolarHBondContact O-N 3.09Å; N15-E17 WeakPolarHBondContact OD1-CA 3.49Å; N15-E17 PolarHBondContact OD1-N 3.27Å; N15-T18 WeakPolarHBondContact O-CA 3.26Å; N15-T18 PolarHBondContact O-N 2.95Å; N15-T18 PolarHBondContact OD1-N 2.84Å; N15-A19 PolarHBondContact N-O 3.11Å; N15-A19 WeakPolarHBondContact OD1-CB 3.41Å; N15-A19 PolarHBondContact OD1-N 3.44Å; N15-A19 PolarHBondContact OD1-O 2.82Å; N15-V21 HydrophobicContact CB-CG2 3.87Å; N15-L87 WeakPolarHBondContact O-CD2 3.38Å
16	S	92.4	Very high	90.3	Very high	45 Å²	45	58.6 Å²	58.6	32%	0.315	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.1	177.7	53	0	0	0	0	114.7	T18 L87	S16-T18 VanDerWaalsContact C-N 3.28Å; S16-L87 WeakPolarHBondContact CB-O 3.4Å
17	E	90.3	Very high	89.1	Confident	152 Å²	152	57.7 Å²	57.7	71%	0.71	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	7.8	176.2	-61	179.8	175.6	0	0	112.6	N15 A19	N15-E17 PolarHBondContact O-N 3.09Å; N15-E17 WeakPolarHBondContact OD1-CA 3.49Å; N15-E17 PolarHBondContact OD1-N 3.27Å; E17-A19 PolarHBondContact O-N 2.73Å
18	T	85.6	Confident	88.1	Confident	77 Å²	77	56 Å²	56	47%	0.472	31%	0.308	S	S	.	.	S	Bend	trans	61.9	14.5	-172.9	66.9	0	0	0	0	115	V14 N15 S16 Q84	V14-T18 VanDerWaalsContact CG1-CA 3.5Å; N15-T18 WeakPolarHBondContact O-CA 3.26Å; N15-T18 PolarHBondContact O-N 2.95Å; N15-T18 PolarHBondContact OD1-N 2.84Å; S16-T18 VanDerWaalsContact C-N 3.28Å; T18-Q84 HydrophobicContact CG2-CG 4.33Å
19	A	91.6	Very high	87.6	Confident	44 Å²	44	62 Å²	62	36%	0.364	33%	0.334	S	S	.	.			trans	-80.2	147.5	175.5	0	0	0	0	0	111.1	V14 N15 E17	V14-A19 WeakPolarHBondContact CA-O 3.07Å; N15-A19 PolarHBondContact N-O 3.11Å; N15-A19 WeakPolarHBondContact OD1-CB 3.41Å; N15-A19 PolarHBondContact OD1-N 3.44Å; N15-A19 PolarHBondContact OD1-O 2.82Å; E17-A19 PolarHBondContact O-N 2.73Å
20	E	93.1	Very high	87.4	Confident	134 Å²	134	62.6 Å²	62.6	63%	0.626	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	132.8	177.4	-68.7	-171	174.3	0	0	111.6	R12 L13	R12-E20 WeakPolarHBondContact CD-OE2 3.5Å; R12-E20 IonicContact CZ-OE2 3.98Å; R12-E20 IonicContact NE-OE2 2.73Å; R12-E20 IonicContact NH1-OE2 2.62Å; L13-E20 CarbonylContact O-C 3.55Å; L13-E20 WeakPolarHBondContact O-CA 3.42Å
21	V	92.4	Very high	87.4	Confident	34 Å²	34	64.2 Å²	64.2	21%	0.206	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.6	173.9	-177.8	0	0	0	0	108.5	R12 L13 N15 V23 L26	R12-V21 WeakPolarHBondContact CA-O 3.33Å; L13-V21 HydrophobicContact CB-CB 4.28Å; L13-V21 PolarHBondContact N-O 2.88Å; L13-V21 PolarHBondContact O-N 3.42Å; N15-V21 HydrophobicContact CB-CG2 3.87Å; V21-V23 PolarHBondContact O-N 3.1Å; V21-L26 HydrophobicContact CG1-CD1 4.28Å; V21-L26 HydrophobicContact CG1-CD2 4.09Å; V21-L26 HydrophobicContact CG1-CG 4.23Å
22	D	91.4	Very high	87.4	Confident	54 Å²	54	58.2 Å²	58.2	29%	0.289	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.2	176.8	-175.5	-9.4	0	0	0	110.6	Q24 A25 L26	D22-Q24 VanDerWaalsContact C-N 3.27Å; D22-Q24 PolarHBondContact O-N 3.23Å; D22-Q24 WeakPolarHBondContact OD1-CB 3.41Å; D22-Q24 PolarHBondContact OD1-N 2.92Å; D22-A25 HydrophobicContact CB-CB 4.12Å; D22-A25 WeakPolarHBondContact O-CB 3.45Å; D22-A25 PolarHBondContact O-N 3.22Å; D22-L26 PolarHBondContact O-N 3.25Å
23	V	90	Very high	87.5	Confident	1 Å²	1	53 Å²	53	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-28.9	179.7	175	0	0	0	0	112	L5 V6 L9 G10 E11 L13 V21 A25 L26 G27	L5-V23 HydrophobicContact CB-CG1 3.82Å; V6-V23 HydrophobicContact CG2-CB 4.14Å; V6-V23 HydrophobicContact CG2-CG1 3.97Å; L9-V23 HydrophobicContact CB-CG1 4.44Å; L9-V23 HydrophobicContact CB-CG2 4.35Å; L9-V23 HydrophobicContact CD1-CG1 4.45Å; G10-V23 VanDerWaalsContact O-CB 3.27Å; G10-V23 WeakPolarHBondContact O-CB 3.5Å; G10-V23 WeakPolarHBondContact O-CG2 3.33Å; E11-V23 PolarHBondContact O-N 3.39Å; L13-V23 HydrophobicContact CD1-CG2 4.07Å; L13-V23 HydrophobicContact CD2-CG2 4.33Å; L13-V23 HydrophobicContact CG-CG2 3.65Å; V21-V23 PolarHBondContact O-N 3.1Å; V23-A25 VanDerWaalsContact C-N 3.26Å; V23-A25 PolarHBondContact O-N 3.16Å; V23-L26 HydrophobicContact CG2-CD1 4.46Å; V23-L26 WeakPolarHBondContact O-CB 3.32Å; V23-L26 PolarHBondContact O-N 2.85Å; V23-G27 PolarHBondContact O-N 3.44Å
24	Q	86.4	Confident	87.5	Confident	110 Å²	110	53 Å²	53	51%	0.514	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-34.4	175.4	-62.4	-170.8	0.6	0	0	111.6	V6 D22 L26 G27	V6-Q24 HydrophobicContact CG2-CG 3.58Å; D22-Q24 VanDerWaalsContact C-N 3.27Å; D22-Q24 PolarHBondContact O-N 3.23Å; D22-Q24 WeakPolarHBondContact OD1-CB 3.41Å; D22-Q24 PolarHBondContact OD1-N 2.92Å; Q24-L26 VanDerWaalsContact C-N 3.3Å; Q24-L26 PolarHBondContact O-N 3.36Å; Q24-G27 PolarHBondContact O-N 3.18Å
25	A	82.3	Confident	87.6	Confident	77 Å²	77	52.1 Å²	52.1	64%	0.636	29%	0.294	S	S	*	.	H	α-helix	trans	-70.4	-26.4	177.5	0	0	0	0	0	112.7	D22 V23	D22-A25 HydrophobicContact CB-CB 4.12Å; D22-A25 WeakPolarHBondContact O-CB 3.45Å; D22-A25 PolarHBondContact O-N 3.22Å; V23-A25 VanDerWaalsContact C-N 3.26Å; V23-A25 PolarHBondContact O-N 3.16Å
26	L	78.1	Confident	87.8	Confident	36 Å²	36	50.1 Å²	50.1	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-37.3	174.3	-62.9	173.4	0	0	0	111.8	L13 V21 D22 V23 Q24 S28 L30	L13-L26 HydrophobicContact CD1-CD1 3.73Å; V21-L26 HydrophobicContact CG1-CD1 4.28Å; V21-L26 HydrophobicContact CG1-CD2 4.09Å; V21-L26 HydrophobicContact CG1-CG 4.23Å; D22-L26 PolarHBondContact O-N 3.25Å; V23-L26 HydrophobicContact CG2-CD1 4.46Å; V23-L26 WeakPolarHBondContact O-CB 3.32Å; V23-L26 PolarHBondContact O-N 2.85Å; Q24-L26 VanDerWaalsContact C-N 3.3Å; Q24-L26 PolarHBondContact O-N 3.36Å; L26-S28 PolarHBondContact O-N 2.83Å; L26-L30 HydrophobicContact CB-CD1 3.97Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 VanDerWaalsContact O-CG 3.31Å; L26-L30 WeakPolarHBondContact O-CG 3.49Å
27	G	64.3	Low	88	Confident	1 Å²	1	48 Å²	48	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.4	-153.4	0	0	0	0	0	119.3	M1 V23 Q24	M1-G27 WeakPolarHBondContact CB-O 3.09Å; V23-G27 PolarHBondContact O-N 3.44Å; Q24-G27 PolarHBondContact O-N 3.18Å
28	S	66.6	Low	88.3	Confident	86 Å²	86	40.7 Å²	40.7	60%	0.601	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-24.7	-176.5	63.8	0	0	0	0	114.3	M1 L26	M1-S28 VanDerWaalsContact CE-O 3.25Å; M1-S28 WeakPolarHBondContact CE-O 3.43Å; L26-S28 PolarHBondContact O-N 2.83Å
29	K	79	Confident	88.7	Confident	138 Å²	138	38.1 Å²	38.1	60%	0.6	22%	0.219	S	C	*	.	S	Bend	trans	-117.8	-7.9	-176.1	-64.1	-177	-179.4	-180	0	114.4	S31 D67 T68	K29-S31 PolarHBondContact O-N 3.06Å; K29-D67 HydrophobicContact CD-CB 4.38Å; K29-T68 WeakPolarHBondContact O-CA 3.47Å
30	L	88.8	Confident	88.7	Confident	14 Å²	14	36.3 Å²	36.3	7%	0.073	20%	0.204	C	C	.	.			trans	-71.6	130	-177.4	-66	178.9	0	0	0	111.2	L5 L26 V33 E70 A123	L5-L30 HydrophobicContact CD1-CD1 4.18Å; L26-L30 HydrophobicContact CB-CD1 3.97Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 VanDerWaalsContact O-CG 3.31Å; L26-L30 WeakPolarHBondContact O-CG 3.49Å; L30-V33 HydrophobicContact CD1-CG2 4.3Å; L30-E70 HydrophobicContact CD1-CB 3.8Å; L30-E70 HydrophobicContact CD2-CB 3.75Å; L30-E70 HydrophobicContact CG-CB 4.45Å; L30-A123 HydrophobicContact CB-CB 3.84Å; L30-A123 WeakPolarHBondContact O-CB 3.42Å
31	S	90.1	Very high	88.5	Confident	43 Å²	43	35.4 Å²	35.4	30%	0.301	20%	0.202	S	C	.	.	S	Bend	trans	-98.7	-37.9	167.6	58.2	0	0	0	0	111.2	K29 T68 A123 F146	K29-S31 PolarHBondContact O-N 3.06Å; S31-T68 PolarHBondContact N-O 3.45Å; S31-T68 VanDerWaalsContact OG-CB 3.27Å; S31-T68 WeakPolarHBondContact OG-CB 3.42Å; S31-T68 PolarHBondContact OG-O 2.79Å; S31-T68 PolarHBondContact OG-OG1 2.94Å; S31-A123 WeakPolarHBondContact O-CB 3.33Å; S31-A123 PolarHBondContact O-N 3.45Å; S31-F146 WeakPolarHBondContact OG-CZ 3.47Å
32	L	93.3	Very high	88.5	Confident	5 Å²	5	36 Å²	36	3%	0.026	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.2	-178.8	-67.2	-176.7	0	0	0	111.6	T68 L69 E70 V121 V129 F146 P147 W148	L32-T68 PolarHBondContact N-O 3.02Å; L32-L69 HydrophobicContact CB-CD1 3.95Å; L32-L69 WeakPolarHBondContact O-CA 3.15Å; L32-E70 PolarHBondContact O-N 3.12Å; L32-V121 WeakPolarHBondContact CA-O 3.34Å; L32-V121 WeakPolarHBondContact CD2-O 3.32Å; L32-V129 HydrophobicContact CD1-CG1 4.29Å; L32-V129 HydrophobicContact CD2-CB 3.97Å; L32-V129 HydrophobicContact CD2-CG1 3.86Å; L32-V129 HydrophobicContact CD2-CG2 3.63Å; L32-F146 HydrophobicContact CB-CE2 4.35Å; L32-F146 HydrophobicContact CB-CZ 4.4Å; L32-F146 HydrophobicContact CD1-CD2 4.27Å; L32-F146 HydrophobicContact CD1-CE2 3.61Å; L32-F146 HydrophobicContact CD1-CZ 3.95Å; L32-F146 HydrophobicContact CG-CE2 4.24Å; L32-F146 HydrophobicContact CG-CZ 4.18Å; L32-P147 HydrophobicContact CD1-CB 3.92Å; L32-W148 HydrophobicContact CD1-CE3 4.2Å
33	V	95.1	Very high	88.6	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.9	166.6	179.5	0	0	0	0	108.8	L5 L30 L35 E70 V72 F120 V121 A123	L5-V33 HydrophobicContact CD2-CG2 3.77Å; L30-V33 HydrophobicContact CD1-CG2 4.3Å; V33-L35 HydrophobicContact CG1-CD2 3.94Å; V33-E70 CarbonylContact C-O 3.57Å; V33-E70 VanDerWaalsContact CA-O 3.29Å; V33-E70 WeakPolarHBondContact CA-O 3.42Å; V33-V72 HydrophobicContact CG1-CG2 4Å; V33-F120 WeakPolarHBondContact O-CA 3.42Å; V33-V121 HydrophobicContact CB-CG2 4Å; V33-V121 PolarHBondContact N-O 3.33Å; V33-V121 WeakPolarHBondContact O-CG2 3.35Å; V33-V121 PolarHBondContact O-N 3.25Å; V33-A123 HydrophobicContact CG2-CB 4.13Å
34	G	96.8	Very high	88.8	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111	170.6	0	0	0	0	0	110.5	Y36 E70 I71 V72	G34-Y36 PolarHBondContact O-N 3.07Å; G34-E70 PolarHBondContact N-O 3.45Å; G34-I71 CarbonylContact O-C 3.59Å; G34-I71 VanDerWaalsContact O-CA 3.26Å; G34-I71 WeakPolarHBondContact O-CA 3.5Å; G34-I71 WeakPolarHBondContact O-CG2 3.15Å; G34-V72 PolarHBondContact O-N 3.36Å
35	L	97.8	Very high	89.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.9	174.7	-59.5	176.7	0	0	0	109.1	L9 V33 F37 V72 Y110 L118 V119 V121	L9-L35 HydrophobicContact CD2-CD2 3.87Å; V33-L35 HydrophobicContact CG1-CD2 3.94Å; L35-F37 HydrophobicContact CB-CD2 4.3Å; L35-F37 HydrophobicContact CB-CE2 3.49Å; L35-F37 VanDerWaalsContact CB-CE2 3.49Å; L35-F37 HydrophobicContact CB-CZ 3.94Å; L35-F37 HydrophobicContact CD1-CE2 4.48Å; L35-F37 HydrophobicContact CD1-CZ 4.29Å; L35-F37 VanDerWaalsContact O-CD2 3.32Å; L35-F37 WeakPolarHBondContact O-CD2 3.38Å; L35-F37 WeakPolarHBondContact O-CE2 3.32Å; L35-V72 HydrophobicContact CD2-CB 4.29Å; L35-Y110 HydrophobicContact CD1-CD2 3.41Å; L35-Y110 VanDerWaalsContact CD1-CD2 3.41Å; L35-Y110 HydrophobicContact CD1-CE2 3.16Å; L35-Y110 HydrophobicContact CD1-CG 4.28Å; L35-L118 WeakPolarHBondContact O-CA 3.16Å; L35-V119 PolarHBondContact N-O 3.39Å; L35-V119 PolarHBondContact O-N 3.24Å; L35-V121 HydrophobicContact CD1-CG1 4.26Å; L35-V121 HydrophobicContact CD1-CG2 4.38Å; L35-V121 HydrophobicContact CG-CG2 4.49Å
36	Y	98.1	Very high	89.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.4	178.3	176	-151.8	0	0	0	110.1	G34 C45 F48 L52 V72 F73 V74 M90 W92 P116 S117	G34-Y36 PolarHBondContact O-N 3.07Å; Y36-C45 PolarHBondContact OH-O 2.94Å; Y36-F48 HydrophobicContact CD2-CD1 4.27Å; Y36-F48 HydrophobicContact CD2-CE1 4.06Å; Y36-F48 AromaticContact CE2-CD1 3.67Å; Y36-F48 HydrophobicContact CE2-CD1 3.67Å; Y36-F48 AromaticContact CE2-CE1 3.93Å; Y36-F48 HydrophobicContact CE2-CE1 3.93Å; Y36-F48 AromaticContact CZ-CD1 3.94Å; Y36-L52 HydrophobicContact CD1-CD2 3.89Å; Y36-L52 HydrophobicContact CE1-CD2 4.36Å; Y36-L52 HydrophobicContact CG-CD2 4.08Å; Y36-V72 PolarHBondContact N-O 3.12Å; Y36-F73 AromaticContact CD1-CD2 3.56Å; Y36-F73 HydrophobicContact CD1-CD2 3.56Å; Y36-F73 HydrophobicContact CD1-CE2 4.08Å; Y36-F73 HydrophobicContact CD1-CG 4.49Å; Y36-F73 AromaticContact CE1-CD2 3.94Å; Y36-F73 HydrophobicContact CE1-CD2 3.94Å; Y36-F73 HydrophobicContact CE1-CE2 4.01Å; Y36-F73 AromaticContact CG-CD2 4Å; Y36-F73 HydrophobicContact CG-CD2 4Å; Y36-F73 CarbonylContact O-C 3.45Å; Y36-F73 WeakPolarHBondContact O-CA 3.42Å; Y36-F73 VanDerWaalsContact O-CD2 3.22Å; Y36-F73 WeakPolarHBondContact O-CD2 3.44Å; Y36-V74 PolarHBondContact O-N 3.43Å; Y36-M90 HydrophobicContact CE1-CE 4.16Å; Y36-W92 AromaticContact CD1-CZ2 3.87Å; Y36-W92 HydrophobicContact CD1-CZ2 3.87Å; Y36-W92 HydrophobicContact CE1-CZ2 4.17Å; Y36-P116 HydrophobicContact CE2-CB 3.93Å; Y36-S117 CarbonylContact C-O 3.49Å
37	F	97.3	Very high	90.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.4	175.3	-57	-96.9	0	0	0	110	L35 V74 L106 W107 Y110 V112 I115 S117 V119	L35-F37 HydrophobicContact CB-CD2 4.3Å; L35-F37 HydrophobicContact CB-CE2 3.49Å; L35-F37 VanDerWaalsContact CB-CE2 3.49Å; L35-F37 HydrophobicContact CB-CZ 3.94Å; L35-F37 HydrophobicContact CD1-CE2 4.48Å; L35-F37 HydrophobicContact CD1-CZ 4.29Å; L35-F37 VanDerWaalsContact O-CD2 3.32Å; L35-F37 WeakPolarHBondContact O-CD2 3.38Å; L35-F37 WeakPolarHBondContact O-CE2 3.32Å; F37-V74 WeakPolarHBondContact CA-O 3.37Å; F37-V74 HydrophobicContact CD1-CB 3.6Å; F37-V74 HydrophobicContact CD1-CG1 3.59Å; F37-V74 HydrophobicContact CD1-CG2 4.23Å; F37-V74 HydrophobicContact CE1-CB 3.86Å; F37-V74 HydrophobicContact CE1-CG1 3.67Å; F37-V74 HydrophobicContact CE1-CG2 4.04Å; F37-V74 HydrophobicContact CG-CB 4.2Å; F37-V74 HydrophobicContact CZ-CG2 4.39Å; F37-L106 HydrophobicContact CE1-CB 3.98Å; F37-L106 HydrophobicContact CZ-CB 4.22Å; F37-W107 AromaticContact CD1-CD1 3.58Å; F37-W107 HydrophobicContact CD1-CD2 4.01Å; F37-W107 AromaticContact CD1-CE2 3.61Å; F37-W107 AromaticContact CD1-CG 3.91Å; F37-W107 HydrophobicContact CD1-CG 3.91Å; F37-W107 HydrophobicContact CD1-CZ2 4.21Å; F37-W107 AromaticContact CD1-NE1 3.34Å; F37-W107 VanDerWaalsContact CD1-NE1 3.34Å; F37-W107 HydrophobicContact CE1-CD2 4.41Å; F37-W107 HydrophobicContact CE1-CG 4.1Å; F37-W107 AromaticContact CG-NE1 3.91Å; F37-Y110 HydrophobicContact CZ-CD2 4.27Å; F37-V112 HydrophobicContact CB-CG1 3.95Å; F37-V112 HydrophobicContact CD1-CG1 4.36Å; F37-V112 HydrophobicContact CD1-CG2 4.47Å; F37-V112 HydrophobicContact CD2-CB 4.46Å; F37-V112 HydrophobicContact CD2-CG1 4.21Å; F37-V112 HydrophobicContact CD2-CG2 3.75Å; F37-V112 HydrophobicContact CE1-CG2 4.37Å; F37-V112 HydrophobicContact CE2-CG2 3.66Å; F37-V112 HydrophobicContact CG-CB 4.4Å; F37-V112 HydrophobicContact CG-CG1 3.93Å; F37-V112 HydrophobicContact CG-CG2 4.16Å; F37-V112 HydrophobicContact CZ-CG2 3.98Å; F37-I115 HydrophobicContact CB-CG2 4.43Å; F37-S117 PolarHBondContact N-O 3.29Å; F37-S117 PolarHBondContact O-N 3.02Å; F37-V119 HydrophobicContact CE2-CB 4.44Å; F37-V119 HydrophobicContact CE2-CG2 4.17Å
38	G	95.7	Very high	92	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	177.8	-175.8	0	0	0	0	0	114.8	V74 S75 S76	G38-V74 PolarHBondContact N-O 3.36Å; G38-S75 WeakPolarHBondContact O-CA 3.05Å; G38-S76 PolarHBondContact O-N 2.83Å; G38-S76 PolarHBondContact O-OG 3.03Å
39	C	93.9	Very high	93.4	Very high	22 Å²	22	37.8 Å²	37.8	15%	0.149	21%	0.205	C	C	.	.			trans	-137.7	133.4	-178.1	-176.3	0	0	0	0	109.9	L41 N42 C45 S76 D77 I115	C39-L41 PolarHBondContact O-N 2.92Å; C39-N42 HydrophobicContact CB-CB 4.02Å; C39-N42 PolarHBondContact O-N 3.3Å; C39-C45 VanDerWaalsContact O-CB 3.24Å; C39-C45 WeakPolarHBondContact O-CB 3.35Å; C39-S76 WeakPolarHBondContact CB-OG 3.35Å; C39-D77 PolarHBondContact SG-OD1 3.4Å; C39-I115 HydrophobicContact CB-CD1 3.5Å
40	S	91.9	Very high	94.1	Very high	6 Å²	6	34.2 Å²	34.2	4%	0.042	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-30.5	-179.6	66.7	0	0	0	0	113.1	N42 K46 D77 H82 F86	S40-N42 VanDerWaalsContact C-N 3.33Å; S40-K46 WeakPolarHBondContact O-CE 3.21Å; S40-D77 VanDerWaalsContact CB-OD1 3.22Å; S40-D77 WeakPolarHBondContact CB-OD1 3.3Å; S40-D77 PolarHBondContact N-OD1 3.15Å; S40-D77 PolarHBondContact N-OD2 2.76Å; S40-D77 PolarHBondContact OG-OD1 2.85Å; S40-H82 WeakPolarHBondContact OG-CB 3.43Å; S40-F86 VanDerWaalsContact CB-CB 3.49Å
41	L	90.4	Very high	94.4	Very high	115 Å²	115	36.4 Å²	36.4	60%	0.602	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.6	-177.4	-60.5	-179.3	0	0	0	113.3	C39	C39-L41 PolarHBondContact O-N 2.92Å
42	N	91.6	Very high	94.8	Very high	47 Å²	47	34.3 Å²	34.3	25%	0.251	20%	0.203	S	C	.	.			trans	-91.5	119.7	-179	179.8	-88.2	0	0	0	110.8	C39 S40 P44 C45 K46 I115	C39-N42 HydrophobicContact CB-CB 4.02Å; C39-N42 PolarHBondContact O-N 3.3Å; S40-N42 VanDerWaalsContact C-N 3.33Å; N42-P44 WeakPolarHBondContact OD1-CB 3.2Å; N42-P44 VanDerWaalsContact OD1-CD 3.24Å; N42-P44 WeakPolarHBondContact OD1-CD 3.47Å; N42-C45 HydrophobicContact CB-CB 3.96Å; N42-C45 WeakPolarHBondContact O-CB 2.91Å; N42-C45 PolarHBondContact O-N 2.86Å; N42-C45 VanDerWaalsContact O-N 3.11Å; N42-C45 PolarHBondContact OD1-N 3.2Å; N42-C45 PolarHBondContact OD1-SG 3.26Å; N42-K46 PolarHBondContact O-N 3.48Å; N42-I115 HydrophobicContact CB-CD1 4.38Å
43	G	93.3	Very high	94.9	Very high	48 Å²	48	35 Å²	35	50%	0.495	21%	0.207	S	C	.	.	H	α-helix	trans	-54.3	-50.8	-179.4	0	0	0	0	0	114	C45 K46 Q47	G43-C45 VanDerWaalsContact C-N 3.32Å; G43-C45 PolarHBondContact O-N 3.43Å; G43-K46 WeakPolarHBondContact O-CB 3.19Å; G43-K46 PolarHBondContact O-N 2.98Å; G43-K46 VanDerWaalsContact O-N 3.12Å; G43-Q47 PolarHBondContact O-N 2.82Å
44	P	94.4	Very high	94.9	Very high	71 Å²	71	40.3 Å²	40.3	46%	0.461	23%	0.232	S	C	.	.	H	α-helix	trans	-55.7	-39.5	173	-28.8	35.1	0	0	0	114.3	N42 Q47 F48 P116	N42-P44 WeakPolarHBondContact OD1-CB 3.2Å; N42-P44 VanDerWaalsContact OD1-CD 3.24Å; N42-P44 WeakPolarHBondContact OD1-CD 3.47Å; P44-Q47 PolarHBondContact O-N 3.07Å; P44-F48 WeakPolarHBondContact O-CB 3.48Å; P44-F48 PolarHBondContact O-N 3.4Å; P44-P116 HydrophobicContact CB-CG 4.34Å
45	C	95.1	Very high	94.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-41.1	174.6	-67.4	0	0	0	0	112.1	Y36 C39 N42 G43 F48 N49 P116	Y36-C45 PolarHBondContact OH-O 2.94Å; C39-C45 VanDerWaalsContact O-CB 3.24Å; C39-C45 WeakPolarHBondContact O-CB 3.35Å; N42-C45 HydrophobicContact CB-CB 3.96Å; N42-C45 WeakPolarHBondContact O-CB 2.91Å; N42-C45 PolarHBondContact O-N 2.86Å; N42-C45 VanDerWaalsContact O-N 3.11Å; N42-C45 PolarHBondContact OD1-N 3.2Å; N42-C45 PolarHBondContact OD1-SG 3.26Å; G43-C45 VanDerWaalsContact C-N 3.32Å; G43-C45 PolarHBondContact O-N 3.43Å; C45-F48 PolarHBondContact O-N 2.87Å; C45-N49 VanDerWaalsContact O-CB 3.27Å; C45-N49 WeakPolarHBondContact O-CB 3.39Å; C45-N49 PolarHBondContact O-N 3.09Å; C45-P116 HydrophobicContact CB-CB 4.48Å
46	K	93.5	Very high	94.8	Very high	108 Å²	108	41.1 Å²	41.1	47%	0.47	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-44.7	175.7	-66	-171.9	-179.1	-168.4	0	112.1	S40 N42 G43 N49 A50 F86	S40-K46 WeakPolarHBondContact O-CE 3.21Å; N42-K46 PolarHBondContact O-N 3.48Å; G43-K46 WeakPolarHBondContact O-CB 3.19Å; G43-K46 PolarHBondContact O-N 2.98Å; G43-K46 VanDerWaalsContact O-N 3.12Å; K46-N49 WeakPolarHBondContact O-CB 3.44Å; K46-N49 PolarHBondContact O-N 3.25Å; K46-A50 PolarHBondContact O-N 3.14Å; K46-F86 HydrophobicContact CG-CE2 4.43Å
47	Q	93.9	Very high	94.6	Very high	149 Å²	149	42.6 Å²	42.6	70%	0.696	25%	0.246	S	C	*	.	H	α-helix	trans	-61.7	-47.1	177.7	-175.5	179.5	7.4	0	0	111.1	G43 P44 N49 A50 S51	G43-Q47 PolarHBondContact O-N 2.82Å; P44-Q47 PolarHBondContact O-N 3.07Å; Q47-N49 VanDerWaalsContact C-N 3.34Å; Q47-N49 PolarHBondContact O-N 2.98Å; Q47-A50 PolarHBondContact O-N 2.94Å; Q47-S51 PolarHBondContact O-N 2.82Å
48	F	95.8	Very high	94.4	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.096	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-37.2	178.3	-179	-114.3	0	0	0	112.3	Y36 P44 C45 A50 S51 L52 P116 L118 L134 V137	Y36-F48 HydrophobicContact CD2-CD1 4.27Å; Y36-F48 HydrophobicContact CD2-CE1 4.06Å; Y36-F48 AromaticContact CE2-CD1 3.67Å; Y36-F48 HydrophobicContact CE2-CD1 3.67Å; Y36-F48 AromaticContact CE2-CE1 3.93Å; Y36-F48 HydrophobicContact CE2-CE1 3.93Å; Y36-F48 AromaticContact CZ-CD1 3.94Å; P44-F48 WeakPolarHBondContact O-CB 3.48Å; P44-F48 PolarHBondContact O-N 3.4Å; C45-F48 PolarHBondContact O-N 2.87Å; F48-A50 VanDerWaalsContact C-N 3.29Å; F48-A50 PolarHBondContact O-N 2.79Å; F48-S51 PolarHBondContact O-N 3.1Å; F48-S51 VanDerWaalsContact O-N 3.16Å; F48-L52 HydrophobicContact CE1-CB 4.37Å; F48-L52 HydrophobicContact CE1-CD2 3.93Å; F48-L52 HydrophobicContact CZ-CB 4.37Å; F48-L52 HydrophobicContact CZ-CD1 4.34Å; F48-L52 HydrophobicContact CZ-CD2 4.36Å; F48-L52 WeakPolarHBondContact O-CB 3.28Å; F48-L52 PolarHBondContact O-N 3.18Å; F48-P116 HydrophobicContact CB-CB 4.24Å; F48-P116 HydrophobicContact CB-CG 4.02Å; F48-P116 HydrophobicContact CD1-CB 3.94Å; F48-P116 HydrophobicContact CD1-CG 4.5Å; F48-P116 HydrophobicContact CG-CB 4.33Å; F48-P116 HydrophobicContact CG-CG 4.4Å; F48-L118 HydrophobicContact CE1-CB 4.2Å; F48-L118 HydrophobicContact CE1-CD2 4.46Å; F48-L118 HydrophobicContact CZ-CB 4.15Å; F48-L118 HydrophobicContact CZ-CD2 3.96Å; F48-L134 HydrophobicContact CD1-CD1 4.45Å; F48-L134 HydrophobicContact CD2-CG 4Å; F48-L134 HydrophobicContact CE1-CD1 3.85Å; F48-L134 HydrophobicContact CE1-CG 4.18Å; F48-L134 HydrophobicContact CE2-CB 4.16Å; F48-L134 HydrophobicContact CE2-CD1 4.14Å; F48-L134 HydrophobicContact CE2-CG 3.65Å; F48-L134 HydrophobicContact CG-CG 4.41Å; F48-L134 HydrophobicContact CZ-CB 4.43Å; F48-L134 HydrophobicContact CZ-CD1 3.67Å; F48-L134 HydrophobicContact CZ-CG 3.74Å; F48-V137 HydrophobicContact CE2-CB 4.14Å; F48-V137 HydrophobicContact CE2-CG1 4.17Å; F48-V137 HydrophobicContact CE2-CG2 4.21Å; F48-V137 HydrophobicContact CZ-CG2 4.14Å
49	N	95.4	Very high	94.3	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.027	26%	0.264	C	S	.	.	H	α-helix	trans	-55.4	-44.6	176.2	-171.1	61.3	0	0	0	111.9	C45 K46 Q47 S51 L52 C53 F86 M90 W92	C45-N49 VanDerWaalsContact O-CB 3.27Å; C45-N49 WeakPolarHBondContact O-CB 3.39Å; C45-N49 PolarHBondContact O-N 3.09Å; K46-N49 WeakPolarHBondContact O-CB 3.44Å; K46-N49 PolarHBondContact O-N 3.25Å; Q47-N49 VanDerWaalsContact C-N 3.34Å; Q47-N49 PolarHBondContact O-N 2.98Å; N49-S51 PolarHBondContact O-N 3.49Å; N49-L52 PolarHBondContact O-N 2.99Å; N49-C53 WeakPolarHBondContact O-CB 3.04Å; N49-C53 PolarHBondContact O-N 3.42Å; N49-F86 HydrophobicContact CB-CE2 3.98Å; N49-F86 HydrophobicContact CB-CZ 3.83Å; N49-M90 WeakPolarHBondContact OD1-CG 3.49Å; N49-W92 WeakPolarHBondContact OD1-CZ2 3.47Å
50	A	94.4	Very high	94.2	Very high	63 Å²	63	48.3 Å²	48.3	52%	0.521	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-46.9	177	0	0	0	0	0	112	K46 Q47 F48 L52 C53 E54	K46-A50 PolarHBondContact O-N 3.14Å; Q47-A50 PolarHBondContact O-N 2.94Å; F48-A50 VanDerWaalsContact C-N 3.29Å; F48-A50 PolarHBondContact O-N 2.79Å; A50-L52 VanDerWaalsContact C-N 3.35Å; A50-L52 PolarHBondContact O-N 2.96Å; A50-C53 PolarHBondContact O-N 3.27Å; A50-E54 PolarHBondContact O-N 3.29Å; A50-E54 VanDerWaalsContact O-N 3.12Å
51	S	95.6	Very high	94.1	Very high	59 Å²	59	56.4 Å²	56.4	41%	0.413	30%	0.302	S	S	.	.	H	α-helix	trans	-62.8	-40.4	176.2	-58.8	0	0	0	0	112.4	Q47 F48 N49 E54 F55	Q47-S51 PolarHBondContact O-N 2.82Å; F48-S51 PolarHBondContact O-N 3.1Å; F48-S51 VanDerWaalsContact O-N 3.16Å; N49-S51 PolarHBondContact O-N 3.49Å; S51-E54 PolarHBondContact O-N 2.9Å; S51-F55 WeakPolarHBondContact O-CB 3.47Å; S51-F55 PolarHBondContact O-N 2.94Å
52	L	96.9	Very high	93.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.9	-39.4	179.2	-173.6	60.2	0	0	0	111.6	Y36 F48 N49 A50 F55 Y56 I71 W92 L118 V137	Y36-L52 HydrophobicContact CD1-CD2 3.89Å; Y36-L52 HydrophobicContact CE1-CD2 4.36Å; Y36-L52 HydrophobicContact CG-CD2 4.08Å; F48-L52 HydrophobicContact CE1-CB 4.37Å; F48-L52 HydrophobicContact CE1-CD2 3.93Å; F48-L52 HydrophobicContact CZ-CB 4.37Å; F48-L52 HydrophobicContact CZ-CD1 4.34Å; F48-L52 HydrophobicContact CZ-CD2 4.36Å; F48-L52 WeakPolarHBondContact O-CB 3.28Å; F48-L52 PolarHBondContact O-N 3.18Å; N49-L52 PolarHBondContact O-N 2.99Å; A50-L52 VanDerWaalsContact C-N 3.35Å; A50-L52 PolarHBondContact O-N 2.96Å; L52-F55 HydrophobicContact CD1-CD1 4.12Å; L52-F55 PolarHBondContact O-N 3.05Å; L52-Y56 WeakPolarHBondContact O-CB 3.4Å; L52-Y56 PolarHBondContact O-N 3.29Å; L52-I71 HydrophobicContact CD1-CD1 3.7Å; L52-I71 HydrophobicContact CD2-CD1 4.15Å; L52-I71 HydrophobicContact CD2-CG2 4.5Å; L52-I71 HydrophobicContact CG-CD1 3.99Å; L52-W92 HydrophobicContact CB-CH2 3.77Å; L52-W92 HydrophobicContact CB-CZ3 4.32Å; L52-W92 HydrophobicContact CD2-CH2 3.48Å; L52-W92 VanDerWaalsContact CD2-CH2 3.48Å; L52-W92 HydrophobicContact CD2-CZ2 3.6Å; L52-W92 HydrophobicContact CD2-CZ3 4.06Å; L52-W92 HydrophobicContact CG-CH2 3.42Å; L52-W92 VanDerWaalsContact CG-CH2 3.42Å; L52-W92 HydrophobicContact CG-CZ2 4.1Å; L52-W92 HydrophobicContact CG-CZ3 3.69Å; L52-L118 HydrophobicContact CD1-CD2 3.86Å; L52-V137 HydrophobicContact CD1-CG2 3.64Å
53	C	96.2	Very high	93.5	Very high	18 Å²	18	53.8 Å²	53.8	12%	0.122	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-45.6	173.2	-84.6	0	0	0	0	111.9	N49 A50 S57 E89 Q91	N49-C53 WeakPolarHBondContact O-CB 3.04Å; N49-C53 PolarHBondContact O-N 3.42Å; A50-C53 PolarHBondContact O-N 3.27Å; C53-S57 VanDerWaalsContact O-CB 3.28Å; C53-S57 WeakPolarHBondContact O-CB 3.31Å; C53-S57 PolarHBondContact O-N 3.45Å; C53-S57 PolarHBondContact O-OG 3.25Å; C53-S57 VanDerWaalsContact O-OG 3.1Å; C53-E89 PolarHBondContact SG-O 2.88Å; C53-E89 VanDerWaalsContact SG-O 3.34Å; C53-Q91 PolarHBondContact O-NE2 2.88Å; C53-Q91 VanDerWaalsContact O-NE2 3.13Å
54	E	95.1	Very high	93.1	Very high	114 Å²	114	60.4 Å²	60.4	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-47.7	177.3	-175.3	-179.4	-180	0	0	111.5	A50 S51 K58	A50-E54 PolarHBondContact O-N 3.29Å; A50-E54 VanDerWaalsContact O-N 3.12Å; S51-E54 PolarHBondContact O-N 2.9Å; E54-K58 HydrophobicContact CG-CD 4.37Å; E54-K58 WeakPolarHBondContact O-CG 3.48Å; E54-K58 PolarHBondContact O-N 3.27Å; E54-K58 VanDerWaalsContact O-N 3.1Å; E54-K58 WeakPolarHBondContact OE1-CE 3.29Å; E54-K58 IonicContact OE1-NZ 3.83Å; E54-K58 PolarHBondContact OE1-NZ 3.45Å
55	F	96.1	Very high	92.7	Very high	6 Å²	6	60.5 Å²	60.5	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-58.5	-53.3	176.6	167.7	-98	0	0	0	112	S51 L52 S57 K58 F59 V137 D140 W148	S51-F55 WeakPolarHBondContact O-CB 3.47Å; S51-F55 PolarHBondContact O-N 2.94Å; L52-F55 HydrophobicContact CD1-CD1 4.12Å; L52-F55 PolarHBondContact O-N 3.05Å; F55-S57 PolarHBondContact O-N 3.34Å; F55-K58 PolarHBondContact O-N 3.06Å; F55-K58 VanDerWaalsContact O-N 3.16Å; F55-F59 HydrophobicContact CZ-CD2 4.31Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 PolarHBondContact O-N 3.47Å; F55-V137 HydrophobicContact CB-CG1 3.87Å; F55-V137 HydrophobicContact CD1-CG2 4.08Å; F55-V137 HydrophobicContact CE1-CG2 4.43Å; F55-V137 HydrophobicContact CG-CG1 4.18Å; F55-V137 HydrophobicContact CG-CG2 4.28Å; F55-D140 VanDerWaalsContact CE2-O 3.3Å; F55-D140 WeakPolarHBondContact CE2-O 3.3Å; F55-W148 HydrophobicContact CE1-CH2 4.16Å; F55-W148 HydrophobicContact CE2-CZ2 4.24Å; F55-W148 AromaticContact CZ-CH2 3.5Å; F55-W148 HydrophobicContact CZ-CH2 3.5Å; F55-W148 VanDerWaalsContact CZ-CH2 3.5Å; F55-W148 AromaticContact CZ-CZ2 3.61Å; F55-W148 HydrophobicContact CZ-CZ2 3.61Å
56	Y	95.9	Very high	92.2	Very high	11 Å²	11	65 Å²	65	4%	0.043	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-41.7	-176.3	-175.6	-99	0	0	0	111.4	L52 K58 F59 K60 E70 I71 Q91 W92	L52-Y56 WeakPolarHBondContact O-CB 3.4Å; L52-Y56 PolarHBondContact O-N 3.29Å; Y56-K58 VanDerWaalsContact C-N 3.34Å; Y56-K58 PolarHBondContact O-N 3.03Å; Y56-F59 PolarHBondContact O-N 3.04Å; Y56-K60 HydrophobicContact CD1-CG 4.09Å; Y56-K60 HydrophobicContact CE1-CD 4.5Å; Y56-K60 HydrophobicContact CE1-CG 3.79Å; Y56-K60 HydrophobicContact CE2-CD 4.48Å; Y56-K60 VanDerWaalsContact CE2-CE 3.5Å; Y56-K60 HydrophobicContact CE2-CG 4.28Å; Y56-K60 HydrophobicContact CG-CG 4.45Å; Y56-K60 WeakPolarHBondContact O-CB 3.49Å; Y56-K60 WeakPolarHBondContact O-CG 3.47Å; Y56-K60 PolarHBondContact O-N 2.84Å; Y56-K60 WeakPolarHBondContact OH-CE 3.44Å; Y56-E70 VanDerWaalsContact OH-CD 3.31Å; Y56-E70 PolarHBondContact OH-OE1 3.11Å; Y56-E70 PolarHBondContact OH-OE2 3.38Å; Y56-I71 HydrophobicContact CD2-CD1 3.45Å; Y56-I71 VanDerWaalsContact CD2-CD1 3.45Å; Y56-I71 HydrophobicContact CD2-CG1 3.85Å; Y56-I71 HydrophobicContact CE2-CB 4.35Å; Y56-I71 HydrophobicContact CE2-CD1 4.03Å; Y56-I71 HydrophobicContact CE2-CG1 3.91Å; Y56-I71 HydrophobicContact CG-CD1 4.11Å; Y56-Q91 HydrophobicContact CD1-CB 3.86Å; Y56-Q91 HydrophobicContact CE1-CB 3.93Å; Y56-W92 HydrophobicContact CD1-CE3 4.12Å; Y56-W92 HydrophobicContact CG-CE3 4.11Å; Y56-W92 HydrophobicContact CG-CZ3 4.4Å
57	S	94.4	Very high	91.9	Very high	30 Å²	30	64 Å²	64	21%	0.21	33%	0.329	C	S	.	.	H	α-helix	trans	-57.8	-44	172.9	-76.3	0	0	0	0	112.5	C53 F55 K61 Q91	C53-S57 VanDerWaalsContact O-CB 3.28Å; C53-S57 WeakPolarHBondContact O-CB 3.31Å; C53-S57 PolarHBondContact O-N 3.45Å; C53-S57 PolarHBondContact O-OG 3.25Å; C53-S57 VanDerWaalsContact O-OG 3.1Å; F55-S57 PolarHBondContact O-N 3.34Å; S57-K61 WeakPolarHBondContact O-CB 3.46Å; S57-K61 VanDerWaalsContact O-CG 3.25Å; S57-K61 WeakPolarHBondContact O-CG 3.36Å; S57-K61 PolarHBondContact O-N 3.09Å; S57-Q91 PolarHBondContact OG-NE2 2.92Å; S57-Q91 PolarHBondContact OG-OE1 2.94Å
58	K	93.4	Very high	91.8	Very high	87 Å²	87	58.3 Å²	58.3	38%	0.378	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-49.3	177.6	-73.5	174.3	-173.1	170.7	0	110.3	E54 F55 Y56 K60 K61 S62	E54-K58 HydrophobicContact CG-CD 4.37Å; E54-K58 WeakPolarHBondContact O-CG 3.48Å; E54-K58 PolarHBondContact O-N 3.27Å; E54-K58 VanDerWaalsContact O-N 3.1Å; E54-K58 WeakPolarHBondContact OE1-CE 3.29Å; E54-K58 IonicContact OE1-NZ 3.83Å; E54-K58 PolarHBondContact OE1-NZ 3.45Å; F55-K58 PolarHBondContact O-N 3.06Å; F55-K58 VanDerWaalsContact O-N 3.16Å; Y56-K58 VanDerWaalsContact C-N 3.34Å; Y56-K58 PolarHBondContact O-N 3.03Å; K58-K60 VanDerWaalsContact C-N 3.35Å; K58-K60 PolarHBondContact O-N 3.06Å; K58-K61 PolarHBondContact O-N 3.49Å; K58-S62 PolarHBondContact O-N 3.27Å; K58-S62 PolarHBondContact O-OG 3.31Å
59	F	93.1	Very high	91.7	Very high	1 Å²	1	57.3 Å²	57.3	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-54	-49.9	178.7	-170.6	-86.7	0	0	0	111.6	F55 Y56 K61 S63 H65 L69 F146 W148	F55-F59 HydrophobicContact CZ-CD2 4.31Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 PolarHBondContact O-N 3.47Å; Y56-F59 PolarHBondContact O-N 3.04Å; F59-K61 VanDerWaalsContact C-N 3.27Å; F59-K61 PolarHBondContact O-N 3.13Å; F59-S63 WeakPolarHBondContact O-CB 3.36Å; F59-S63 PolarHBondContact O-N 2.95Å; F59-H65 HydrophobicContact CE1-CB 4.38Å; F59-H65 WeakPolarHBondContact CE1-O 3.35Å; F59-H65 HydrophobicContact CZ-CB 3.84Å; F59-L69 HydrophobicContact CD1-CB 4.28Å; F59-L69 HydrophobicContact CD1-CD2 3.93Å; F59-L69 HydrophobicContact CE1-CB 3.58Å; F59-L69 HydrophobicContact CE1-CD2 3.84Å; F59-L69 HydrophobicContact CE1-CG 4.36Å; F59-L69 HydrophobicContact CE2-CD2 4.47Å; F59-L69 HydrophobicContact CG-CD2 4.3Å; F59-L69 HydrophobicContact CZ-CB 4.09Å; F59-L69 HydrophobicContact CZ-CD2 4.12Å; F59-F146 HydrophobicContact CE2-CB 4.09Å; F59-F146 AromaticContact CE2-CD2 3.7Å; F59-F146 HydrophobicContact CE2-CD2 3.7Å; F59-F146 HydrophobicContact CE2-CE2 4.31Å; F59-F146 AromaticContact CE2-CG 3.95Å; F59-F146 HydrophobicContact CE2-CG 3.95Å; F59-F146 HydrophobicContact CZ-CB 4.49Å; F59-F146 HydrophobicContact CZ-CD1 4.37Å; F59-F146 AromaticContact CZ-CD2 3.57Å; F59-F146 HydrophobicContact CZ-CD2 3.57Å; F59-F146 AromaticContact CZ-CE2 3.74Å; F59-F146 HydrophobicContact CZ-CE2 3.74Å; F59-F146 AromaticContact CZ-CG 3.89Å; F59-F146 HydrophobicContact CZ-CG 3.89Å; F59-F146 HydrophobicContact CZ-CZ 4.25Å; F59-W148 HydrophobicContact CD2-CH2 4.39Å; F59-W148 HydrophobicContact CE2-CH2 4.07Å; F59-W148 HydrophobicContact CE2-CZ2 4.27Å
60	K	92.3	Very high	91.6	Very high	54 Å²	54	58.2 Å²	58.2	24%	0.235	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-27	178.7	-70.9	-61.7	-169.8	173	0	114.2	Y56 K58 K66 L69	Y56-K60 HydrophobicContact CD1-CG 4.09Å; Y56-K60 HydrophobicContact CE1-CD 4.5Å; Y56-K60 HydrophobicContact CE1-CG 3.79Å; Y56-K60 HydrophobicContact CE2-CD 4.48Å; Y56-K60 VanDerWaalsContact CE2-CE 3.5Å; Y56-K60 HydrophobicContact CE2-CG 4.28Å; Y56-K60 HydrophobicContact CG-CG 4.45Å; Y56-K60 WeakPolarHBondContact O-CB 3.49Å; Y56-K60 WeakPolarHBondContact O-CG 3.47Å; Y56-K60 PolarHBondContact O-N 2.84Å; Y56-K60 WeakPolarHBondContact OH-CE 3.44Å; K58-K60 VanDerWaalsContact C-N 3.35Å; K58-K60 PolarHBondContact O-N 3.06Å; K60-K66 WeakPolarHBondContact CD-O 3.42Å; K60-K66 WeakPolarHBondContact CE-O 3.48Å; K60-K66 PolarHBondContact NZ-O 2.77Å; K60-K66 VanDerWaalsContact O-CB 3.29Å; K60-K66 WeakPolarHBondContact O-CB 3.48Å; K60-L69 WeakPolarHBondContact CE-O 3.21Å; K60-L69 PolarHBondContact NZ-O 2.86Å
61	K	90.3	Very high	91.7	Very high	177 Å²	177	55.2 Å²	55.2	77%	0.77	28%	0.279	S	S	*	.	H	α-helix	trans	-87.2	-43.6	-179.3	-75.1	175.7	-176.9	177.4	0	113.3	S57 K58 F59	S57-K61 WeakPolarHBondContact O-CB 3.46Å; S57-K61 VanDerWaalsContact O-CG 3.25Å; S57-K61 WeakPolarHBondContact O-CG 3.36Å; S57-K61 PolarHBondContact O-N 3.09Å; K58-K61 PolarHBondContact O-N 3.49Å; F59-K61 VanDerWaalsContact C-N 3.27Å; F59-K61 PolarHBondContact O-N 3.13Å
62	S	83.6	Confident	91.8	Very high	89 Å²	89	52.5 Å²	52.5	62%	0.622	26%	0.26	S	S	*	.	H	α-helix	trans	-113.5	-14.5	-166	63	0	0	0	0	115	K58	K58-S62 PolarHBondContact O-N 3.27Å; K58-S62 PolarHBondContact O-OG 3.31Å
63	S	84.2	Confident	91.9	Very high	18 Å²	18	52.5 Å²	52.5	13%	0.126	26%	0.26	C	S	.	.			trans	-79.9	139.9	-179.8	-172.5	0	0	0	0	111.2	F59 H65 K66	F59-S63 WeakPolarHBondContact O-CB 3.36Å; F59-S63 PolarHBondContact O-N 2.95Å; S63-H65 PolarHBondContact O-N 3.3Å; S63-H65 WeakPolarHBondContact OG-CB 3.31Å; S63-H65 PolarHBondContact OG-N 2.89Å; S63-K66 WeakPolarHBondContact O-CB 3.26Å; S63-K66 PolarHBondContact O-N 3.18Å
64	E	85.3	Confident	91.9	Very high	187 Å²	187	51.6 Å²	51.6	87%	0.874	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.1	166.2	-61.2	-176.3	168.5	0	0	111.4
65	H	86.2	Confident	92	Very high	72 Å²	72	46.3 Å²	46.3	33%	0.333	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	15.6	179.4	-59.3	-64.7	0	0	0	114	F59 S63 D67 T68 F146	F59-H65 HydrophobicContact CE1-CB 4.38Å; F59-H65 WeakPolarHBondContact CE1-O 3.35Å; F59-H65 HydrophobicContact CZ-CB 3.84Å; S63-H65 PolarHBondContact O-N 3.3Å; S63-H65 WeakPolarHBondContact OG-CB 3.31Å; S63-H65 PolarHBondContact OG-N 2.89Å; H65-D67 PolarHBondContact O-N 2.65Å; H65-T68 WeakPolarHBondContact CB-OG1 3.37Å; H65-T68 PolarHBondContact O-N 3.01Å; H65-T68 PolarHBondContact O-OG1 3.15Å; H65-F146 HydrophobicContact CB-CD1 3.65Å; H65-F146 HydrophobicContact CB-CE1 3.67Å; H65-F146 HydrophobicContact CB-CG 4.39Å; H65-F146 HydrophobicContact CB-CZ 4.4Å; H65-F146 AromaticContact CD2-CD1 3.56Å; H65-F146 AromaticContact CG-CD1 3.47Å; H65-F146 VanDerWaalsContact CG-CD1 3.47Å; H65-F146 AromaticContact CG-CE1 3.74Å
66	K	83.9	Confident	91.8	Very high	95 Å²	95	47.8 Å²	47.8	41%	0.413	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-33.4	-175.5	60.9	-177.8	-176.7	-176.4	0	115.1	K60 S63	K60-K66 WeakPolarHBondContact CD-O 3.42Å; K60-K66 WeakPolarHBondContact CE-O 3.48Å; K60-K66 PolarHBondContact NZ-O 2.77Å; K60-K66 VanDerWaalsContact O-CB 3.29Å; K60-K66 WeakPolarHBondContact O-CB 3.48Å; S63-K66 WeakPolarHBondContact O-CB 3.26Å; S63-K66 PolarHBondContact O-N 3.18Å
67	D	87.4	Confident	91.7	Very high	86 Å²	86	47.7 Å²	47.7	46%	0.46	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	3.9	-177.4	-61.3	-32.4	0	0	0	113	K29 H65	K29-D67 HydrophobicContact CD-CB 4.38Å; H65-D67 PolarHBondContact O-N 2.65Å
68	T	91.5	Very high	91.5	Very high	31 Å²	31	53.6 Å²	53.6	19%	0.19	27%	0.265	C	S	.	.	S	Bend	trans	-112	-1.1	-172.4	79.8	0	0	0	0	114.3	K29 S31 L32 H65 F146	K29-T68 WeakPolarHBondContact O-CA 3.47Å; S31-T68 PolarHBondContact N-O 3.45Å; S31-T68 VanDerWaalsContact OG-CB 3.27Å; S31-T68 WeakPolarHBondContact OG-CB 3.42Å; S31-T68 PolarHBondContact OG-O 2.79Å; S31-T68 PolarHBondContact OG-OG1 2.94Å; L32-T68 PolarHBondContact N-O 3.02Å; H65-T68 WeakPolarHBondContact CB-OG1 3.37Å; H65-T68 PolarHBondContact O-N 3.01Å; H65-T68 PolarHBondContact O-OG1 3.15Å; T68-F146 WeakPolarHBondContact OG1-CE1 3.43Å; T68-F146 WeakPolarHBondContact OG1-CZ 3.45Å
69	L	94.1	Very high	91.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.7	172.3	175.1	64	0	0	0	109.9	L32 F59 K60 F120 F146 W148	L32-L69 HydrophobicContact CB-CD1 3.95Å; L32-L69 WeakPolarHBondContact O-CA 3.15Å; F59-L69 HydrophobicContact CD1-CB 4.28Å; F59-L69 HydrophobicContact CD1-CD2 3.93Å; F59-L69 HydrophobicContact CE1-CB 3.58Å; F59-L69 HydrophobicContact CE1-CD2 3.84Å; F59-L69 HydrophobicContact CE1-CG 4.36Å; F59-L69 HydrophobicContact CE2-CD2 4.47Å; F59-L69 HydrophobicContact CG-CD2 4.3Å; F59-L69 HydrophobicContact CZ-CB 4.09Å; F59-L69 HydrophobicContact CZ-CD2 4.12Å; K60-L69 WeakPolarHBondContact CE-O 3.21Å; K60-L69 PolarHBondContact NZ-O 2.86Å; L69-F120 HydrophobicContact CD1-CD1 4.15Å; L69-F120 HydrophobicContact CD1-CE1 3.98Å; L69-F146 HydrophobicContact CB-CE2 4.07Å; L69-F146 HydrophobicContact CB-CZ 4.41Å; L69-W148 HydrophobicContact CD2-CH2 3.93Å; L69-W148 HydrophobicContact CD2-CZ3 4.06Å
70	E	94.6	Very high	91.7	Very high	25 Å²	25	56.7 Å²	56.7	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148.9	164.7	-169.9	52.6	-86.2	0	0	110.2	L30 L32 V33 G34 Y56	L30-E70 HydrophobicContact CD1-CB 3.8Å; L30-E70 HydrophobicContact CD2-CB 3.75Å; L30-E70 HydrophobicContact CG-CB 4.45Å; L32-E70 PolarHBondContact O-N 3.12Å; V33-E70 CarbonylContact C-O 3.57Å; V33-E70 VanDerWaalsContact CA-O 3.29Å; V33-E70 WeakPolarHBondContact CA-O 3.42Å; G34-E70 PolarHBondContact N-O 3.45Å; Y56-E70 VanDerWaalsContact OH-CD 3.31Å; Y56-E70 PolarHBondContact OH-OE1 3.11Å; Y56-E70 PolarHBondContact OH-OE2 3.38Å
71	I	96.7	Very high	91.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.3	171.8	-63.4	177.9	0	0	0	108.2	G34 L52 Y56 W92 P93	G34-I71 CarbonylContact O-C 3.59Å; G34-I71 VanDerWaalsContact O-CA 3.26Å; G34-I71 WeakPolarHBondContact O-CA 3.5Å; G34-I71 WeakPolarHBondContact O-CG2 3.15Å; L52-I71 HydrophobicContact CD1-CD1 3.7Å; L52-I71 HydrophobicContact CD2-CD1 4.15Å; L52-I71 HydrophobicContact CD2-CG2 4.5Å; L52-I71 HydrophobicContact CG-CD1 3.99Å; Y56-I71 HydrophobicContact CD2-CD1 3.45Å; Y56-I71 VanDerWaalsContact CD2-CD1 3.45Å; Y56-I71 HydrophobicContact CD2-CG1 3.85Å; Y56-I71 HydrophobicContact CE2-CB 4.35Å; Y56-I71 HydrophobicContact CE2-CD1 4.03Å; Y56-I71 HydrophobicContact CE2-CG1 3.91Å; Y56-I71 HydrophobicContact CG-CD1 4.11Å; I71-W92 HydrophobicContact CB-CB 3.76Å; I71-W92 HydrophobicContact CB-CD2 3.92Å; I71-W92 HydrophobicContact CB-CE3 4.23Å; I71-W92 HydrophobicContact CB-CG 3.69Å; I71-W92 HydrophobicContact CD1-CD2 4.44Å; I71-W92 HydrophobicContact CD1-CE3 4Å; I71-W92 HydrophobicContact CD1-CZ3 4.35Å; I71-W92 HydrophobicContact CG2-CB 4.14Å; I71-W92 HydrophobicContact CG2-CD2 3.61Å; I71-W92 HydrophobicContact CG2-CE3 4.22Å; I71-W92 HydrophobicContact CG2-CG 3.53Å; I71-W92 WeakPolarHBondContact O-CB 3.3Å; I71-P93 WeakPolarHBondContact O-CD 3.25Å
72	V	97.3	Very high	92	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	125	172.6	-177.8	0	0	0	0	109.1	L9 L13 V33 G34 L35 Y36 P93 L95	L9-V72 HydrophobicContact CD1-CG2 3.94Å; L9-V72 HydrophobicContact CD2-CB 4.49Å; L9-V72 HydrophobicContact CD2-CG1 4.23Å; L9-V72 HydrophobicContact CD2-CG2 4.49Å; L13-V72 HydrophobicContact CD1-CG1 4.15Å; L13-V72 HydrophobicContact CD1-CG2 3.87Å; L13-V72 HydrophobicContact CD2-CG1 3.97Å; V33-V72 HydrophobicContact CG1-CG2 4Å; G34-V72 PolarHBondContact O-N 3.36Å; L35-V72 HydrophobicContact CD2-CB 4.29Å; Y36-V72 PolarHBondContact N-O 3.12Å; V72-P93 WeakPolarHBondContact CA-O 3.2Å; V72-L95 HydrophobicContact CG1-CG 4.49Å
73	F	98	Very high	92.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125.7	177.9	-178.1	-129.5	0	0	0	111.7	Y36 S75 F86 M90 P93 A94 L95	Y36-F73 AromaticContact CD1-CD2 3.56Å; Y36-F73 HydrophobicContact CD1-CD2 3.56Å; Y36-F73 HydrophobicContact CD1-CE2 4.08Å; Y36-F73 HydrophobicContact CD1-CG 4.49Å; Y36-F73 AromaticContact CE1-CD2 3.94Å; Y36-F73 HydrophobicContact CE1-CD2 3.94Å; Y36-F73 HydrophobicContact CE1-CE2 4.01Å; Y36-F73 AromaticContact CG-CD2 4Å; Y36-F73 HydrophobicContact CG-CD2 4Å; Y36-F73 CarbonylContact O-C 3.45Å; Y36-F73 WeakPolarHBondContact O-CA 3.42Å; Y36-F73 VanDerWaalsContact O-CD2 3.22Å; Y36-F73 WeakPolarHBondContact O-CD2 3.44Å; F73-S75 VanDerWaalsContact CE1-CB 3.42Å; F73-F86 AromaticContact CE1-CD1 3.94Å; F73-F86 HydrophobicContact CE1-CD1 3.94Å; F73-F86 HydrophobicContact CE1-CE1 4.31Å; F73-F86 HydrophobicContact CE2-CE1 4.22Å; F73-F86 AromaticContact CZ-CD1 3.79Å; F73-F86 HydrophobicContact CZ-CD1 3.79Å; F73-F86 AromaticContact CZ-CE1 3.75Å; F73-F86 HydrophobicContact CZ-CE1 3.75Å; F73-M90 HydrophobicContact CB-SD 4Å; F73-M90 HydrophobicContact CD1-CE 3.93Å; F73-M90 HydrophobicContact CD1-SD 3.88Å; F73-M90 HydrophobicContact CD2-CE 4.12Å; F73-M90 HydrophobicContact CD2-SD 4.31Å; F73-M90 HydrophobicContact CE1-CE 3.88Å; F73-M90 HydrophobicContact CE1-SD 4.42Å; F73-M90 HydrophobicContact CE2-CE 4.12Å; F73-M90 HydrophobicContact CG-CE 4.07Å; F73-M90 HydrophobicContact CG-SD 3.82Å; F73-M90 HydrophobicContact CZ-CE 4.01Å; F73-P93 PolarHBondContact N-O 2.8Å; F73-A94 HydrophobicContact CB-CB 3.85Å; F73-A94 HydrophobicContact CD1-CB 4.06Å; F73-A94 HydrophobicContact CG-CB 4.44Å; F73-A94 WeakPolarHBondContact O-CA 3.09Å; F73-L95 PolarHBondContact O-N 2.83Å
74	V	97.5	Very high	93	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	89.7	176.3	-172.7	0	0	0	0	107.8	Y36 F37 G38 L95 K103 L106 W107	Y36-V74 PolarHBondContact O-N 3.43Å; F37-V74 WeakPolarHBondContact CA-O 3.37Å; F37-V74 HydrophobicContact CD1-CB 3.6Å; F37-V74 HydrophobicContact CD1-CG1 3.59Å; F37-V74 HydrophobicContact CD1-CG2 4.23Å; F37-V74 HydrophobicContact CE1-CB 3.86Å; F37-V74 HydrophobicContact CE1-CG1 3.67Å; F37-V74 HydrophobicContact CE1-CG2 4.04Å; F37-V74 HydrophobicContact CG-CB 4.2Å; F37-V74 HydrophobicContact CZ-CG2 4.39Å; G38-V74 PolarHBondContact N-O 3.36Å; V74-L95 HydrophobicContact CG1-CD1 4.34Å; V74-L95 HydrophobicContact CG2-CD1 4.3Å; V74-K103 HydrophobicContact CG1-CB 4Å; V74-K103 HydrophobicContact CG1-CG 4.12Å; V74-L106 HydrophobicContact CG2-CD1 3.89Å; V74-W107 HydrophobicContact CG1-CE3 4.48Å; V74-W107 HydrophobicContact CG1-CH2 4.16Å; V74-W107 HydrophobicContact CG1-CZ2 4.23Å; V74-W107 HydrophobicContact CG1-CZ3 4.34Å
75	S	95.6	Very high	93.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	132.6	-172.9	165.4	0	0	0	0	113.6	G38 F73 D77 K103 W107	G38-S75 WeakPolarHBondContact O-CA 3.05Å; F73-S75 VanDerWaalsContact CE1-CB 3.42Å; S75-D77 WeakPolarHBondContact OG-CB 3.49Å; S75-D77 VanDerWaalsContact OG-CG 3.25Å; S75-D77 PolarHBondContact OG-N 3.1Å; S75-D77 PolarHBondContact OG-OD2 3.34Å; S75-K103 WeakPolarHBondContact O-CD 3.33Å; S75-K103 PolarHBondContact O-NZ 3.31Å; S75-W107 VanDerWaalsContact C-CH2 3.44Å; S75-W107 VanDerWaalsContact O-CH2 3.31Å; S75-W107 WeakPolarHBondContact O-CH2 3.49Å
76	S	93.2	Very high	93.8	Very high	37 Å²	37	44.9 Å²	44.9	26%	0.259	22%	0.22	S	C	.	.			trans	-94.7	14.9	166.8	71.6	0	0	0	0	113.9	G38 C39 W107	G38-S76 PolarHBondContact O-N 2.83Å; G38-S76 PolarHBondContact O-OG 3.03Å; C39-S76 WeakPolarHBondContact CB-OG 3.35Å; S76-W107 VanDerWaalsContact CA-CH2 3.49Å
77	D	92.9	Very high	94.3	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.053	20%	0.201	C	C	.	.			trans	-64.5	137.4	178.8	-66.3	-70.1	0	0	0	110.8	C39 S40 S75 W83 F97	C39-D77 PolarHBondContact SG-OD1 3.4Å; S40-D77 VanDerWaalsContact CB-OD1 3.22Å; S40-D77 WeakPolarHBondContact CB-OD1 3.3Å; S40-D77 PolarHBondContact N-OD1 3.15Å; S40-D77 PolarHBondContact N-OD2 2.76Å; S40-D77 PolarHBondContact OG-OD1 2.85Å; S75-D77 WeakPolarHBondContact OG-CB 3.49Å; S75-D77 VanDerWaalsContact OG-CG 3.25Å; S75-D77 PolarHBondContact OG-N 3.1Å; S75-D77 PolarHBondContact OG-OD2 3.34Å; D77-W83 HydrophobicContact CB-CB 3.96Å; D77-F97 HydrophobicContact CB-CE2 4.4Å; D77-F97 WeakPolarHBondContact O-CE2 3.31Å
78	Q	91.3	Very high	94.7	Very high	153 Å²	153	42.4 Å²	42.4	72%	0.715	21%	0.207	S	C	*	.	S	Bend	trans	-91.4	-18.3	176.7	-61.1	-59.5	-32.5	0	0	112.4
79	D	94.3	Very high	94.8	Very high	71 Å²	71	46.1 Å²	46.1	38%	0.38	22%	0.222	S	C	.	.			trans	-112.9	131.5	-178.6	178	-100.7	0	0	0	111	K81 H82 W83	D79-K81 VanDerWaalsContact C-N 3.34Å; D79-K81 PolarHBondContact O-N 2.95Å; D79-K81 WeakPolarHBondContact OD1-CA 3.29Å; D79-K81 VanDerWaalsContact OD1-CB 3.28Å; D79-K81 WeakPolarHBondContact OD1-CB 3.31Å; D79-K81 PolarHBondContact OD1-N 3.08Å; D79-H82 HydrophobicContact CB-CB 4.37Å; D79-H82 IonicContact OD1-CG 2.68Å; D79-H82 PolarHBondContact OD1-N 3.01Å; D79-H82 IonicContact OD1-ND1 2.86Å; D79-W83 WeakPolarHBondContact O-CB 3.31Å; D79-W83 PolarHBondContact O-N 3.24Å
80	Q	94.6	Very high	94.8	Very high	82 Å²	82	46.5 Å²	46.5	38%	0.383	22%	0.224	S	C	.	.	H	α-helix	trans	-69.2	-34.5	-176	-175.7	174.3	-19.6	0	0	112	W83 Q84 F97	Q80-W83 PolarHBondContact O-N 2.84Å; Q80-Q84 HydrophobicContact CG-CG 4.4Å; Q80-Q84 VanDerWaalsContact NE2-NE2 3.16Å; Q80-Q84 WeakPolarHBondContact O-CB 3.36Å; Q80-Q84 VanDerWaalsContact O-CG 3.3Å; Q80-Q84 WeakPolarHBondContact O-CG 3.29Å; Q80-Q84 PolarHBondContact O-N 3.2Å; Q80-F97 HydrophobicContact CB-CD1 3.76Å; Q80-F97 HydrophobicContact CB-CE1 3.63Å; Q80-F97 HydrophobicContact CB-CE2 4.41Å; Q80-F97 HydrophobicContact CB-CG 4.22Å; Q80-F97 HydrophobicContact CB-CZ 3.98Å; Q80-F97 HydrophobicContact CG-CB 4.48Å; Q80-F97 HydrophobicContact CG-CD1 3.86Å; Q80-F97 HydrophobicContact CG-CE1 4.27Å; Q80-F97 HydrophobicContact CG-CG 4.08Å
81	K	94.4	Very high	94.8	Very high	133 Å²	133	49.7 Å²	49.7	58%	0.578	24%	0.239	S	C	*	.	H	α-helix	trans	-69.7	-48	-177.5	-177.9	-178.2	176.8	-176.8	0	110.3	D79 W83 Q84 D85	D79-K81 VanDerWaalsContact C-N 3.34Å; D79-K81 PolarHBondContact O-N 2.95Å; D79-K81 WeakPolarHBondContact OD1-CA 3.29Å; D79-K81 VanDerWaalsContact OD1-CB 3.28Å; D79-K81 WeakPolarHBondContact OD1-CB 3.31Å; D79-K81 PolarHBondContact OD1-N 3.08Å; K81-W83 VanDerWaalsContact C-N 3.26Å; K81-W83 PolarHBondContact O-N 3.39Å; K81-Q84 PolarHBondContact O-N 2.72Å; K81-Q84 VanDerWaalsContact O-N 3.1Å; K81-D85 VanDerWaalsContact O-CG 3.28Å; K81-D85 PolarHBondContact O-N 3.43Å
82	H	94.4	Very high	94.7	Very high	76 Å²	76	49.8 Å²	49.8	35%	0.352	24%	0.239	S	C	.	.	H	α-helix	trans	-59.1	-39	174.7	-64.7	147.2	0	0	0	112.5	S40 D79 F86	S40-H82 WeakPolarHBondContact OG-CB 3.43Å; D79-H82 HydrophobicContact CB-CB 4.37Å; D79-H82 IonicContact OD1-CG 2.68Å; D79-H82 PolarHBondContact OD1-N 3.01Å; D79-H82 IonicContact OD1-ND1 2.86Å; H82-F86 WeakPolarHBondContact O-CB 3.45Å; H82-F86 PolarHBondContact O-N 3.35Å
83	W	95.4	Very high	94.6	Very high	6 Å²	6	50.2 Å²	50.2	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-45.5	173	175.4	72.5	0	0	0	112.6	V14 D77 D79 Q80 K81 L87 A94 L95 F97	V14-W83 HydrophobicContact CB-CH2 3.97Å; V14-W83 HydrophobicContact CG1-CH2 3.88Å; V14-W83 HydrophobicContact CG2-CH2 4.32Å; D77-W83 HydrophobicContact CB-CB 3.96Å; D79-W83 WeakPolarHBondContact O-CB 3.31Å; D79-W83 PolarHBondContact O-N 3.24Å; Q80-W83 PolarHBondContact O-N 2.84Å; K81-W83 VanDerWaalsContact C-N 3.26Å; K81-W83 PolarHBondContact O-N 3.39Å; W83-L87 HydrophobicContact CH2-CD2 3.71Å; W83-L87 HydrophobicContact CZ2-CD2 3.79Å; W83-L87 HydrophobicContact CZ3-CD2 4.27Å; W83-L87 WeakPolarHBondContact O-CB 3.18Å; W83-L87 PolarHBondContact O-N 2.99Å; W83-A94 HydrophobicContact CZ2-CB 3.82Å; W83-L95 WeakPolarHBondContact CZ2-O 3.22Å; W83-F97 HydrophobicContact CB-CD2 3.72Å; W83-F97 HydrophobicContact CB-CE2 4.02Å; W83-F97 HydrophobicContact CD2-CB 3.88Å; W83-F97 AromaticContact CD2-CD2 3.89Å; W83-F97 HydrophobicContact CD2-CD2 3.89Å; W83-F97 HydrophobicContact CD2-CG 4.3Å; W83-F97 HydrophobicContact CE3-CB 3.69Å; W83-F97 HydrophobicContact CE3-CD2 4.23Å; W83-F97 HydrophobicContact CE3-CG 4.26Å; W83-F97 AromaticContact CG-CD2 3.65Å; W83-F97 HydrophobicContact CG-CD2 3.65Å; W83-F97 HydrophobicContact CG-CE2 4.39Å; W83-F97 HydrophobicContact CG-CG 4.5Å; W83-F97 HydrophobicContact CH2-CB 4.27Å; W83-F97 HydrophobicContact CZ2-CB 4.41Å; W83-F97 HydrophobicContact CZ3-CB 3.92Å
84	Q	94.8	Very high	94.6	Very high	61 Å²	61	50.2 Å²	50.2	29%	0.285	24%	0.242	S	C	.	.	H	α-helix	trans	-64.4	-46.8	178.2	-76.1	174.3	-19	0	0	112	T18 Q80 K81 F86 L87 Q88	T18-Q84 HydrophobicContact CG2-CG 4.33Å; Q80-Q84 HydrophobicContact CG-CG 4.4Å; Q80-Q84 VanDerWaalsContact NE2-NE2 3.16Å; Q80-Q84 WeakPolarHBondContact O-CB 3.36Å; Q80-Q84 VanDerWaalsContact O-CG 3.3Å; Q80-Q84 WeakPolarHBondContact O-CG 3.29Å; Q80-Q84 PolarHBondContact O-N 3.2Å; K81-Q84 PolarHBondContact O-N 2.72Å; K81-Q84 VanDerWaalsContact O-N 3.1Å; Q84-F86 VanDerWaalsContact C-N 3.29Å; Q84-F86 PolarHBondContact O-N 3.07Å; Q84-L87 WeakPolarHBondContact O-CB 3.5Å; Q84-L87 PolarHBondContact O-N 2.81Å; Q84-Q88 PolarHBondContact O-N 3.24Å
85	D	94.1	Very high	94.6	Very high	70 Å²	70	50.2 Å²	50.2	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-43.3	179.6	-67.7	-17.4	0	0	0	110.3	K81 Q88	K81-D85 VanDerWaalsContact O-CG 3.28Å; K81-D85 PolarHBondContact O-N 3.43Å; D85-Q88 WeakPolarHBondContact O-CB 3.22Å; D85-Q88 PolarHBondContact O-N 3.09Å
86	F	94.6	Very high	94.6	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-70.4	-33.6	178.3	-167.4	-136.7	0	0	0	113.1	S40 K46 N49 F73 H82 Q84 Q88 E89 M90	S40-F86 VanDerWaalsContact CB-CB 3.49Å; K46-F86 HydrophobicContact CG-CE2 4.43Å; N49-F86 HydrophobicContact CB-CE2 3.98Å; N49-F86 HydrophobicContact CB-CZ 3.83Å; F73-F86 AromaticContact CE1-CD1 3.94Å; F73-F86 HydrophobicContact CE1-CD1 3.94Å; F73-F86 HydrophobicContact CE1-CE1 4.31Å; F73-F86 HydrophobicContact CE2-CE1 4.22Å; F73-F86 AromaticContact CZ-CD1 3.79Å; F73-F86 HydrophobicContact CZ-CD1 3.79Å; F73-F86 AromaticContact CZ-CE1 3.75Å; F73-F86 HydrophobicContact CZ-CE1 3.75Å; H82-F86 WeakPolarHBondContact O-CB 3.45Å; H82-F86 PolarHBondContact O-N 3.35Å; Q84-F86 VanDerWaalsContact C-N 3.29Å; Q84-F86 PolarHBondContact O-N 3.07Å; F86-Q88 PolarHBondContact O-N 2.85Å; F86-E89 WeakPolarHBondContact O-CB 3.47Å; F86-E89 PolarHBondContact O-N 3.43Å; F86-E89 VanDerWaalsContact O-N 3.08Å; F86-M90 HydrophobicContact CD1-CE 3.17Å; F86-M90 HydrophobicContact CD2-CE 4.11Å; F86-M90 HydrophobicContact CE1-CE 3.04Å; F86-M90 HydrophobicContact CE2-CE 4Å; F86-M90 HydrophobicContact CG-CE 3.72Å; F86-M90 HydrophobicContact CZ-CE 3.49Å; F86-M90 VanDerWaalsContact CZ-CE 3.49Å
87	L	94.6	Very high	94.6	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-29.8	175.5	-170.8	58.7	0	0	0	112.2	V14 N15 S16 W83 Q84 E89 M90 A94	V14-L87 HydrophobicContact CG1-CD2 4.1Å; N15-L87 WeakPolarHBondContact O-CD2 3.38Å; S16-L87 WeakPolarHBondContact CB-O 3.4Å; W83-L87 HydrophobicContact CH2-CD2 3.71Å; W83-L87 HydrophobicContact CZ2-CD2 3.79Å; W83-L87 HydrophobicContact CZ3-CD2 4.27Å; W83-L87 WeakPolarHBondContact O-CB 3.18Å; W83-L87 PolarHBondContact O-N 2.99Å; Q84-L87 WeakPolarHBondContact O-CB 3.5Å; Q84-L87 PolarHBondContact O-N 2.81Å; L87-E89 PolarHBondContact O-N 2.69Å; L87-M90 HydrophobicContact CD1-SD 4.4Å; L87-M90 PolarHBondContact O-N 2.95Å; L87-A94 HydrophobicContact CD1-CB 3.55Å; L87-A94 HydrophobicContact CD2-CB 4.26Å
88	Q	94.7	Very high	94.6	Very high	128 Å²	128	59 Å²	59	60%	0.598	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.9	174.6	-67.3	174	17.1	0	0	113.1	Q84 D85 F86 M90	Q84-Q88 PolarHBondContact O-N 3.24Å; D85-Q88 WeakPolarHBondContact O-CB 3.22Å; D85-Q88 PolarHBondContact O-N 3.09Å; F86-Q88 PolarHBondContact O-N 2.85Å; Q88-M90 VanDerWaalsContact C-N 3.28Å
89	E	93.9	Very high	94.6	Very high	109 Å²	109	53.8 Å²	53.8	51%	0.509	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.2	176.1	-57.3	-178.5	-166.5	0	0	112.9	C53 F86 L87	C53-E89 PolarHBondContact SG-O 2.88Å; C53-E89 VanDerWaalsContact SG-O 3.34Å; F86-E89 WeakPolarHBondContact O-CB 3.47Å; F86-E89 PolarHBondContact O-N 3.43Å; F86-E89 VanDerWaalsContact O-N 3.08Å; L87-E89 PolarHBondContact O-N 2.69Å
90	M	93.6	Very high	94.3	Very high	7 Å²	7	57.6 Å²	57.6	3%	0.034	26%	0.264	C	S	.	.			trans	-109.3	152.9	-173.1	-60	179.2	-170.7	0	0	112.5	Y36 N49 F73 F86 L87 Q88 W92	Y36-M90 HydrophobicContact CE1-CE 4.16Å; N49-M90 WeakPolarHBondContact OD1-CG 3.49Å; F73-M90 HydrophobicContact CB-SD 4Å; F73-M90 HydrophobicContact CD1-CE 3.93Å; F73-M90 HydrophobicContact CD1-SD 3.88Å; F73-M90 HydrophobicContact CD2-CE 4.12Å; F73-M90 HydrophobicContact CD2-SD 4.31Å; F73-M90 HydrophobicContact CE1-CE 3.88Å; F73-M90 HydrophobicContact CE1-SD 4.42Å; F73-M90 HydrophobicContact CE2-CE 4.12Å; F73-M90 HydrophobicContact CG-CE 4.07Å; F73-M90 HydrophobicContact CG-SD 3.82Å; F73-M90 HydrophobicContact CZ-CE 4.01Å; F86-M90 HydrophobicContact CD1-CE 3.17Å; F86-M90 HydrophobicContact CD2-CE 4.11Å; F86-M90 HydrophobicContact CE1-CE 3.04Å; F86-M90 HydrophobicContact CE2-CE 4Å; F86-M90 HydrophobicContact CG-CE 3.72Å; F86-M90 HydrophobicContact CZ-CE 3.49Å; F86-M90 VanDerWaalsContact CZ-CE 3.49Å; L87-M90 HydrophobicContact CD1-SD 4.4Å; L87-M90 PolarHBondContact O-N 2.95Å; Q88-M90 VanDerWaalsContact C-N 3.28Å; M90-W92 HydrophobicContact CB-CD2 4.24Å; M90-W92 HydrophobicContact CB-CG 4.49Å; M90-W92 HydrophobicContact CB-CZ2 4.04Å; M90-W92 HydrophobicContact CG-CZ2 3.73Å; M90-W92 HydrophobicContact SD-CZ2 3.96Å; M90-W92 PolarHBondContact SD-NE1 2.87Å
91	Q	93.9	Very high	93.8	Very high	93 Å²	93	59.7 Å²	59.7	44%	0.435	27%	0.274	S	S	.	.	S	Bend	trans	-97.5	-5.2	176.2	-71.5	166.2	75.6	0	0	113.4	C53 Y56 S57	C53-Q91 PolarHBondContact O-NE2 2.88Å; C53-Q91 VanDerWaalsContact O-NE2 3.13Å; Y56-Q91 HydrophobicContact CD1-CB 3.86Å; Y56-Q91 HydrophobicContact CE1-CB 3.93Å; S57-Q91 PolarHBondContact OG-NE2 2.92Å; S57-Q91 PolarHBondContact OG-OE1 2.94Å
92	W	94.8	Very high	93.5	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.008	26%	0.255	C	S	.	.	S	Bend	trans	-117	157	-174.1	53.9	74.2	0	0	0	111.2	Y36 N49 L52 Y56 I71 M90	Y36-W92 AromaticContact CD1-CZ2 3.87Å; Y36-W92 HydrophobicContact CD1-CZ2 3.87Å; Y36-W92 HydrophobicContact CE1-CZ2 4.17Å; N49-W92 WeakPolarHBondContact OD1-CZ2 3.47Å; L52-W92 HydrophobicContact CB-CH2 3.77Å; L52-W92 HydrophobicContact CB-CZ3 4.32Å; L52-W92 HydrophobicContact CD2-CH2 3.48Å; L52-W92 VanDerWaalsContact CD2-CH2 3.48Å; L52-W92 HydrophobicContact CD2-CZ2 3.6Å; L52-W92 HydrophobicContact CD2-CZ3 4.06Å; L52-W92 HydrophobicContact CG-CH2 3.42Å; L52-W92 VanDerWaalsContact CG-CH2 3.42Å; L52-W92 HydrophobicContact CG-CZ2 4.1Å; L52-W92 HydrophobicContact CG-CZ3 3.69Å; Y56-W92 HydrophobicContact CD1-CE3 4.12Å; Y56-W92 HydrophobicContact CG-CE3 4.11Å; Y56-W92 HydrophobicContact CG-CZ3 4.4Å; I71-W92 HydrophobicContact CB-CB 3.76Å; I71-W92 HydrophobicContact CB-CD2 3.92Å; I71-W92 HydrophobicContact CB-CE3 4.23Å; I71-W92 HydrophobicContact CB-CG 3.69Å; I71-W92 HydrophobicContact CD1-CD2 4.44Å; I71-W92 HydrophobicContact CD1-CE3 4Å; I71-W92 HydrophobicContact CD1-CZ3 4.35Å; I71-W92 HydrophobicContact CG2-CB 4.14Å; I71-W92 HydrophobicContact CG2-CD2 3.61Å; I71-W92 HydrophobicContact CG2-CE3 4.22Å; I71-W92 HydrophobicContact CG2-CG 3.53Å; I71-W92 WeakPolarHBondContact O-CB 3.3Å; M90-W92 HydrophobicContact CB-CD2 4.24Å; M90-W92 HydrophobicContact CB-CG 4.49Å; M90-W92 HydrophobicContact CB-CZ2 4.04Å; M90-W92 HydrophobicContact CG-CZ2 3.73Å; M90-W92 HydrophobicContact SD-CZ2 3.96Å; M90-W92 PolarHBondContact SD-NE1 2.87Å
93	P	96.3	Very high	93.3	Very high	10 Å²	10	52.1 Å²	52.1	7%	0.065	24%	0.24	C	C	.	.			trans	-74	166.5	178.5	31.8	-37.6	0	0	0	113.1	L13 V14 I71 V72 F73	L13-P93 HydrophobicContact CB-CB 3.84Å; L13-P93 HydrophobicContact CB-CG 4.5Å; L13-P93 HydrophobicContact CD1-CB 3.93Å; L13-P93 HydrophobicContact CD1-CG 3.67Å; V14-P93 CarbonylContact O-C 3.52Å; V14-P93 WeakPolarHBondContact O-CA 3.4Å; I71-P93 WeakPolarHBondContact O-CD 3.25Å; V72-P93 WeakPolarHBondContact CA-O 3.2Å; F73-P93 PolarHBondContact N-O 2.8Å
94	A	97.4	Very high	92.8	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-125.5	156.2	177	0	0	0	0	0	111.9	L13 V14 F73 W83 L87	L13-A94 WeakPolarHBondContact CA-O 3.45Å; L13-A94 WeakPolarHBondContact CB-O 3.33Å; V14-A94 PolarHBondContact N-O 3Å; V14-A94 PolarHBondContact O-N 2.91Å; F73-A94 HydrophobicContact CB-CB 3.85Å; F73-A94 HydrophobicContact CD1-CB 4.06Å; F73-A94 HydrophobicContact CG-CB 4.44Å; F73-A94 WeakPolarHBondContact O-CA 3.09Å; W83-A94 HydrophobicContact CZ2-CB 3.82Å; L87-A94 HydrophobicContact CD1-CB 3.55Å; L87-A94 HydrophobicContact CD2-CB 4.26Å
95	L	96.9	Very high	92.3	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.267	C	S	.	.			trans	-60.8	139.5	163.5	-78.7	-175.1	0	0	0	110.3	L9 L13 V72 F73 V74 W83 F97 K102 K103 L106	L9-L95 HydrophobicContact CB-CD2 4.49Å; L9-L95 WeakPolarHBondContact O-CD2 3.41Å; L13-L95 HydrophobicContact CD2-CD2 3.7Å; L13-L95 HydrophobicContact CD2-CG 4.47Å; V72-L95 HydrophobicContact CG1-CG 4.49Å; F73-L95 PolarHBondContact O-N 2.83Å; V74-L95 HydrophobicContact CG1-CD1 4.34Å; V74-L95 HydrophobicContact CG2-CD1 4.3Å; W83-L95 WeakPolarHBondContact CZ2-O 3.22Å; L95-F97 PolarHBondContact O-N 2.97Å; L95-K102 HydrophobicContact CD1-CD 4.37Å; L95-K102 HydrophobicContact CD1-CG 4.25Å; L95-K102 HydrophobicContact CD2-CD 3.91Å; L95-K103 HydrophobicContact CB-CG 4.16Å; L95-K103 HydrophobicContact CD1-CB 4.48Å; L95-K103 HydrophobicContact CD1-CG 3.69Å; L95-L106 HydrophobicContact CD1-CD1 3.54Å
96	P	96.1	Very high	92.1	Very high	33 Å²	33	54.9 Å²	54.9	21%	0.214	25%	0.25	C	S	.	.			trans	-51.4	136.8	177.8	-25.8	32.9	0	0	0	112.1	V14 K98 D99 K103	V14-P96 HydrophobicContact CG2-CB 4.17Å; V14-P96 HydrophobicContact CG2-CG 4.09Å; P96-K98 PolarHBondContact O-N 3.01Å; P96-K98 VanDerWaalsContact O-N 3.11Å; P96-D99 HydrophobicContact CB-CB 4.35Å; P96-D99 PolarHBondContact O-N 2.62Å; P96-K103 VanDerWaalsContact O-CE 3.32Å; P96-K103 WeakPolarHBondContact O-CE 3.25Å
97	F	94.1	Very high	91.8	Very high	24 Å²	24	56.3 Å²	56.3	11%	0.105	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-43.1	-176.9	-179	-104.7	0	0	0	113.1	D77 Q80 W83 L95 D99 K103	D77-F97 HydrophobicContact CB-CE2 4.4Å; D77-F97 WeakPolarHBondContact O-CE2 3.31Å; Q80-F97 HydrophobicContact CB-CD1 3.76Å; Q80-F97 HydrophobicContact CB-CE1 3.63Å; Q80-F97 HydrophobicContact CB-CE2 4.41Å; Q80-F97 HydrophobicContact CB-CG 4.22Å; Q80-F97 HydrophobicContact CB-CZ 3.98Å; Q80-F97 HydrophobicContact CG-CB 4.48Å; Q80-F97 HydrophobicContact CG-CD1 3.86Å; Q80-F97 HydrophobicContact CG-CE1 4.27Å; Q80-F97 HydrophobicContact CG-CG 4.08Å; W83-F97 HydrophobicContact CB-CD2 3.72Å; W83-F97 HydrophobicContact CB-CE2 4.02Å; W83-F97 HydrophobicContact CD2-CB 3.88Å; W83-F97 AromaticContact CD2-CD2 3.89Å; W83-F97 HydrophobicContact CD2-CD2 3.89Å; W83-F97 HydrophobicContact CD2-CG 4.3Å; W83-F97 HydrophobicContact CE3-CB 3.69Å; W83-F97 HydrophobicContact CE3-CD2 4.23Å; W83-F97 HydrophobicContact CE3-CG 4.26Å; W83-F97 AromaticContact CG-CD2 3.65Å; W83-F97 HydrophobicContact CG-CD2 3.65Å; W83-F97 HydrophobicContact CG-CE2 4.39Å; W83-F97 HydrophobicContact CG-CG 4.5Å; W83-F97 HydrophobicContact CH2-CB 4.27Å; W83-F97 HydrophobicContact CZ2-CB 4.41Å; W83-F97 HydrophobicContact CZ3-CB 3.92Å; L95-F97 PolarHBondContact O-N 2.97Å; F97-D99 VanDerWaalsContact C-N 3.29Å; F97-D99 PolarHBondContact O-N 3.42Å; F97-K103 PolarHBondContact O-NZ 2.92Å; F97-K103 VanDerWaalsContact O-NZ 3.08Å
98	K	92.4	Very high	91.1	Very high	177 Å²	177	58.2 Å²	58.2	77%	0.77	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-17.4	-176.9	-64.7	-176.3	178.7	178.4	0	114.2	P96 R100	P96-K98 PolarHBondContact O-N 3.01Å; P96-K98 VanDerWaalsContact O-N 3.11Å; K98-R100 PolarHBondContact O-N 2.64Å
99	D	92.1	Very high	90.6	Very high	42 Å²	42	57.6 Å²	57.6	23%	0.225	26%	0.261	C	S	.	.			trans	-82.4	58.7	-175.9	-162.1	-3.7	0	0	0	112.2	P96 F97 H101 K102 K103	P96-D99 HydrophobicContact CB-CB 4.35Å; P96-D99 PolarHBondContact O-N 2.62Å; F97-D99 VanDerWaalsContact C-N 3.29Å; F97-D99 PolarHBondContact O-N 3.42Å; D99-H101 VanDerWaalsContact C-N 3.3Å; D99-H101 PolarHBondContact O-N 2.99Å; D99-K102 HydrophobicContact CB-CB 4.48Å; D99-K102 PolarHBondContact O-N 2.7Å; D99-K102 WeakPolarHBondContact OD1-CB 3.22Å; D99-K102 PolarHBondContact OD1-N 3.45Å; D99-K102 VanDerWaalsContact OD2-CB 3.3Å; D99-K102 WeakPolarHBondContact OD2-CB 3.18Å; D99-K102 WeakPolarHBondContact OD2-CD 3.35Å; D99-K102 VanDerWaalsContact OD2-CE 3.3Å; D99-K102 WeakPolarHBondContact OD2-CE 3.37Å; D99-K102 IonicContact OD2-NZ 3.94Å; D99-K102 PolarHBondContact OD2-NZ 3.47Å; D99-K103 VanDerWaalsContact O-CG 3.29Å; D99-K103 WeakPolarHBondContact O-CG 3.16Å; D99-K103 PolarHBondContact O-N 3.35Å
100	R	87.2	Confident	90.3	Very high	151 Å²	151	52.6 Å²	52.6	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-59.7	-41.7	-176.6	-69	-178.5	172.1	-179.1	-4.9	112	K98 K103 M104	K98-R100 PolarHBondContact O-N 2.64Å; R100-K103 PolarHBondContact O-N 2.85Å; R100-M104 WeakPolarHBondContact O-CG 3.48Å; R100-M104 PolarHBondContact O-N 2.81Å
101	H	83.1	Confident	89.8	Confident	126 Å²	126	56 Å²	56	58%	0.583	25%	0.253	S	S	*	.	H	α-helix	trans	-64.2	-43.5	-177.7	177.9	-106.6	0	0	0	111.9	D99 M104 K105	D99-H101 VanDerWaalsContact C-N 3.3Å; D99-H101 PolarHBondContact O-N 2.99Å; H101-M104 PolarHBondContact O-N 3.04Å; H101-K105 WeakPolarHBondContact CE1-CE 3.35Å; H101-K105 PolarHBondContact O-N 3.04Å
102	K	88.3	Confident	89.4	Confident	44 Å²	44	52.6 Å²	52.6	19%	0.191	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-41.3	176.7	-170.7	177	-68.5	138.7	0	112.4	L9 L95 D99 M104 K105 L106	L9-K102 VanDerWaalsContact C-CD 3.43Å; L9-K102 WeakPolarHBondContact O-CD 3.49Å; L9-K102 PolarHBondContact O-NZ 3.15Å; L95-K102 HydrophobicContact CD1-CD 4.37Å; L95-K102 HydrophobicContact CD1-CG 4.25Å; L95-K102 HydrophobicContact CD2-CD 3.91Å; D99-K102 HydrophobicContact CB-CB 4.48Å; D99-K102 PolarHBondContact O-N 2.7Å; D99-K102 WeakPolarHBondContact OD1-CB 3.22Å; D99-K102 PolarHBondContact OD1-N 3.45Å; D99-K102 VanDerWaalsContact OD2-CB 3.3Å; D99-K102 WeakPolarHBondContact OD2-CB 3.18Å; D99-K102 WeakPolarHBondContact OD2-CD 3.35Å; D99-K102 VanDerWaalsContact OD2-CE 3.3Å; D99-K102 WeakPolarHBondContact OD2-CE 3.37Å; D99-K102 IonicContact OD2-NZ 3.94Å; D99-K102 PolarHBondContact OD2-NZ 3.47Å; K102-M104 VanDerWaalsContact C-N 3.31Å; K102-M104 PolarHBondContact O-N 3.41Å; K102-K105 PolarHBondContact O-N 3.24Å; K102-L106 PolarHBondContact O-N 2.95Å
103	K	91.8	Very high	88.7	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-57.2	-47.1	174.9	-65.1	166.5	171.8	-171.1	0	110.8	V74 S75 L95 P96 F97 D99 R100 L106 W107	V74-K103 HydrophobicContact CG1-CB 4Å; V74-K103 HydrophobicContact CG1-CG 4.12Å; S75-K103 WeakPolarHBondContact O-CD 3.33Å; S75-K103 PolarHBondContact O-NZ 3.31Å; L95-K103 HydrophobicContact CB-CG 4.16Å; L95-K103 HydrophobicContact CD1-CB 4.48Å; L95-K103 HydrophobicContact CD1-CG 3.69Å; P96-K103 VanDerWaalsContact O-CE 3.32Å; P96-K103 WeakPolarHBondContact O-CE 3.25Å; F97-K103 PolarHBondContact O-NZ 2.92Å; F97-K103 VanDerWaalsContact O-NZ 3.08Å; D99-K103 VanDerWaalsContact O-CG 3.29Å; D99-K103 WeakPolarHBondContact O-CG 3.16Å; D99-K103 PolarHBondContact O-N 3.35Å; R100-K103 PolarHBondContact O-N 2.85Å; K103-L106 PolarHBondContact O-N 3.1Å; K103-W107 HydrophobicContact CB-CE3 4.04Å; K103-W107 HydrophobicContact CB-CH2 4.28Å; K103-W107 HydrophobicContact CB-CZ3 3.51Å; K103-W107 PolarHBondContact O-N 2.72Å
104	M	83.6	Confident	88.2	Confident	89 Å²	89	60.8 Å²	60.8	44%	0.438	29%	0.291	S	S	.	.	H	α-helix	trans	-58.5	-47.1	173.8	-71.1	-53.7	-55.2	0	0	112.5	R100 H101 K102 L106 W107 N108	R100-M104 WeakPolarHBondContact O-CG 3.48Å; R100-M104 PolarHBondContact O-N 2.81Å; H101-M104 PolarHBondContact O-N 3.04Å; K102-M104 VanDerWaalsContact C-N 3.31Å; K102-M104 PolarHBondContact O-N 3.41Å; M104-L106 VanDerWaalsContact C-N 3.27Å; M104-L106 PolarHBondContact O-N 3.09Å; M104-W107 PolarHBondContact O-N 3.2Å; M104-W107 HydrophobicContact SD-CE3 3.95Å; M104-W107 HydrophobicContact SD-CZ3 4.34Å; M104-N108 WeakPolarHBondContact O-CB 3.4Å; M104-N108 PolarHBondContact O-N 3.14Å; M104-N108 PolarHBondContact O-ND2 2.85Å; M104-N108 PolarHBondContact O-OD1 2.64Å
105	K	83.8	Confident	87.9	Confident	102 Å²	102	63.4 Å²	63.4	44%	0.443	30%	0.304	S	S	.	.	H	α-helix	trans	-56.1	-39.9	175	-79.2	-169.9	162	-171	0	112.4	H101 K102 K109	H101-K105 WeakPolarHBondContact CE1-CE 3.35Å; H101-K105 PolarHBondContact O-N 3.04Å; K102-K105 PolarHBondContact O-N 3.24Å; K105-K109 WeakPolarHBondContact O-CB 3.36Å; K105-K109 PolarHBondContact O-N 3.2Å
106	L	90.9	Very high	87.9	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-70.5	-42.1	177	-68.8	-178.8	0	0	0	113	L8 L9 F37 V74 L95 K102 K103 M104 N108 K109 Y110	L8-L106 HydrophobicContact CD1-CD2 3.58Å; L8-L106 HydrophobicContact CG-CD2 3.96Å; L9-L106 HydrophobicContact CD2-CD1 4.32Å; F37-L106 HydrophobicContact CE1-CB 3.98Å; F37-L106 HydrophobicContact CZ-CB 4.22Å; V74-L106 HydrophobicContact CG2-CD1 3.89Å; L95-L106 HydrophobicContact CD1-CD1 3.54Å; K102-L106 PolarHBondContact O-N 2.95Å; K103-L106 PolarHBondContact O-N 3.1Å; M104-L106 VanDerWaalsContact C-N 3.27Å; M104-L106 PolarHBondContact O-N 3.09Å; L106-N108 VanDerWaalsContact C-N 3.27Å; L106-N108 PolarHBondContact O-N 2.71Å; L106-K109 PolarHBondContact O-N 2.92Å; L106-Y110 HydrophobicContact CD2-CD2 4.31Å; L106-Y110 HydrophobicContact CD2-CE2 3.86Å; L106-Y110 WeakPolarHBondContact O-CD2 3.47Å; L106-Y110 PolarHBondContact O-N 3.41Å
107	W	87.5	Confident	87.8	Confident	34 Å²	34	63.3 Å²	63.3	13%	0.129	30%	0.304	C	S	.	.	H	α-helix	trans	-55.2	-47.2	174.1	-92.7	-70.4	0	0	0	111.1	F37 V74 S75 S76 K103 M104 K111 V112	F37-W107 AromaticContact CD1-CD1 3.58Å; F37-W107 HydrophobicContact CD1-CD2 4.01Å; F37-W107 AromaticContact CD1-CE2 3.61Å; F37-W107 AromaticContact CD1-CG 3.91Å; F37-W107 HydrophobicContact CD1-CG 3.91Å; F37-W107 HydrophobicContact CD1-CZ2 4.21Å; F37-W107 AromaticContact CD1-NE1 3.34Å; F37-W107 VanDerWaalsContact CD1-NE1 3.34Å; F37-W107 HydrophobicContact CE1-CD2 4.41Å; F37-W107 HydrophobicContact CE1-CG 4.1Å; F37-W107 AromaticContact CG-NE1 3.91Å; V74-W107 HydrophobicContact CG1-CE3 4.48Å; V74-W107 HydrophobicContact CG1-CH2 4.16Å; V74-W107 HydrophobicContact CG1-CZ2 4.23Å; V74-W107 HydrophobicContact CG1-CZ3 4.34Å; S75-W107 VanDerWaalsContact C-CH2 3.44Å; S75-W107 VanDerWaalsContact O-CH2 3.31Å; S75-W107 WeakPolarHBondContact O-CH2 3.49Å; S76-W107 VanDerWaalsContact CA-CH2 3.49Å; K103-W107 HydrophobicContact CB-CE3 4.04Å; K103-W107 HydrophobicContact CB-CH2 4.28Å; K103-W107 HydrophobicContact CB-CZ3 3.51Å; K103-W107 PolarHBondContact O-N 2.72Å; M104-W107 PolarHBondContact O-N 3.2Å; M104-W107 HydrophobicContact SD-CE3 3.95Å; M104-W107 HydrophobicContact SD-CZ3 4.34Å; W107-K111 PolarHBondContact O-N 3.02Å; W107-V112 PolarHBondContact O-N 2.93Å
108	N	80.7	Confident	87.9	Confident	41 Å²	41	62.2 Å²	62.2	22%	0.219	30%	0.299	C	S	.	.	H	α-helix	trans	-69	-50.8	-177.8	-63.2	-6	0	0	0	111	M104 L106 Y110 K111 S384 A385	M104-N108 WeakPolarHBondContact O-CB 3.4Å; M104-N108 PolarHBondContact O-N 3.14Å; M104-N108 PolarHBondContact O-ND2 2.85Å; M104-N108 PolarHBondContact O-OD1 2.64Å; L106-N108 VanDerWaalsContact C-N 3.27Å; L106-N108 PolarHBondContact O-N 2.71Å; N108-Y110 PolarHBondContact O-N 3.28Å; N108-K111 PolarHBondContact O-N 3.1Å; N108-S384 WeakPolarHBondContact CB-OG 3.25Å; N108-S384 PolarHBondContact ND2-O 3.12Å; N108-S384 PolarHBondContact ND2-OG 3.04Å; N108-S384 VanDerWaalsContact ND2-OG 3.13Å; N108-S384 WeakPolarHBondContact OD1-CB 3.43Å; N108-S384 PolarHBondContact OD1-O 3.46Å; N108-A385 PolarHBondContact ND2-N 3.45Å
109	K	84.3	Confident	88.1	Confident	116 Å²	116	54 Å²	54	50%	0.504	26%	0.264	S	S	.	.	H	α-helix	trans	-55.5	-38.6	-179.7	178	167.8	176.4	162.5	0	112.6	L8 K105 L106	L8-K109 HydrophobicContact CD1-CD 4.2Å; K105-K109 WeakPolarHBondContact O-CB 3.36Å; K105-K109 PolarHBondContact O-N 3.2Å; L106-K109 PolarHBondContact O-N 2.92Å
110	Y	87.5	Confident	88.2	Confident	4 Å²	4	52 Å²	52	2%	0.016	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	6.5	-179.3	-64.9	-64	0	0	0	114	L8 L35 F37 L106 N108 V112 V119 V121 G126 V128 R131	L8-Y110 HydrophobicContact CD1-CE2 4.06Å; L8-Y110 WeakPolarHBondContact CD1-OH 3.25Å; L35-Y110 HydrophobicContact CD1-CD2 3.41Å; L35-Y110 VanDerWaalsContact CD1-CD2 3.41Å; L35-Y110 HydrophobicContact CD1-CE2 3.16Å; L35-Y110 HydrophobicContact CD1-CG 4.28Å; F37-Y110 HydrophobicContact CZ-CD2 4.27Å; L106-Y110 HydrophobicContact CD2-CD2 4.31Å; L106-Y110 HydrophobicContact CD2-CE2 3.86Å; L106-Y110 WeakPolarHBondContact O-CD2 3.47Å; L106-Y110 PolarHBondContact O-N 3.41Å; N108-Y110 PolarHBondContact O-N 3.28Å; Y110-V112 VanDerWaalsContact C-N 3.27Å; Y110-V112 PolarHBondContact O-N 2.72Å; Y110-V119 HydrophobicContact CD1-CG1 4.26Å; Y110-V121 HydrophobicContact CD1-CG1 4.01Å; Y110-V121 HydrophobicContact CE1-CB 4.43Å; Y110-V121 HydrophobicContact CE1-CG1 3.38Å; Y110-V121 HydrophobicContact CE2-CG1 4.44Å; Y110-G126 WeakPolarHBondContact CE1-O 3.39Å; Y110-G126 PolarHBondContact OH-O 3.28Å; Y110-V128 HydrophobicContact CD1-CG2 3.53Å; Y110-V128 HydrophobicContact CE1-CG2 3.76Å; Y110-R131 PolarHBondContact O-NH1 3.02Å; Y110-R131 VanDerWaalsContact O-NH1 3.14Å
111	K	82.8	Confident	88.5	Confident	79 Å²	79	44.8 Å²	44.8	34%	0.343	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	43.6	176.9	-52.4	-177.8	-178.1	-176.9	0	112.1	W107 N108 T113 E308 E348	W107-K111 PolarHBondContact O-N 3.02Å; N108-K111 PolarHBondContact O-N 3.1Å; K111-T113 PolarHBondContact O-N 3.14Å; K111-E308 VanDerWaalsContact CD-O 3.3Å; K111-E308 WeakPolarHBondContact CD-O 3.3Å; K111-E308 WeakPolarHBondContact CE-O 3.41Å; K111-E308 PolarHBondContact NZ-O 3.06Å; K111-E348 VanDerWaalsContact CE-OE2 3.3Å; K111-E348 WeakPolarHBondContact CE-OE2 3.32Å; K111-E348 IonicContact NZ-OE2 3.43Å; K111-E348 PolarHBondContact NZ-OE2 3.44Å
112	V	86.1	Confident	88.9	Confident	21 Å²	21	41.1 Å²	41.1	13%	0.127	21%	0.211	C	C	.	.			trans	-84.8	110.3	-177.9	173.2	0	0	0	0	109.2	F37 W107 Y110 S114 V119	F37-V112 HydrophobicContact CB-CG1 3.95Å; F37-V112 HydrophobicContact CD1-CG1 4.36Å; F37-V112 HydrophobicContact CD1-CG2 4.47Å; F37-V112 HydrophobicContact CD2-CB 4.46Å; F37-V112 HydrophobicContact CD2-CG1 4.21Å; F37-V112 HydrophobicContact CD2-CG2 3.75Å; F37-V112 HydrophobicContact CE1-CG2 4.37Å; F37-V112 HydrophobicContact CE2-CG2 3.66Å; F37-V112 HydrophobicContact CG-CB 4.4Å; F37-V112 HydrophobicContact CG-CG1 3.93Å; F37-V112 HydrophobicContact CG-CG2 4.16Å; F37-V112 HydrophobicContact CZ-CG2 3.98Å; W107-V112 PolarHBondContact O-N 2.93Å; Y110-V112 VanDerWaalsContact C-N 3.27Å; Y110-V112 PolarHBondContact O-N 2.72Å; V112-S114 WeakPolarHBondContact CG1-O 3.46Å; V112-V119 HydrophobicContact CG2-CG2 3.98Å
113	T	80.4	Confident	89	Confident	124 Å²	124	39.1 Å²	39.1	76%	0.761	20%	0.202	S	C	*	.			trans	-103.5	-10.9	-174.2	55.4	0	0	0	0	114.2	K111	K111-T113 PolarHBondContact O-N 3.14Å
114	S	85.3	Confident	88.8	Confident	60 Å²	60	41 Å²	41	42%	0.42	22%	0.218	S	C	.	.	S	Bend	trans	-146	161.8	-178.5	66	0	0	0	0	111.8	V112 S117	V112-S114 WeakPolarHBondContact CG1-O 3.46Å; S114-S117 WeakPolarHBondContact O-CB 3.33Å; S114-S117 PolarHBondContact O-OG 3.18Å
115	I	91.9	Very high	89	Confident	54 Å²	54	40 Å²	40	28%	0.277	22%	0.218	S	C	.	.	S	Bend	trans	-127.1	148	175.2	58.8	170.3	0	0	0	110.5	F37 C39 N42	F37-I115 HydrophobicContact CB-CG2 4.43Å; C39-I115 HydrophobicContact CB-CD1 3.5Å; N42-I115 HydrophobicContact CB-CD1 4.38Å
116	P	95.3	Very high	89.2	Confident	19 Å²	19	35.4 Å²	35.4	12%	0.123	20%	0.199	C	C	.	.	S	Bend	cis	-69.3	145.1	-5.6	27.2	-32.9	0	0	0	112.6	Y36 P44 C45 F48 L134	Y36-P116 HydrophobicContact CE2-CB 3.93Å; P44-P116 HydrophobicContact CB-CG 4.34Å; C45-P116 HydrophobicContact CB-CB 4.48Å; F48-P116 HydrophobicContact CB-CB 4.24Å; F48-P116 HydrophobicContact CB-CG 4.02Å; F48-P116 HydrophobicContact CD1-CB 3.94Å; F48-P116 HydrophobicContact CD1-CG 4.5Å; F48-P116 HydrophobicContact CG-CB 4.33Å; F48-P116 HydrophobicContact CG-CG 4.4Å; P116-L134 HydrophobicContact CG-CD2 4.24Å; P116-L134 WeakPolarHBondContact O-CD2 3.31Å
117	S	95.5	Very high	89	Confident	13 Å²	13	38.8 Å²	38.8	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.5	172.6	-78.7	0	0	0	0	110.6	Y36 F37 S114	Y36-S117 CarbonylContact C-O 3.49Å; F37-S117 PolarHBondContact N-O 3.29Å; F37-S117 PolarHBondContact O-N 3.02Å; S114-S117 WeakPolarHBondContact O-CB 3.33Å; S114-S117 PolarHBondContact O-OG 3.18Å
118	L	96.3	Very high	89.1	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.2	174.4	179.2	60.6	0	0	0	108.6	L35 F48 L52 F120 G133 L134 V137	L35-L118 WeakPolarHBondContact O-CA 3.16Å; F48-L118 HydrophobicContact CE1-CB 4.2Å; F48-L118 HydrophobicContact CE1-CD2 4.46Å; F48-L118 HydrophobicContact CZ-CB 4.15Å; F48-L118 HydrophobicContact CZ-CD2 3.96Å; L52-L118 HydrophobicContact CD1-CD2 3.86Å; L118-F120 HydrophobicContact CD2-CE1 4.3Å; L118-F120 HydrophobicContact CD2-CE2 4.02Å; L118-F120 HydrophobicContact CD2-CZ 3.64Å; L118-F120 HydrophobicContact CG-CE1 4.49Å; L118-F120 HydrophobicContact CG-CE2 4.27Å; L118-F120 HydrophobicContact CG-CZ 4.11Å; L118-G133 VanDerWaalsContact O-CA 3.25Å; L118-G133 WeakPolarHBondContact O-CA 3.42Å; L118-G133 PolarHBondContact O-N 3.15Å; L118-L134 HydrophobicContact CB-CD1 3.66Å; L118-V137 HydrophobicContact CD2-CG2 3.9Å
119	V	95.4	Very high	89.6	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.1	178.5	-176.6	0	0	0	0	108.6	L35 F37 Y110 V112 V121 V128	L35-V119 PolarHBondContact N-O 3.39Å; L35-V119 PolarHBondContact O-N 3.24Å; F37-V119 HydrophobicContact CE2-CB 4.44Å; F37-V119 HydrophobicContact CE2-CG2 4.17Å; Y110-V119 HydrophobicContact CD1-CG1 4.26Å; V112-V119 HydrophobicContact CG2-CG2 3.98Å; V119-V121 HydrophobicContact CG1-CG1 3.96Å; V119-V128 HydrophobicContact CG1-CG1 3.87Å; V119-V128 HydrophobicContact CG1-CG2 4.22Å
120	F	95.3	Very high	90	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129	171.5	-66.5	-69.1	0	0	0	109.7	V33 L69 L118 V129 C130 V136 W148	V33-F120 WeakPolarHBondContact O-CA 3.42Å; L69-F120 HydrophobicContact CD1-CD1 4.15Å; L69-F120 HydrophobicContact CD1-CE1 3.98Å; L118-F120 HydrophobicContact CD2-CE1 4.3Å; L118-F120 HydrophobicContact CD2-CE2 4.02Å; L118-F120 HydrophobicContact CD2-CZ 3.64Å; L118-F120 HydrophobicContact CG-CE1 4.49Å; L118-F120 HydrophobicContact CG-CE2 4.27Å; L118-F120 HydrophobicContact CG-CZ 4.11Å; F120-V129 PolarHBondContact O-N 3.39Å; F120-C130 HydrophobicContact CB-CB 4.2Å; F120-C130 HydrophobicContact CD2-CB 4.12Å; F120-C130 PolarHBondContact N-O 3.5Å; F120-C130 PolarHBondContact O-N 3.45Å; F120-C130 VanDerWaalsContact O-N 3.1Å; F120-V136 HydrophobicContact CD2-CG2 4.43Å; F120-V136 HydrophobicContact CE2-CB 3.94Å; F120-V136 HydrophobicContact CE2-CG1 3.96Å; F120-V136 HydrophobicContact CE2-CG2 4.15Å; F120-W148 HydrophobicContact CD1-CE3 4.28Å; F120-W148 HydrophobicContact CD1-CZ3 4.1Å; F120-W148 HydrophobicContact CD2-CE3 4.01Å; F120-W148 HydrophobicContact CD2-CZ3 4.43Å; F120-W148 HydrophobicContact CE1-CE3 4.22Å; F120-W148 AromaticContact CE1-CZ3 3.7Å; F120-W148 HydrophobicContact CE1-CZ3 3.7Å; F120-W148 AromaticContact CE2-CE3 3.92Å; F120-W148 HydrophobicContact CE2-CE3 3.92Å; F120-W148 HydrophobicContact CE2-CZ3 4.05Å; F120-W148 HydrophobicContact CG-CE3 4.18Å; F120-W148 HydrophobicContact CG-CZ3 4.44Å; F120-W148 HydrophobicContact CZ-CE3 4.03Å; F120-W148 HydrophobicContact CZ-CH2 4.4Å; F120-W148 AromaticContact CZ-CZ3 3.66Å; F120-W148 HydrophobicContact CZ-CZ3 3.66Å
121	V	93.8	Very high	90.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.7	179.5	-54.7	0	0	0	0	110.2	L8 L32 V33 L35 Y110 V119 A123 K127 V128	L8-V121 HydrophobicContact CD2-CG2 4.35Å; L32-V121 WeakPolarHBondContact CA-O 3.34Å; L32-V121 WeakPolarHBondContact CD2-O 3.32Å; V33-V121 HydrophobicContact CB-CG2 4Å; V33-V121 PolarHBondContact N-O 3.33Å; V33-V121 WeakPolarHBondContact O-CG2 3.35Å; V33-V121 PolarHBondContact O-N 3.25Å; L35-V121 HydrophobicContact CD1-CG1 4.26Å; L35-V121 HydrophobicContact CD1-CG2 4.38Å; L35-V121 HydrophobicContact CG-CG2 4.49Å; Y110-V121 HydrophobicContact CD1-CG1 4.01Å; Y110-V121 HydrophobicContact CE1-CB 4.43Å; Y110-V121 HydrophobicContact CE1-CG1 3.38Å; Y110-V121 HydrophobicContact CE2-CG1 4.44Å; V119-V121 HydrophobicContact CG1-CG1 3.96Å; V121-A123 PolarHBondContact O-N 3.2Å; V121-K127 CarbonylContact C-O 3.53Å; V121-K127 VanDerWaalsContact CA-O 3.25Å; V121-K127 WeakPolarHBondContact CA-O 3.25Å; V121-V128 HydrophobicContact CG1-CG2 4.46Å
122	D	91.5	Very high	90.4	Very high	49 Å²	49	33.6 Å²	33.6	26%	0.262	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	128.4	172.6	176.1	-91.4	0	0	0	109.6	A124 T125 G126 K127 V129	D122-A124 VanDerWaalsContact C-N 3.26Å; D122-A124 PolarHBondContact O-N 2.65Å; D122-A124 WeakPolarHBondContact OD1-CA 3.48Å; D122-A124 WeakPolarHBondContact OD1-CB 3.46Å; D122-A124 PolarHBondContact OD1-N 3.32Å; D122-T125 WeakPolarHBondContact CB-OG1 3.26Å; D122-T125 WeakPolarHBondContact OD1-CB 3.45Å; D122-T125 WeakPolarHBondContact OD1-CG2 3.38Å; D122-T125 PolarHBondContact OD1-N 3.4Å; D122-T125 PolarHBondContact OD1-OG1 3.17Å; D122-G126 WeakPolarHBondContact O-CA 3.14Å; D122-G126 PolarHBondContact O-N 3.46Å; D122-K127 PolarHBondContact N-O 2.93Å; D122-V129 HydrophobicContact CB-CG2 3.86Å
123	A	90.1	Very high	90.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.8	-173.4	0	0	0	0	0	113.1	L5 L30 S31 V33 V121	L5-A123 HydrophobicContact CD1-CB 4.37Å; L5-A123 HydrophobicContact CD2-CB 4.25Å; L5-A123 WeakPolarHBondContact CD2-O 3.25Å; L5-A123 WeakPolarHBondContact CG-O 3.27Å; L30-A123 HydrophobicContact CB-CB 3.84Å; L30-A123 WeakPolarHBondContact O-CB 3.42Å; S31-A123 WeakPolarHBondContact O-CB 3.33Å; S31-A123 PolarHBondContact O-N 3.45Å; V33-A123 HydrophobicContact CG2-CB 4.13Å; V121-A123 PolarHBondContact O-N 3.2Å
124	A	87.7	Confident	91.3	Very high	45 Å²	45	29 Å²	29	37%	0.372	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-33.8	-178	0	0	0	0	0	112.7	M1 F4 D122	M1-A124 HydrophobicContact CG-CB 4.3Å; F4-A124 WeakPolarHBondContact CB-O 3.49Å; F4-A124 WeakPolarHBondContact CG-O 3.2Å; D122-A124 VanDerWaalsContact C-N 3.26Å; D122-A124 PolarHBondContact O-N 2.65Å; D122-A124 WeakPolarHBondContact OD1-CA 3.48Å; D122-A124 WeakPolarHBondContact OD1-CB 3.46Å; D122-A124 PolarHBondContact OD1-N 3.32Å
125	T	87	Confident	91.6	Very high	70 Å²	70	27.2 Å²	27.2	43%	0.429	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-19.5	-171.3	64.1	0	0	0	0	113.5	F4 D122 K127	F4-T125 VanDerWaalsContact CE2-O 3.3Å; F4-T125 WeakPolarHBondContact CE2-O 3.22Å; F4-T125 WeakPolarHBondContact CZ-O 3.23Å; D122-T125 WeakPolarHBondContact CB-OG1 3.26Å; D122-T125 WeakPolarHBondContact OD1-CB 3.45Å; D122-T125 WeakPolarHBondContact OD1-CG2 3.38Å; D122-T125 PolarHBondContact OD1-N 3.4Å; D122-T125 PolarHBondContact OD1-OG1 3.17Å; T125-K127 PolarHBondContact O-N 3.05Å; T125-K127 PolarHBondContact OG1-N 2.92Å
126	G	87.7	Confident	91.7	Very high	5 Å²	5	24.6 Å²	24.6	5%	0.052	14%	0.139	C	C	.	.			trans	65.2	10.7	-172.8	0	0	0	0	0	114.5	F4 Y110 D122	F4-G126 VanDerWaalsContact CZ-N 3.34Å; Y110-G126 WeakPolarHBondContact CE1-O 3.39Å; Y110-G126 PolarHBondContact OH-O 3.28Å; D122-G126 WeakPolarHBondContact O-CA 3.14Å; D122-G126 PolarHBondContact O-N 3.46Å
127	K	87.7	Confident	91.6	Very high	74 Å²	74	24.2 Å²	24.2	32%	0.322	14%	0.136	S	C	.	.			trans	-62.7	142.5	172.2	-72.1	-168.1	177	-161.6	0	109.3	V121 D122 T125 V129 K345 E346	V121-K127 CarbonylContact C-O 3.53Å; V121-K127 VanDerWaalsContact CA-O 3.25Å; V121-K127 WeakPolarHBondContact CA-O 3.25Å; D122-K127 PolarHBondContact N-O 2.93Å; T125-K127 PolarHBondContact O-N 3.05Å; T125-K127 PolarHBondContact OG1-N 2.92Å; K127-V129 PolarHBondContact O-N 3.44Å; K127-K345 PolarHBondContact NZ-O 3.4Å; K127-E346 PolarHBondContact NZ-O 3.4Å
128	V	89.6	Confident	91.5	Very high	50 Å²	50	31 Å²	31	30%	0.303	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123.8	178.7	-179.3	0	0	0	0	109.5	Y110 V119 V121 R131	Y110-V128 HydrophobicContact CD1-CG2 3.53Å; Y110-V128 HydrophobicContact CE1-CG2 3.76Å; V119-V128 HydrophobicContact CG1-CG1 3.87Å; V119-V128 HydrophobicContact CG1-CG2 4.22Å; V121-V128 HydrophobicContact CG1-CG2 4.46Å; V128-R131 HydrophobicContact CG1-CB 4.44Å; V128-R131 HydrophobicContact CG1-CG 3.56Å
129	V	91.5	Very high	91.2	Very high	28 Å²	28	33.5 Å²	33.5	17%	0.17	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-42.9	178.1	171.8	0	0	0	0	109.5	L32 F120 D122 K127 G149	L32-V129 HydrophobicContact CD1-CG1 4.29Å; L32-V129 HydrophobicContact CD2-CB 3.97Å; L32-V129 HydrophobicContact CD2-CG1 3.86Å; L32-V129 HydrophobicContact CD2-CG2 3.63Å; F120-V129 PolarHBondContact O-N 3.39Å; D122-V129 HydrophobicContact CB-CG2 3.86Å; K127-V129 PolarHBondContact O-N 3.44Å; V129-G149 VanDerWaalsContact CG1-CA 3.4Å
130	C	91.4	Very high	91	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	120.3	173	-177.3	0	0	0	0	110.6	F120	F120-C130 HydrophobicContact CB-CB 4.2Å; F120-C130 HydrophobicContact CD2-CB 4.12Å; F120-C130 PolarHBondContact N-O 3.5Å; F120-C130 PolarHBondContact O-N 3.45Å; F120-C130 VanDerWaalsContact O-N 3.1Å
131	R	90.1	Very high	90.8	Very high	56 Å²	56	36.8 Å²	36.8	21%	0.211	19%	0.194	C	C	.	.	S	Bend	trans	-72.2	-33.7	177.6	-76.2	-174.9	176.7	-86.3	3.6	112.9	Y110 V128 E348	Y110-R131 PolarHBondContact O-NH1 3.02Å; Y110-R131 VanDerWaalsContact O-NH1 3.14Å; V128-R131 HydrophobicContact CG1-CB 4.44Å; V128-R131 HydrophobicContact CG1-CG 3.56Å; R131-E348 IonicContact CZ-OE1 3.51Å; R131-E348 IonicContact NH2-OE1 3.91Å; R131-E348 PolarHBondContact NH2-OE1 3.02Å; R131-E348 IonicContact NH2-OE2 3.53Å; R131-E348 PolarHBondContact NH2-OE2 3.26Å
132	N	89.1	Confident	90.5	Very high	22 Å²	22	43.4 Å²	43.4	12%	0.118	22%	0.223	C	C	.	.			trans	-110.3	66.6	-173.5	-160	-13.9	0	0	0	111.8	L134 L135 N250	N132-L134 PolarHBondContact O-N 3.17Å; N132-L135 HydrophobicContact CB-CD1 4.29Å; N132-L135 HydrophobicContact CB-CG 4.48Å; N132-L135 VanDerWaalsContact ND2-CD1 3.26Å; N132-L135 WeakPolarHBondContact ND2-CD1 3.5Å; N132-L135 PolarHBondContact O-N 3.09Å; N132-N250 PolarHBondContact ND2-OD1 3.45Å
133	G	93	Very high	90.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.9	-19.4	179.9	0	0	0	0	0	114.2	L118 L135 V136 V137	L118-G133 VanDerWaalsContact O-CA 3.25Å; L118-G133 WeakPolarHBondContact O-CA 3.42Å; L118-G133 PolarHBondContact O-N 3.15Å; G133-L135 VanDerWaalsContact C-N 3.28Å; G133-L135 PolarHBondContact O-N 2.98Å; G133-V136 WeakPolarHBondContact O-CB 3.43Å; G133-V136 PolarHBondContact O-N 2.82Å; G133-V136 VanDerWaalsContact O-N 3.16Å; G133-V137 WeakPolarHBondContact O-CG2 3.33Å; G133-V137 PolarHBondContact O-N 3.36Å; G133-V137 VanDerWaalsContact O-N 3.08Å
134	L	92.9	Very high	90.3	Very high	49 Å²	49	48 Å²	48	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-58.8	-43.1	172.1	-85.6	61	0	0	0	111	F48 P116 L118 N132 V136 V137 R138	F48-L134 HydrophobicContact CD1-CD1 4.45Å; F48-L134 HydrophobicContact CD2-CG 4Å; F48-L134 HydrophobicContact CE1-CD1 3.85Å; F48-L134 HydrophobicContact CE1-CG 4.18Å; F48-L134 HydrophobicContact CE2-CB 4.16Å; F48-L134 HydrophobicContact CE2-CD1 4.14Å; F48-L134 HydrophobicContact CE2-CG 3.65Å; F48-L134 HydrophobicContact CG-CG 4.41Å; F48-L134 HydrophobicContact CZ-CB 4.43Å; F48-L134 HydrophobicContact CZ-CD1 3.67Å; F48-L134 HydrophobicContact CZ-CG 3.74Å; P116-L134 HydrophobicContact CG-CD2 4.24Å; P116-L134 WeakPolarHBondContact O-CD2 3.31Å; L118-L134 HydrophobicContact CB-CD1 3.66Å; N132-L134 PolarHBondContact O-N 3.17Å; L134-V136 VanDerWaalsContact C-N 3.33Å; L134-V137 PolarHBondContact O-N 3.37Å; L134-R138 PolarHBondContact O-N 3.46Å
135	L	91.6	Very high	90.4	Very high	22 Å²	22	49 Å²	49	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-33.8	177.1	-64.5	-179.2	0	0	0	111.8	N132 G133 R138 D139 N250 R251	N132-L135 HydrophobicContact CB-CD1 4.29Å; N132-L135 HydrophobicContact CB-CG 4.48Å; N132-L135 VanDerWaalsContact ND2-CD1 3.26Å; N132-L135 WeakPolarHBondContact ND2-CD1 3.5Å; N132-L135 PolarHBondContact O-N 3.09Å; G133-L135 VanDerWaalsContact C-N 3.28Å; G133-L135 PolarHBondContact O-N 2.98Å; L135-R138 VanDerWaalsContact CD2-CZ 3.41Å; L135-R138 PolarHBondContact O-N 3.41Å; L135-D139 WeakPolarHBondContact O-CB 3.41Å; L135-D139 PolarHBondContact O-N 3.02Å; L135-N250 HydrophobicContact CD1-CB 4.14Å; L135-N250 VanDerWaalsContact CD1-OD1 3.29Å; L135-N250 WeakPolarHBondContact CD1-OD1 3.44Å; L135-R251 HydrophobicContact CB-CG 3.56Å; L135-R251 HydrophobicContact CD1-CG 3.63Å; L135-R251 HydrophobicContact CG-CG 4.24Å
136	V	92.9	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-49.7	174.5	172.2	0	0	0	0	110.8	F120 G133 L134 R138 D139 D140 W148	F120-V136 HydrophobicContact CD2-CG2 4.43Å; F120-V136 HydrophobicContact CE2-CB 3.94Å; F120-V136 HydrophobicContact CE2-CG1 3.96Å; F120-V136 HydrophobicContact CE2-CG2 4.15Å; G133-V136 WeakPolarHBondContact O-CB 3.43Å; G133-V136 PolarHBondContact O-N 2.82Å; G133-V136 VanDerWaalsContact O-N 3.16Å; L134-V136 VanDerWaalsContact C-N 3.33Å; V136-R138 PolarHBondContact O-N 3.45Å; V136-D139 PolarHBondContact O-N 3.21Å; V136-D140 CarbonylContact O-C 3.47Å; V136-D140 WeakPolarHBondContact O-CA 3.34Å; V136-D140 PolarHBondContact O-N 3.45Å; V136-W148 HydrophobicContact CG1-CD2 3.4Å; V136-W148 VanDerWaalsContact CG1-CD2 3.4Å; V136-W148 HydrophobicContact CG1-CE3 3.95Å; V136-W148 HydrophobicContact CG1-CG 3.7Å; V136-W148 HydrophobicContact CG1-CH2 4.3Å; V136-W148 HydrophobicContact CG1-CZ2 3.78Å; V136-W148 HydrophobicContact CG1-CZ3 4.36Å; V136-W148 HydrophobicContact CG2-CB 4.26Å; V136-W148 HydrophobicContact CG2-CG 4.14Å
137	V	94.3	Very high	90.6	Very high	10 Å²	10	50.2 Å²	50.2	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-36.9	179.6	173.3	0	0	0	0	111.4	F48 L52 F55 L118 G133 L134	F48-V137 HydrophobicContact CE2-CB 4.14Å; F48-V137 HydrophobicContact CE2-CG1 4.17Å; F48-V137 HydrophobicContact CE2-CG2 4.21Å; F48-V137 HydrophobicContact CZ-CG2 4.14Å; L52-V137 HydrophobicContact CD1-CG2 3.64Å; F55-V137 HydrophobicContact CB-CG1 3.87Å; F55-V137 HydrophobicContact CD1-CG2 4.08Å; F55-V137 HydrophobicContact CE1-CG2 4.43Å; F55-V137 HydrophobicContact CG-CG1 4.18Å; F55-V137 HydrophobicContact CG-CG2 4.28Å; L118-V137 HydrophobicContact CD2-CG2 3.9Å; G133-V137 WeakPolarHBondContact O-CG2 3.33Å; G133-V137 PolarHBondContact O-N 3.36Å; G133-V137 VanDerWaalsContact O-N 3.08Å; L134-V137 PolarHBondContact O-N 3.37Å
138	R	92.3	Very high	90.6	Very high	155 Å²	155	47.4 Å²	47.4	59%	0.585	24%	0.238	S	C	*	.	H	α-helix	trans	-75.3	-47.9	178.5	-172.6	-168.3	70.4	-173.5	3.5	113	L134 L135 V136 S247	L134-R138 PolarHBondContact O-N 3.46Å; L135-R138 VanDerWaalsContact CD2-CZ 3.41Å; L135-R138 PolarHBondContact O-N 3.41Å; V136-R138 PolarHBondContact O-N 3.45Å; R138-S247 PolarHBondContact NH2-OG 3.04Å
139	D	90.9	Very high	90.2	Very high	55 Å²	55	46.3 Å²	46.3	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-87.9	-30.2	-167.9	-59.5	-18.6	0	0	0	112.9	L135 V136 P141 S247 R251	L135-D139 WeakPolarHBondContact O-CB 3.41Å; L135-D139 PolarHBondContact O-N 3.02Å; V136-D139 PolarHBondContact O-N 3.21Å; D139-P141 WeakPolarHBondContact O-CD 3.26Å; D139-S247 VanDerWaalsContact OD2-CB 3.23Å; D139-S247 WeakPolarHBondContact OD2-CB 3.48Å; D139-S247 PolarHBondContact OD2-OG 3.5Å; D139-R251 IonicContact OD2-CZ 3.49Å; D139-R251 IonicContact OD2-NH1 2.74Å; D139-R251 PolarHBondContact OD2-NH1 2.89Å
140	D	90.6	Very high	89.5	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.048	26%	0.261	C	S	.	.			trans	-123	63.8	178.1	-176.8	21.3	0	0	0	110.8	F55 V136 K142 G143 L144 E145 W148	F55-D140 VanDerWaalsContact CE2-O 3.3Å; F55-D140 WeakPolarHBondContact CE2-O 3.3Å; V136-D140 CarbonylContact O-C 3.47Å; V136-D140 WeakPolarHBondContact O-CA 3.34Å; V136-D140 PolarHBondContact O-N 3.45Å; D140-K142 PolarHBondContact O-N 2.94Å; D140-G143 PolarHBondContact O-N 3.28Å; D140-G143 WeakPolarHBondContact OD1-CA 3.14Å; D140-G143 PolarHBondContact OD1-N 2.97Å; D140-G143 WeakPolarHBondContact OD2-CA 3.43Å; D140-L144 VanDerWaalsContact CG-N 3.3Å; D140-L144 PolarHBondContact OD1-N 3.37Å; D140-L144 PolarHBondContact OD2-N 2.92Å; D140-E145 WeakPolarHBondContact OD2-CB 3.5Å; D140-E145 PolarHBondContact OD2-N 2.87Å; D140-W148 PolarHBondContact OD2-NE1 3.03Å
141	P	90.4	Very high	89.3	Confident	63 Å²	63	53.3 Å²	53.3	41%	0.409	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.6	-174.4	28.2	-37.2	0	0	0	114	D139	D139-P141 WeakPolarHBondContact O-CD 3.26Å
142	K	87.9	Confident	89.4	Confident	139 Å²	139	54.9 Å²	54.9	60%	0.604	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-8.7	177.9	-69.5	-178.6	-177.6	178	0	113	D140 L144	D140-K142 PolarHBondContact O-N 2.94Å; K142-L144 HydrophobicContact CB-CD1 4.25Å; K142-L144 HydrophobicContact CB-CD2 4.24Å; K142-L144 HydrophobicContact CB-CG 3.81Å; K142-L144 HydrophobicContact CD-CD1 4.32Å
143	G	89.1	Confident	89.6	Confident	5 Å²	5	54.7 Å²	54.7	5%	0.052	29%	0.291	C	S	.	.			trans	67.2	31.9	-177.6	0	0	0	0	0	114.2	D140 E145 F146	D140-G143 PolarHBondContact O-N 3.28Å; D140-G143 WeakPolarHBondContact OD1-CA 3.14Å; D140-G143 PolarHBondContact OD1-N 2.97Å; D140-G143 WeakPolarHBondContact OD2-CA 3.43Å; G143-E145 VanDerWaalsContact C-N 3.31Å; G143-F146 VanDerWaalsContact O-CB 3.29Å; G143-F146 WeakPolarHBondContact O-CB 3.42Å; G143-F146 PolarHBondContact O-N 2.77Å
144	L	89.3	Confident	89.6	Confident	141 Å²	141	57.6 Å²	57.6	74%	0.738	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-22.7	-178.9	-59.8	178	0	0	0	112.7	D140 K142 F146	D140-L144 VanDerWaalsContact CG-N 3.3Å; D140-L144 PolarHBondContact OD1-N 3.37Å; D140-L144 PolarHBondContact OD2-N 2.92Å; K142-L144 HydrophobicContact CB-CD1 4.25Å; K142-L144 HydrophobicContact CB-CD2 4.24Å; K142-L144 HydrophobicContact CB-CG 3.81Å; K142-L144 HydrophobicContact CD-CD1 4.32Å; L144-F146 VanDerWaalsContact C-N 3.28Å
145	E	88.5	Confident	89.5	Confident	67 Å²	67	60.1 Å²	60.1	31%	0.313	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	9.3	176.1	-61.2	-171.4	160.7	0	0	112.1	D140 G143 P147 R251	D140-E145 WeakPolarHBondContact OD2-CB 3.5Å; D140-E145 PolarHBondContact OD2-N 2.87Å; G143-E145 VanDerWaalsContact C-N 3.31Å; E145-P147 CarbonylContact O-C 3.59Å; E145-P147 VanDerWaalsContact O-C 3.23Å; E145-P147 VanDerWaalsContact O-O 3.13Å; E145-R251 IonicContact OE2-CZ 2.76Å; E145-R251 IonicContact OE2-NH2 3.82Å; E145-R251 PolarHBondContact OE2-NH2 3.14Å
146	F	89.5	Confident	89.6	Confident	19 Å²	19	59.4 Å²	59.4	8%	0.083	32%	0.321	C	S	.	.			trans	-67.7	137.6	179.3	-173.5	-83.9	0	0	0	111.7	S31 L32 F59 H65 T68 L69 G143 L144 W148	S31-F146 WeakPolarHBondContact OG-CZ 3.47Å; L32-F146 HydrophobicContact CB-CE2 4.35Å; L32-F146 HydrophobicContact CB-CZ 4.4Å; L32-F146 HydrophobicContact CD1-CD2 4.27Å; L32-F146 HydrophobicContact CD1-CE2 3.61Å; L32-F146 HydrophobicContact CD1-CZ 3.95Å; L32-F146 HydrophobicContact CG-CE2 4.24Å; L32-F146 HydrophobicContact CG-CZ 4.18Å; F59-F146 HydrophobicContact CE2-CB 4.09Å; F59-F146 AromaticContact CE2-CD2 3.7Å; F59-F146 HydrophobicContact CE2-CD2 3.7Å; F59-F146 HydrophobicContact CE2-CE2 4.31Å; F59-F146 AromaticContact CE2-CG 3.95Å; F59-F146 HydrophobicContact CE2-CG 3.95Å; F59-F146 HydrophobicContact CZ-CB 4.49Å; F59-F146 HydrophobicContact CZ-CD1 4.37Å; F59-F146 AromaticContact CZ-CD2 3.57Å; F59-F146 HydrophobicContact CZ-CD2 3.57Å; F59-F146 AromaticContact CZ-CE2 3.74Å; F59-F146 HydrophobicContact CZ-CE2 3.74Å; F59-F146 AromaticContact CZ-CG 3.89Å; F59-F146 HydrophobicContact CZ-CG 3.89Å; F59-F146 HydrophobicContact CZ-CZ 4.25Å; H65-F146 HydrophobicContact CB-CD1 3.65Å; H65-F146 HydrophobicContact CB-CE1 3.67Å; H65-F146 HydrophobicContact CB-CG 4.39Å; H65-F146 HydrophobicContact CB-CZ 4.4Å; H65-F146 AromaticContact CD2-CD1 3.56Å; H65-F146 AromaticContact CG-CD1 3.47Å; H65-F146 VanDerWaalsContact CG-CD1 3.47Å; H65-F146 AromaticContact CG-CE1 3.74Å; T68-F146 WeakPolarHBondContact OG1-CE1 3.43Å; T68-F146 WeakPolarHBondContact OG1-CZ 3.45Å; L69-F146 HydrophobicContact CB-CE2 4.07Å; L69-F146 HydrophobicContact CB-CZ 4.41Å; G143-F146 VanDerWaalsContact O-CB 3.29Å; G143-F146 WeakPolarHBondContact O-CB 3.42Å; G143-F146 PolarHBondContact O-N 2.77Å; L144-F146 VanDerWaalsContact C-N 3.28Å; F146-W148 HydrophobicContact CB-CZ2 4.24Å; F146-W148 HydrophobicContact CD2-CD2 4.27Å; F146-W148 AromaticContact CD2-CE3 3.95Å; F146-W148 HydrophobicContact CD2-CE3 3.95Å; F146-W148 AromaticContact CD2-CH2 3.54Å; F146-W148 HydrophobicContact CD2-CH2 3.54Å; F146-W148 AromaticContact CD2-CZ2 3.9Å; F146-W148 HydrophobicContact CD2-CZ2 3.9Å; F146-W148 AromaticContact CD2-CZ3 3.59Å; F146-W148 HydrophobicContact CD2-CZ3 3.59Å; F146-W148 HydrophobicContact CE2-CE3 4.42Å; F146-W148 HydrophobicContact CE2-CH2 4.18Å; F146-W148 AromaticContact CE2-CZ3 3.93Å; F146-W148 HydrophobicContact CE2-CZ3 3.93Å
147	P	88.9	Confident	89.7	Confident	82 Å²	82	59.4 Å²	59.4	53%	0.532	32%	0.321	S	S	.	.	S	Bend	cis	-76.4	139.7	-5.5	30.9	-33.9	0	0	0	112.2	L32 E145 G149	L32-P147 HydrophobicContact CD1-CB 3.92Å; E145-P147 CarbonylContact O-C 3.59Å; E145-P147 VanDerWaalsContact O-C 3.23Å; E145-P147 VanDerWaalsContact O-O 3.13Å; P147-G149 PolarHBondContact O-N 3.31Å
148	W	89.4	Confident	89.6	Confident	14 Å²	14	61.1 Å²	61.1	5%	0.053	34%	0.336	C	S	.	.			trans	-78	39.8	-175.3	-50.7	-72.6	0	0	0	114.4	L32 F55 F59 L69 F120 V136 D140 F146	L32-W148 HydrophobicContact CD1-CE3 4.2Å; F55-W148 HydrophobicContact CE1-CH2 4.16Å; F55-W148 HydrophobicContact CE2-CZ2 4.24Å; F55-W148 AromaticContact CZ-CH2 3.5Å; F55-W148 HydrophobicContact CZ-CH2 3.5Å; F55-W148 VanDerWaalsContact CZ-CH2 3.5Å; F55-W148 AromaticContact CZ-CZ2 3.61Å; F55-W148 HydrophobicContact CZ-CZ2 3.61Å; F59-W148 HydrophobicContact CD2-CH2 4.39Å; F59-W148 HydrophobicContact CE2-CH2 4.07Å; F59-W148 HydrophobicContact CE2-CZ2 4.27Å; L69-W148 HydrophobicContact CD2-CH2 3.93Å; L69-W148 HydrophobicContact CD2-CZ3 4.06Å; F120-W148 HydrophobicContact CD1-CE3 4.28Å; F120-W148 HydrophobicContact CD1-CZ3 4.1Å; F120-W148 HydrophobicContact CD2-CE3 4.01Å; F120-W148 HydrophobicContact CD2-CZ3 4.43Å; F120-W148 HydrophobicContact CE1-CE3 4.22Å; F120-W148 AromaticContact CE1-CZ3 3.7Å; F120-W148 HydrophobicContact CE1-CZ3 3.7Å; F120-W148 AromaticContact CE2-CE3 3.92Å; F120-W148 HydrophobicContact CE2-CE3 3.92Å; F120-W148 HydrophobicContact CE2-CZ3 4.05Å; F120-W148 HydrophobicContact CG-CE3 4.18Å; F120-W148 HydrophobicContact CG-CZ3 4.44Å; F120-W148 HydrophobicContact CZ-CE3 4.03Å; F120-W148 HydrophobicContact CZ-CH2 4.4Å; F120-W148 AromaticContact CZ-CZ3 3.66Å; F120-W148 HydrophobicContact CZ-CZ3 3.66Å; V136-W148 HydrophobicContact CG1-CD2 3.4Å; V136-W148 VanDerWaalsContact CG1-CD2 3.4Å; V136-W148 HydrophobicContact CG1-CE3 3.95Å; V136-W148 HydrophobicContact CG1-CG 3.7Å; V136-W148 HydrophobicContact CG1-CH2 4.3Å; V136-W148 HydrophobicContact CG1-CZ2 3.78Å; V136-W148 HydrophobicContact CG1-CZ3 4.36Å; V136-W148 HydrophobicContact CG2-CB 4.26Å; V136-W148 HydrophobicContact CG2-CG 4.14Å; D140-W148 PolarHBondContact OD2-NE1 3.03Å; F146-W148 HydrophobicContact CB-CZ2 4.24Å; F146-W148 HydrophobicContact CD2-CD2 4.27Å; F146-W148 AromaticContact CD2-CE3 3.95Å; F146-W148 HydrophobicContact CD2-CE3 3.95Å; F146-W148 AromaticContact CD2-CH2 3.54Å; F146-W148 HydrophobicContact CD2-CH2 3.54Å; F146-W148 AromaticContact CD2-CZ2 3.9Å; F146-W148 HydrophobicContact CD2-CZ2 3.9Å; F146-W148 AromaticContact CD2-CZ3 3.59Å; F146-W148 HydrophobicContact CD2-CZ3 3.59Å; F146-W148 HydrophobicContact CE2-CE3 4.42Å; F146-W148 HydrophobicContact CE2-CH2 4.18Å; F146-W148 AromaticContact CE2-CZ3 3.93Å; F146-W148 HydrophobicContact CE2-CZ3 3.93Å
149	G	79.8	Confident	89.7	Confident	27 Å²	27	55 Å²	55	28%	0.278	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-67	167.7	177.2	0	0	0	0	0	113.7	V129 P147 K151	V129-G149 VanDerWaalsContact CG1-CA 3.4Å; P147-G149 PolarHBondContact O-N 3.31Å; G149-K151 PolarHBondContact O-N 2.82Å
150	P	77.6	Confident	89.9	Confident	102 Å²	102	55.5 Å²	55.5	66%	0.662	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-63	126.3	177.4	26.9	-33.2	0	0	0	109.6	L252	P150-L252 HydrophobicContact CB-CD1 4.2Å
151	K	87.4	Confident	90.2	Very high	83 Å²	83	55.1 Å²	55.1	36%	0.361	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-93.3	152.1	170.1	-70.4	174.6	164	-144.6	0	109.3	G149 F153 E155 V156 L252	G149-K151 PolarHBondContact O-N 2.82Å; K151-F153 PolarHBondContact O-N 3.11Å; K151-E155 VanDerWaalsContact CD-OE1 3.29Å; K151-E155 WeakPolarHBondContact CD-OE1 3.41Å; K151-E155 WeakPolarHBondContact CE-OE1 3.41Å; K151-E155 IonicContact NZ-OE1 3.66Å; K151-E155 PolarHBondContact NZ-OE1 2.97Å; K151-V156 HydrophobicContact CB-CG2 3.62Å; K151-L252 VanDerWaalsContact O-CD1 3.24Å; K151-L252 WeakPolarHBondContact O-CD1 3.16Å
152	P	90.8	Very high	90.5	Very high	89 Å²	89	53.8 Å²	53.8	58%	0.578	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-52.2	138.6	173.4	-25.1	34.5	0	0	0	111.1	A154 E155 V156	P152-A154 PolarHBondContact O-N 2.79Å; P152-A154 VanDerWaalsContact O-N 3.17Å; P152-E155 WeakPolarHBondContact O-CB 3.25Å; P152-E155 PolarHBondContact O-N 2.91Å; P152-V156 PolarHBondContact O-N 3.22Å
153	F	93.5	Very high	90.8	Very high	18 Å²	18	51 Å²	51	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-52.3	-42.4	-178.9	167.7	-111.6	0	0	0	112	K151 E155 V156 V157 L174 V179 V181 L249 L252 F253 L264	K151-F153 PolarHBondContact O-N 3.11Å; F153-E155 VanDerWaalsContact C-N 3.29Å; F153-E155 PolarHBondContact O-N 2.7Å; F153-V156 PolarHBondContact O-N 2.88Å; F153-V157 HydrophobicContact CD1-CG1 4.3Å; F153-V157 HydrophobicContact CD2-CB 4.33Å; F153-V157 HydrophobicContact CD2-CG1 4.42Å; F153-V157 HydrophobicContact CE1-CG1 3.89Å; F153-V157 HydrophobicContact CE2-CB 3.79Å; F153-V157 HydrophobicContact CE2-CG1 4.01Å; F153-V157 HydrophobicContact CE2-CG2 4.12Å; F153-V157 HydrophobicContact CZ-CB 3.92Å; F153-V157 HydrophobicContact CZ-CG1 3.74Å; F153-V157 HydrophobicContact CZ-CG2 4.02Å; F153-V157 WeakPolarHBondContact O-CG1 3.36Å; F153-V157 PolarHBondContact O-N 2.98Å; F153-L174 HydrophobicContact CE1-CD1 4.35Å; F153-L174 HydrophobicContact CZ-CD1 4.47Å; F153-V179 HydrophobicContact CE1-CB 4.39Å; F153-V179 HydrophobicContact CE1-CG1 4.1Å; F153-V179 HydrophobicContact CE1-CG2 4.42Å; F153-V179 HydrophobicContact CZ-CG1 3.96Å; F153-V181 HydrophobicContact CE2-CG2 3.68Å; F153-V181 HydrophobicContact CZ-CG2 3.88Å; F153-L249 HydrophobicContact CD2-CD2 4.14Å; F153-L249 HydrophobicContact CE2-CD2 3.87Å; F153-L252 HydrophobicContact CB-CD2 4.4Å; F153-L252 HydrophobicContact CD2-CD2 4.31Å; F153-F253 HydrophobicContact CD2-CE2 4.12Å; F153-F253 AromaticContact CD2-CZ 3.77Å; F153-F253 HydrophobicContact CD2-CZ 3.77Å; F153-F253 HydrophobicContact CE2-CE2 4.31Å; F153-F253 HydrophobicContact CE2-CZ 4.3Å; F153-L264 HydrophobicContact CB-CD1 4.12Å; F153-L264 HydrophobicContact CD1-CD1 3.45Å; F153-L264 VanDerWaalsContact CD1-CD1 3.45Å; F153-L264 HydrophobicContact CD2-CD1 3.7Å; F153-L264 HydrophobicContact CE1-CD1 3.67Å; F153-L264 HydrophobicContact CE2-CD1 3.9Å; F153-L264 HydrophobicContact CG-CD1 3.46Å; F153-L264 VanDerWaalsContact CG-CD1 3.46Å; F153-L264 HydrophobicContact CZ-CD1 3.89Å
154	A	92.8	Very high	90.8	Very high	60 Å²	60	54.2 Å²	54.2	50%	0.496	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-38.8	178.9	0	0	0	0	0	113.1	P152 A158 I171	P152-A154 PolarHBondContact O-N 2.79Å; P152-A154 VanDerWaalsContact O-N 3.17Å; A154-A158 WeakPolarHBondContact O-CB 3.46Å; A154-A158 PolarHBondContact O-N 2.96Å; A154-I171 HydrophobicContact CB-CD1 4.22Å; A154-I171 WeakPolarHBondContact O-CD1 3.48Å
155	E	92.8	Very high	90.7	Very high	102 Å²	102	51.4 Å²	51.4	48%	0.477	30%	0.302	S	S	.	.	H	α-helix	trans	-67.5	-42.1	175.4	-172.8	-169.7	146.3	0	0	110.9	K151 P152 F153 A158	K151-E155 VanDerWaalsContact CD-OE1 3.29Å; K151-E155 WeakPolarHBondContact CD-OE1 3.41Å; K151-E155 WeakPolarHBondContact CE-OE1 3.41Å; K151-E155 IonicContact NZ-OE1 3.66Å; K151-E155 PolarHBondContact NZ-OE1 2.97Å; P152-E155 WeakPolarHBondContact O-CB 3.25Å; P152-E155 PolarHBondContact O-N 2.91Å; F153-E155 VanDerWaalsContact C-N 3.29Å; F153-E155 PolarHBondContact O-N 2.7Å; E155-A158 WeakPolarHBondContact O-CB 3.26Å
156	V	92.7	Very high	90.3	Very high	7 Å²	7	58.3 Å²	58.3	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-71.3	-39.1	-174.2	179	0	0	0	0	112.1	K151 P152 F153 R245 R248 L249 L252	K151-V156 HydrophobicContact CB-CG2 3.62Å; P152-V156 PolarHBondContact O-N 3.22Å; F153-V156 PolarHBondContact O-N 2.88Å; V156-R245 WeakPolarHBondContact O-CG 3.48Å; V156-R248 HydrophobicContact CG1-CB 3.71Å; V156-L249 HydrophobicContact CB-CD2 4.43Å; V156-L249 HydrophobicContact CG1-CD2 3.74Å; V156-L249 HydrophobicContact CG1-CG 3.91Å; V156-L252 HydrophobicContact CB-CD2 4.04Å; V156-L252 HydrophobicContact CG1-CB 4.49Å; V156-L252 HydrophobicContact CG1-CD2 4.22Å; V156-L252 HydrophobicContact CG2-CD2 4Å
157	V	94.6	Very high	90.3	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-85.6	-10.6	-178.2	77.1	0	0	0	0	113.3	F153 L161 I171 V215 R245 L249	F153-V157 HydrophobicContact CD1-CG1 4.3Å; F153-V157 HydrophobicContact CD2-CB 4.33Å; F153-V157 HydrophobicContact CD2-CG1 4.42Å; F153-V157 HydrophobicContact CE1-CG1 3.89Å; F153-V157 HydrophobicContact CE2-CB 3.79Å; F153-V157 HydrophobicContact CE2-CG1 4.01Å; F153-V157 HydrophobicContact CE2-CG2 4.12Å; F153-V157 HydrophobicContact CZ-CB 3.92Å; F153-V157 HydrophobicContact CZ-CG1 3.74Å; F153-V157 HydrophobicContact CZ-CG2 4.02Å; F153-V157 WeakPolarHBondContact O-CG1 3.36Å; F153-V157 PolarHBondContact O-N 2.98Å; V157-L161 HydrophobicContact CG2-CD2 4.29Å; V157-I171 HydrophobicContact CG1-CD1 3.18Å; V157-I171 HydrophobicContact CG1-CG1 3.81Å; V157-V215 HydrophobicContact CG2-CG1 4.4Å; V157-R245 WeakPolarHBondContact O-CD 3.33Å; V157-R245 PolarHBondContact O-NH1 3.11Å; V157-R245 VanDerWaalsContact O-NH1 3.14Å; V157-L249 HydrophobicContact CB-CD2 4.16Å; V157-L249 HydrophobicContact CG2-CD1 4.3Å; V157-L249 HydrophobicContact CG2-CD2 4.44Å
158	A	93.4	Very high	90.5	Very high	46 Å²	46	63.8 Å²	63.8	38%	0.38	35%	0.351	S	S	.	.			trans	-46	143.7	-177.6	0	0	0	0	0	114	A154 E155 R245	A154-A158 WeakPolarHBondContact O-CB 3.46Å; A154-A158 PolarHBondContact O-N 2.96Å; E155-A158 WeakPolarHBondContact O-CB 3.26Å; A158-R245 WeakPolarHBondContact O-CD 3.49Å; A158-R245 PolarHBondContact O-NH1 3.01Å
159	G	93.3	Very high	90.7	Very high	26 Å²	26	64.8 Å²	64.8	27%	0.268	36%	0.359	S	S	.	.	S	Bend	trans	111.9	177.1	-175.9	0	0	0	0	0	112.7	L161 R245	G159-L161 PolarHBondContact O-N 2.98Å; G159-R245 VanDerWaalsContact C-NH1 3.31Å; G159-R245 PolarHBondContact O-NH1 2.79Å
160	P	94.9	Very high	91.2	Very high	67 Å²	67	67.4 Å²	67.4	44%	0.435	37%	0.367	S	S	.	.			trans	-65.4	138.3	-175.7	26.9	-34.1	0	0	0	111.1	T168 P239 R245	P160-T168 HydrophobicContact CB-CG2 4.19Å; P160-P239 VanDerWaalsContact O-CD 3.31Å; P160-P239 WeakPolarHBondContact O-CD 3.3Å; P160-R245 PolarHBondContact O-NH1 2.91Å; P160-R245 PolarHBondContact O-NH2 3.22Å; P160-R245 VanDerWaalsContact O-NH2 3.07Å
161	L	97	Very high	91.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	147.3	170.6	-62.6	176.3	0	0	0	109.4	V157 G159 T168 T169 L174 V215 L236 A237 V238	V157-L161 HydrophobicContact CG2-CD2 4.29Å; G159-L161 PolarHBondContact O-N 2.98Å; L161-T168 CarbonylContact O-C 3.46Å; L161-T168 WeakPolarHBondContact O-CA 3.13Å; L161-T169 HydrophobicContact CB-CG2 4.06Å; L161-T169 PolarHBondContact N-O 2.85Å; L161-T169 PolarHBondContact O-N 2.85Å; L161-L174 HydrophobicContact CD1-CD1 3.9Å; L161-L174 HydrophobicContact CD1-CG 4.25Å; L161-V215 HydrophobicContact CD1-CG2 4.34Å; L161-V215 HydrophobicContact CD2-CG1 4.22Å; L161-L236 HydrophobicContact CB-CB 4.31Å; L161-L236 HydrophobicContact CB-CD1 4.32Å; L161-L236 HydrophobicContact CD1-CB 4.44Å; L161-L236 HydrophobicContact CD1-CD1 3.77Å; L161-A237 CarbonylContact C-O 3.57Å; L161-A237 WeakPolarHBondContact CA-O 3.43Å; L161-V238 HydrophobicContact CD2-CG2 4.18Å
162	L	96.8	Very high	92	Very high	36 Å²	36	63 Å²	63	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.1	179.9	-59.7	-179.4	0	0	0	111	T168 F226 F230 L236 A237 P239	L162-T168 HydrophobicContact CD2-CG2 3.79Å; L162-F226 HydrophobicContact CD1-CE1 4.09Å; L162-F226 HydrophobicContact CD1-CZ 4.14Å; L162-F230 HydrophobicContact CB-CE1 3.95Å; L162-F230 HydrophobicContact CB-CZ 4.32Å; L162-F230 WeakPolarHBondContact O-CZ 3.47Å; L162-L236 CarbonylContact O-C 3.23Å; L162-L236 WeakPolarHBondContact O-CA 3.36Å; L162-A237 HydrophobicContact CB-CB 4.47Å; L162-A237 PolarHBondContact N-O 3.19Å; L162-A237 PolarHBondContact O-N 3.48Å; L162-P239 HydrophobicContact CD1-CB 4.14Å; L162-P239 HydrophobicContact CD1-CG 4.31Å; L162-P239 HydrophobicContact CD2-CG 4.3Å; L162-P239 HydrophobicContact CG-CB 4.35Å; L162-P239 HydrophobicContact CG-CG 3.97Å
163	R	94.8	Very high	92	Very high	81 Å²	81	60.3 Å²	60.3	31%	0.306	33%	0.329	S	S	.	.			trans	-97.9	154	157.9	-71.1	-174.4	-179.3	-77	-4.4	109.4	N165 R166 Q167 F230 L236	R163-N165 WeakPolarHBondContact CB-OD1 3.32Å; R163-N165 PolarHBondContact O-N 2.84Å; R163-R166 PolarHBondContact O-N 2.83Å; R163-Q167 PolarHBondContact N-O 3.48Å; R163-F230 VanDerWaalsContact C-CE1 3.47Å; R163-L236 HydrophobicContact CG-CD2 3.57Å
164	N	88.4	Confident	92	Very high	72 Å²	72	60 Å²	60	39%	0.385	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.1	179.3	67.4	-1.3	0	0	0	114.1	R166 F230 M233	N164-R166 VanDerWaalsContact C-N 3.26Å; N164-R166 PolarHBondContact O-N 2.82Å; N164-F230 HydrophobicContact CB-CE1 4.19Å; N164-F230 HydrophobicContact CB-CZ 4.2Å; N164-M233 WeakPolarHBondContact CB-O 3.25Å; N164-M233 PolarHBondContact ND2-O 3.15Å
165	N	87.4	Confident	91.9	Very high	81 Å²	81	64.1 Å²	64.1	43%	0.433	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	14.3	172.6	70.5	-0.8	0	0	0	113.7	R163 Q167	R163-N165 WeakPolarHBondContact CB-OD1 3.32Å; R163-N165 PolarHBondContact O-N 2.84Å; N165-Q167 VanDerWaalsContact ND2-CD 3.28Å; N165-Q167 PolarHBondContact ND2-OE1 3Å; N165-Q167 PolarHBondContact O-N 3.04Å; N165-Q167 WeakPolarHBondContact OD1-CB 3.43Å; N165-Q167 WeakPolarHBondContact OD1-CG 3.32Å; N165-Q167 PolarHBondContact OD1-N 2.94Å
166	R	80.8	Confident	92	Very high	213 Å²	213	61.6 Å²	61.6	80%	0.804	34%	0.338	S	S	*	.	S	Bend	trans	66	9.6	-177.6	-53	-179.2	175.6	-172.2	-3.8	115.3	R163 N164	R163-R166 PolarHBondContact O-N 2.83Å; N164-R166 VanDerWaalsContact C-N 3.26Å; N164-R166 PolarHBondContact O-N 2.82Å
167	Q	90.3	Very high	92.1	Very high	117 Å²	117	63.3 Å²	63.3	55%	0.547	35%	0.346	S	S	.	.			trans	-79.3	150.3	170.3	-64.2	176.2	-14.4	0	0	110.4	R163 N165	R163-Q167 PolarHBondContact N-O 3.48Å; N165-Q167 VanDerWaalsContact ND2-CD 3.28Å; N165-Q167 PolarHBondContact ND2-OE1 3Å; N165-Q167 PolarHBondContact O-N 3.04Å; N165-Q167 WeakPolarHBondContact OD1-CB 3.43Å; N165-Q167 WeakPolarHBondContact OD1-CG 3.32Å; N165-Q167 PolarHBondContact OD1-N 2.94Å
168	T	92.2	Very high	92.3	Very high	99 Å²	99	66.1 Å²	66.1	61%	0.607	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	147	171.2	47.9	0	0	0	0	110.5	P160 L161 L162	P160-T168 HydrophobicContact CB-CG2 4.19Å; L161-T168 CarbonylContact O-C 3.46Å; L161-T168 WeakPolarHBondContact O-CA 3.13Å; L162-T168 HydrophobicContact CD2-CG2 3.79Å
169	T	93.4	Very high	92.5	Very high	35 Å²	35	64.1 Å²	64.1	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	156.3	170.2	-161.7	0	0	0	0	109.6	L161 L236	L161-T169 HydrophobicContact CB-CG2 4.06Å; L161-T169 PolarHBondContact N-O 2.85Å; L161-T169 PolarHBondContact O-N 2.85Å; T169-L236 HydrophobicContact CG2-CD1 3.78Å; T169-L236 HydrophobicContact CG2-CD2 3.7Å; T169-L236 HydrophobicContact CG2-CG 4.4Å
170	D	91.1	Very high	92.8	Very high	82 Å²	82	62.9 Å²	62.9	44%	0.439	33%	0.327	S	S	.	.			trans	-84.6	158.3	178.2	-174.7	-100.1	0	0	0	110.9	S172 S173	D170-S172 PolarHBondContact O-N 2.89Å; D170-S172 WeakPolarHBondContact OD1-CB 3.26Å; D170-S172 PolarHBondContact OD1-N 2.77Å; D170-S172 PolarHBondContact OD1-OG 2.79Å; D170-S173 WeakPolarHBondContact O-CB 3.35Å; D170-S173 PolarHBondContact O-N 2.88Å; D170-S173 VanDerWaalsContact O-N 3.09Å; D170-S173 PolarHBondContact O-OG 2.89Å
171	I	91.4	Very high	92.9	Very high	32 Å²	32	59.7 Å²	59.7	16%	0.164	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-57.1	-29.3	176.1	-175.9	-176.5	0	0	0	112.8	A154 V157 S173 L174	A154-I171 HydrophobicContact CB-CD1 4.22Å; A154-I171 WeakPolarHBondContact O-CD1 3.48Å; V157-I171 HydrophobicContact CG1-CD1 3.18Å; V157-I171 HydrophobicContact CG1-CG1 3.81Å; I171-S173 PolarHBondContact O-N 2.95Å; I171-L174 HydrophobicContact CG1-CD1 4.23Å; I171-L174 VanDerWaalsContact O-CB 3.31Å; I171-L174 WeakPolarHBondContact O-CB 3.35Å; I171-L174 PolarHBondContact O-N 3.1Å
172	S	89.5	Confident	93	Very high	60 Å²	60	59.7 Å²	59.7	42%	0.42	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-53.4	-21.1	174.5	48	0	0	0	0	113.8	D170 L174 E175	D170-S172 PolarHBondContact O-N 2.89Å; D170-S172 WeakPolarHBondContact OD1-CB 3.26Å; D170-S172 PolarHBondContact OD1-N 2.77Å; D170-S172 PolarHBondContact OD1-OG 2.79Å; S172-L174 PolarHBondContact O-N 2.83Å; S172-E175 WeakPolarHBondContact O-CB 3.32Å; S172-E175 PolarHBondContact O-N 2.9Å
173	S	90.7	Very high	93.1	Very high	33 Å²	33	58.2 Å²	58.2	23%	0.231	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-64.7	-15.5	171	64.4	0	0	0	0	114.9	D170 I171	D170-S173 WeakPolarHBondContact O-CB 3.35Å; D170-S173 PolarHBondContact O-N 2.88Å; D170-S173 VanDerWaalsContact O-N 3.09Å; D170-S173 PolarHBondContact O-OG 2.89Å; I171-S173 PolarHBondContact O-N 2.95Å
174	L	93.6	Very high	93.2	Very high	11 Å²	11	54.4 Å²	54.4	6%	0.058	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-92.9	-12.3	176.4	-58.1	-178.4	0	0	0	113	F153 L161 I171 S172 G176 H177 V179 E213 V215 L236	F153-L174 HydrophobicContact CE1-CD1 4.35Å; F153-L174 HydrophobicContact CZ-CD1 4.47Å; L161-L174 HydrophobicContact CD1-CD1 3.9Å; L161-L174 HydrophobicContact CD1-CG 4.25Å; I171-L174 HydrophobicContact CG1-CD1 4.23Å; I171-L174 VanDerWaalsContact O-CB 3.31Å; I171-L174 WeakPolarHBondContact O-CB 3.35Å; I171-L174 PolarHBondContact O-N 3.1Å; S172-L174 PolarHBondContact O-N 2.83Å; L174-G176 PolarHBondContact O-N 3.43Å; L174-H177 WeakPolarHBondContact O-CB 3.39Å; L174-H177 PolarHBondContact O-N 3.24Å; L174-H177 VanDerWaalsContact O-N 3.09Å; L174-V179 HydrophobicContact CB-CG2 4.14Å; L174-V179 HydrophobicContact CD2-CG2 4.32Å; L174-E213 HydrophobicContact CD2-CB 3.95Å; L174-E213 HydrophobicContact CD2-CG 3.7Å; L174-V215 HydrophobicContact CD1-CG2 3.78Å; L174-V215 HydrophobicContact CD2-CG2 3.99Å; L174-L236 HydrophobicContact CD2-CD1 3.94Å
175	E	91.9	Very high	93.6	Very high	147 Å²	147	51 Å²	51	69%	0.687	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	133.7	-177.9	-71.5	175.9	-166.5	0	0	110.6	S172 H177	S172-E175 WeakPolarHBondContact O-CB 3.32Å; S172-E175 PolarHBondContact O-N 2.9Å; E175-H177 PolarHBondContact O-N 3.31Å; E175-H177 PolarHBondContact O-ND1 2.99Å
176	G	92.9	Very high	94	Very high	48 Å²	48	49.2 Å²	49.2	50%	0.495	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	5.2	-178.3	0	0	0	0	0	114.9	L174	L174-G176 PolarHBondContact O-N 3.43Å
177	H	96.6	Very high	94.6	Very high	43 Å²	43	44.6 Å²	44.6	20%	0.199	24%	0.238	C	C	.	.	S	Bend	trans	-101.3	143.1	176.6	-66.3	68	0	0	0	111.2	L174 E175 V179 H211 E213 A266	L174-H177 WeakPolarHBondContact O-CB 3.39Å; L174-H177 PolarHBondContact O-N 3.24Å; L174-H177 VanDerWaalsContact O-N 3.09Å; E175-H177 PolarHBondContact O-N 3.31Å; E175-H177 PolarHBondContact O-ND1 2.99Å; H177-V179 WeakPolarHBondContact O-CG2 3.38Å; H177-V179 PolarHBondContact O-N 3Å; H177-H211 CarbonylContact C-O 3.51Å; H177-H211 WeakPolarHBondContact CA-O 3.38Å; H177-E213 HydrophobicContact CB-CB 4.44Å; H177-A266 WeakPolarHBondContact O-CA 3.48Å
178	Y	98	Very high	94.7	Very high	59 Å²	59	39.5 Å²	39.5	23%	0.231	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	132.1	153.5	-66.8	-78.7	0	0	0	108.6	H211 F212 E213 L264 D265 I271 F288 P289	Y178-H211 PolarHBondContact N-O 2.73Å; Y178-F212 VanDerWaalsContact O-CD2 3.29Å; Y178-F212 WeakPolarHBondContact O-CD2 3.41Å; Y178-E213 PolarHBondContact O-N 2.93Å; Y178-L264 WeakPolarHBondContact CA-O 3.39Å; Y178-D265 HydrophobicContact CE1-CB 4.33Å; Y178-I271 HydrophobicContact CD1-CD1 3.64Å; Y178-I271 HydrophobicContact CE1-CD1 3.7Å; Y178-F288 AromaticContact CD2-CE1 3.76Å; Y178-F288 HydrophobicContact CD2-CE1 3.76Å; Y178-F288 AromaticContact CD2-CZ 3.95Å; Y178-F288 HydrophobicContact CD2-CZ 3.95Å; Y178-F288 HydrophobicContact CE2-CE1 4.22Å; Y178-F288 HydrophobicContact CG-CE1 4.09Å; Y178-F288 AromaticContact CG-CZ 3.85Å; Y178-F288 HydrophobicContact CG-CZ 3.85Å; Y178-P289 HydrophobicContact CD1-CB 3.75Å; Y178-P289 HydrophobicContact CD1-CG 4.4Å; Y178-P289 HydrophobicContact CE1-CB 3.58Å; Y178-P289 HydrophobicContact CE1-CG 3.72Å; Y178-P289 HydrophobicContact CE2-CB 4.44Å; Y178-P289 HydrophobicContact CG-CB 4.28Å
179	V	98.3	Very high	94.7	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.024	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.9	-176.9	-175.8	0	0	0	0	111.1	F153 L174 H177 V181 E213 V215 L264	F153-V179 HydrophobicContact CE1-CB 4.39Å; F153-V179 HydrophobicContact CE1-CG1 4.1Å; F153-V179 HydrophobicContact CE1-CG2 4.42Å; F153-V179 HydrophobicContact CZ-CG1 3.96Å; L174-V179 HydrophobicContact CB-CG2 4.14Å; L174-V179 HydrophobicContact CD2-CG2 4.32Å; H177-V179 WeakPolarHBondContact O-CG2 3.38Å; H177-V179 PolarHBondContact O-N 3Å; V179-V181 HydrophobicContact CG1-CG2 4.13Å; V179-E213 CarbonylContact C-O 3.45Å; V179-E213 VanDerWaalsContact CA-O 3.3Å; V179-E213 WeakPolarHBondContact CA-O 3.39Å; V179-V215 HydrophobicContact CG1-CG2 4Å; V179-L264 HydrophobicContact CB-CB 4.31Å; V179-L264 HydrophobicContact CB-CD1 4.4Å; V179-L264 PolarHBondContact N-O 2.94Å; V179-L264 VanDerWaalsContact N-O 3.07Å; V179-L264 PolarHBondContact O-N 3.29Å
180	G	98.3	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	105.5	169	0	0	0	0	0	111.4	Y182 E213 M214 V215 I262	G180-Y182 PolarHBondContact O-N 3.43Å; G180-E213 PolarHBondContact N-O 3.01Å; G180-M214 CarbonylContact O-C 3.5Å; G180-M214 VanDerWaalsContact O-CA 3.22Å; G180-M214 WeakPolarHBondContact O-CA 3.3Å; G180-M214 WeakPolarHBondContact O-CB 3.31Å; G180-V215 PolarHBondContact O-N 3.21Å; G180-I262 CarbonylContact C-O 3.53Å; G180-I262 WeakPolarHBondContact CA-O 3.46Å
181	V	98.5	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	109.3	174.9	-168.5	0	0	0	0	109.2	F153 V179 F183 V215 V217 F253 I262 L264	F153-V181 HydrophobicContact CE2-CG2 3.68Å; F153-V181 HydrophobicContact CZ-CG2 3.88Å; V179-V181 HydrophobicContact CG1-CG2 4.13Å; V181-F183 HydrophobicContact CB-CE2 4.21Å; V181-F183 HydrophobicContact CG1-CD2 4.26Å; V181-F183 HydrophobicContact CG1-CE2 3.48Å; V181-F183 VanDerWaalsContact CG1-CE2 3.48Å; V181-F183 HydrophobicContact CG1-CZ 3.81Å; V181-V215 WeakPolarHBondContact CA-O 3.18Å; V181-V217 HydrophobicContact CG1-CG2 3.74Å; V181-F253 HydrophobicContact CB-CE2 4.21Å; V181-F253 HydrophobicContact CG1-CD2 4.5Å; V181-F253 HydrophobicContact CG1-CE2 4.13Å; V181-F253 HydrophobicContact CG2-CE2 3.99Å; V181-F253 HydrophobicContact CG2-CZ 4.34Å; V181-I262 HydrophobicContact CB-CB 4.33Å; V181-I262 PolarHBondContact N-O 2.74Å; V181-I262 PolarHBondContact O-N 3.2Å; V181-L264 HydrophobicContact CG2-CD1 4.02Å; V181-L264 HydrophobicContact CG2-CG 4.49Å
182	Y	98.5	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	110.3	-171.3	180	-139	0	0	0	111.5	G180 S184 C191 L194 T195 L198 M214 V215 F216 V217 Y229 M233 W235 P259	G180-Y182 PolarHBondContact O-N 3.43Å; Y182-S184 VanDerWaalsContact CZ-OG 3.29Å; Y182-S184 WeakPolarHBondContact OH-CB 3.24Å; Y182-S184 PolarHBondContact OH-OG 3.02Å; Y182-C191 PolarHBondContact OH-O 3.01Å; Y182-L194 HydrophobicContact CE2-CD2 4.01Å; Y182-T195 WeakPolarHBondContact CE1-OG1 3.4Å; Y182-T195 PolarHBondContact OH-OG1 3.3Å; Y182-L198 HydrophobicContact CD1-CD1 4.26Å; Y182-L198 HydrophobicContact CD2-CD1 3.96Å; Y182-L198 HydrophobicContact CE1-CD1 4.1Å; Y182-L198 HydrophobicContact CE2-CD1 3.81Å; Y182-L198 HydrophobicContact CG-CD1 4.19Å; Y182-M214 HydrophobicContact CD1-CE 4.45Å; Y182-M214 HydrophobicContact CG-CE 4.34Å; Y182-V215 PolarHBondContact N-O 2.93Å; Y182-F216 HydrophobicContact CD1-CD2 4.09Å; Y182-F216 WeakPolarHBondContact O-CD2 3.44Å; Y182-V217 PolarHBondContact O-N 3.36Å; Y182-Y229 PolarHBondContact OH-OH 3.47Å; Y182-M233 HydrophobicContact CE1-CE 4.4Å; Y182-W235 HydrophobicContact CD1-CZ2 4.07Å; Y182-W235 HydrophobicContact CE1-CZ2 4.29Å; Y182-P259 HydrophobicContact CE2-CB 3.98Å
183	F	98.1	Very high	95.3	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.8	176	-64.7	-94.2	0	0	0	109.9	V181 V217 L249 N250 F253 I255 I258 P259 T260 I262	V181-F183 HydrophobicContact CB-CE2 4.21Å; V181-F183 HydrophobicContact CG1-CD2 4.26Å; V181-F183 HydrophobicContact CG1-CE2 3.48Å; V181-F183 VanDerWaalsContact CG1-CE2 3.48Å; V181-F183 HydrophobicContact CG1-CZ 3.81Å; F183-V217 WeakPolarHBondContact CA-O 3.43Å; F183-V217 HydrophobicContact CD1-CB 3.7Å; F183-V217 HydrophobicContact CD1-CG1 3.76Å; F183-V217 HydrophobicContact CD1-CG2 4.42Å; F183-V217 HydrophobicContact CE1-CB 3.72Å; F183-V217 HydrophobicContact CE1-CG1 3.57Å; F183-V217 HydrophobicContact CE1-CG2 4.04Å; F183-V217 HydrophobicContact CG-CB 4.33Å; F183-V217 HydrophobicContact CZ-CB 4.34Å; F183-V217 HydrophobicContact CZ-CG1 4.48Å; F183-V217 HydrophobicContact CZ-CG2 4.19Å; F183-L249 HydrophobicContact CE1-CB 4.2Å; F183-L249 HydrophobicContact CZ-CB 4.05Å; F183-N250 HydrophobicContact CE1-CB 4.26Å; F183-F253 AromaticContact CE2-CD2 3.84Å; F183-F253 HydrophobicContact CE2-CD2 3.84Å; F183-F253 AromaticContact CZ-CD2 3.82Å; F183-F253 HydrophobicContact CZ-CD2 3.82Å; F183-I255 HydrophobicContact CB-CG2 4.16Å; F183-I255 HydrophobicContact CD1-CG1 3.96Å; F183-I255 HydrophobicContact CD1-CG2 4.35Å; F183-I255 HydrophobicContact CD2-CD1 3.67Å; F183-I255 HydrophobicContact CD2-CG1 3.75Å; F183-I255 HydrophobicContact CE1-CG1 3.87Å; F183-I255 HydrophobicContact CE2-CD1 3.71Å; F183-I255 HydrophobicContact CE2-CG1 3.67Å; F183-I255 HydrophobicContact CG-CD1 4.23Å; F183-I255 HydrophobicContact CG-CG1 3.9Å; F183-I255 HydrophobicContact CG-CG2 4.13Å; F183-I255 HydrophobicContact CZ-CD1 4.28Å; F183-I255 HydrophobicContact CZ-CG1 3.74Å; F183-I258 HydrophobicContact CB-CG2 4.14Å; F183-P259 WeakPolarHBondContact O-CA 3.36Å; F183-T260 PolarHBondContact N-O 3.36Å; F183-T260 PolarHBondContact O-N 3.11Å; F183-I262 HydrophobicContact CE2-CG1 4.29Å
184	S	97.8	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	167.8	-170.3	-177	0	0	0	0	112.8	Y182 C191 F216 V217 A219 Y229	Y182-S184 VanDerWaalsContact CZ-OG 3.29Å; Y182-S184 WeakPolarHBondContact OH-CB 3.24Å; Y182-S184 PolarHBondContact OH-OG 3.02Å; S184-C191 WeakPolarHBondContact OG-CB 3.31Å; S184-C191 PolarHBondContact OG-SG 3.32Å; S184-C191 VanDerWaalsContact OG-SG 3.36Å; S184-F216 WeakPolarHBondContact O-CE2 3.29Å; S184-V217 PolarHBondContact N-O 2.87Å; S184-A219 PolarHBondContact O-N 2.94Å; S184-Y229 WeakPolarHBondContact OG-CE1 3.49Å; S184-Y229 PolarHBondContact OG-OH 3.2Å
185	A	96.8	Very high	95.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.			trans	-153.2	148.8	175.5	0	0	0	0	0	112.3	W187 C188 C191 A219 Y229 I258	A185-W187 VanDerWaalsContact C-N 3.33Å; A185-W187 HydrophobicContact CB-CD2 4.23Å; A185-W187 HydrophobicContact CB-CG 4.27Å; A185-W187 HydrophobicContact CB-CZ2 4.05Å; A185-W187 PolarHBondContact O-N 3.27Å; A185-C188 WeakPolarHBondContact O-CB 3.4Å; A185-C188 PolarHBondContact O-N 3.28Å; A185-C191 WeakPolarHBondContact O-CB 3.29Å; A185-A219 HydrophobicContact CB-CB 4.12Å; A185-Y229 VanDerWaalsContact C-CE1 3.45Å; A185-I258 HydrophobicContact CB-CD1 3.59Å
186	H	94.4	Very high	95.9	Very high	44 Å²	44	38.7 Å²	38.7	20%	0.204	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-39.5	-176	-173.1	-122.8	0	0	0	112.8	C188 R192 D220 Y229	H186-C188 PolarHBondContact O-N 2.82Å; H186-C188 VanDerWaalsContact O-N 3.16Å; H186-R192 WeakPolarHBondContact O-CD 3.27Å; H186-R192 PolarHBondContact O-NH1 3.43Å; H186-D220 VanDerWaalsContact CB-OD1 3.27Å; H186-D220 WeakPolarHBondContact CB-OD1 3.5Å; H186-D220 PolarHBondContact N-OD1 3.16Å; H186-Y229 HydrophobicContact CB-CD1 3.89Å; H186-Y229 HydrophobicContact CB-CG 3.83Å; H186-Y229 AromaticContact CD2-CD2 3.9Å; H186-Y229 AromaticContact CD2-CG 3.96Å; H186-Y229 VanDerWaalsContact N-CD1 3.35Å
187	W	93.8	Very high	96.1	Very high	117 Å²	117	38.4 Å²	38.4	44%	0.443	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-14.6	-177.5	56.5	-97.8	0	0	0	113.2	A185 P189 A219 I258	A185-W187 VanDerWaalsContact C-N 3.33Å; A185-W187 HydrophobicContact CB-CD2 4.23Å; A185-W187 HydrophobicContact CB-CG 4.27Å; A185-W187 HydrophobicContact CB-CZ2 4.05Å; A185-W187 PolarHBondContact O-N 3.27Å; W187-P189 WeakPolarHBondContact O-CD 3.22Å; W187-A219 PolarHBondContact NE1-O 3.23Å; W187-A219 VanDerWaalsContact NE1-O 3.08Å; W187-I258 HydrophobicContact CH2-CD1 3.83Å; W187-I258 HydrophobicContact CH2-CG1 4.46Å; W187-I258 HydrophobicContact CZ2-CD1 3.71Å
188	C	93.3	Very high	96.1	Very high	10 Å²	10	36.4 Å²	36.4	7%	0.068	18%	0.175	C	C	.	.			trans	-93.2	114.4	-176	-176.4	0	0	0	0	111.1	A185 H186 P190 C191 R192 I258	A185-C188 WeakPolarHBondContact O-CB 3.4Å; A185-C188 PolarHBondContact O-N 3.28Å; H186-C188 PolarHBondContact O-N 2.82Å; H186-C188 VanDerWaalsContact O-N 3.16Å; C188-P190 VanDerWaalsContact SG-CD 3.57Å; C188-P190 VanDerWaalsContact SG-CG 3.55Å; C188-C191 HydrophobicContact CB-CB 3.77Å; C188-C191 VanDerWaalsContact CB-SG 3.5Å; C188-C191 VanDerWaalsContact O-CB 3.25Å; C188-C191 WeakPolarHBondContact O-CB 3.48Å; C188-C191 PolarHBondContact O-N 3.14Å; C188-C191 PolarHBondContact SG-SG 2.94Å; C188-R192 PolarHBondContact O-N 2.77Å; C188-I258 HydrophobicContact CB-CD1 3.95Å; C188-I258 HydrophobicContact CB-CG1 4.42Å
189	P	92.9	Very high	96.1	Very high	74 Å²	74	35.2 Å²	35.2	48%	0.481	17%	0.172	S	C	.	.	H	α-helix	trans	-57.8	-46.2	-179.8	-24.1	34.2	0	0	0	116.3	W187 C191 R192 S193	W187-P189 WeakPolarHBondContact O-CD 3.22Å; P189-C191 PolarHBondContact O-N 3.44Å; P189-R192 PolarHBondContact O-N 3.32Å; P189-S193 PolarHBondContact O-N 3.02Å; P189-S193 PolarHBondContact O-OG 3Å
190	P	92.2	Very high	96	Very high	59 Å²	59	41.2 Å²	41.2	38%	0.383	20%	0.2	S	C	.	.	H	α-helix	trans	-64.7	-28.5	177.1	23.3	-32.4	0	0	0	112.5	C188 S193 L194 P259	C188-P190 VanDerWaalsContact SG-CD 3.57Å; C188-P190 VanDerWaalsContact SG-CG 3.55Å; P190-S193 PolarHBondContact O-N 3.19Å; P190-L194 PolarHBondContact O-N 3.46Å; P190-P259 HydrophobicContact CB-CG 4.43Å
191	C	95.8	Very high	96	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-48.8	173.2	-74.7	0	0	0	0	112.3	Y182 S184 A185 C188 P189 S193 L194 T195 Y229 P259	Y182-C191 PolarHBondContact OH-O 3.01Å; S184-C191 WeakPolarHBondContact OG-CB 3.31Å; S184-C191 PolarHBondContact OG-SG 3.32Å; S184-C191 VanDerWaalsContact OG-SG 3.36Å; A185-C191 WeakPolarHBondContact O-CB 3.29Å; C188-C191 HydrophobicContact CB-CB 3.77Å; C188-C191 VanDerWaalsContact CB-SG 3.5Å; C188-C191 VanDerWaalsContact O-CB 3.25Å; C188-C191 WeakPolarHBondContact O-CB 3.48Å; C188-C191 PolarHBondContact O-N 3.14Å; C188-C191 PolarHBondContact SG-SG 2.94Å; P189-C191 PolarHBondContact O-N 3.44Å; C191-S193 VanDerWaalsContact C-N 3.25Å; C191-S193 PolarHBondContact O-N 3.47Å; C191-L194 PolarHBondContact O-N 3Å; C191-T195 PolarHBondContact O-N 3.41Å; C191-T195 PolarHBondContact O-OG1 3Å; C191-Y229 PolarHBondContact O-OH 2.82Å; C191-P259 HydrophobicContact CB-CB 4.38Å; C191-P259 VanDerWaalsContact SG-CD 3.6Å; C191-P259 VanDerWaalsContact SG-N 3.44Å
192	R	95.4	Very high	95.9	Very high	91 Å²	91	42.2 Å²	42.2	34%	0.343	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-35.7	178.9	-63.2	-168.7	-56.6	-84.6	0.3	112.2	H186 C188 P189 R196 Y229	H186-R192 WeakPolarHBondContact O-CD 3.27Å; H186-R192 PolarHBondContact O-NH1 3.43Å; C188-R192 PolarHBondContact O-N 2.77Å; P189-R192 PolarHBondContact O-N 3.32Å; R192-R196 PolarHBondContact O-N 3.43Å; R192-Y229 HydrophobicContact CG-CE2 4.42Å
193	S	94	Very high	95.9	Very high	71 Å²	71	48.9 Å²	48.9	50%	0.497	23%	0.23	S	C	.	.	H	α-helix	trans	-66.2	-48.6	177	-53.4	0	0	0	0	111	P189 P190 C191 T195 R196	P189-S193 PolarHBondContact O-N 3.02Å; P189-S193 PolarHBondContact O-OG 3Å; P190-S193 PolarHBondContact O-N 3.19Å; C191-S193 VanDerWaalsContact C-N 3.25Å; C191-S193 PolarHBondContact O-N 3.47Å; S193-T195 VanDerWaalsContact C-N 3.33Å; S193-T195 PolarHBondContact O-N 2.94Å; S193-R196 PolarHBondContact O-N 3.47Å
194	L	95.7	Very high	95.8	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-36.5	177.9	-173.5	64.1	0	0	0	112.4	Y182 P190 C191 R196 V197 L198 P259 R276 L280	Y182-L194 HydrophobicContact CE2-CD2 4.01Å; P190-L194 PolarHBondContact O-N 3.46Å; C191-L194 PolarHBondContact O-N 3Å; L194-R196 PolarHBondContact O-N 3.18Å; L194-V197 PolarHBondContact O-N 3.21Å; L194-L198 HydrophobicContact CD1-CG 4.41Å; L194-L198 HydrophobicContact CD2-CD1 4.14Å; L194-L198 HydrophobicContact CG-CD1 3.8Å; L194-L198 HydrophobicContact CG-CG 4.11Å; L194-L198 WeakPolarHBondContact O-CG 3.24Å; L194-L198 PolarHBondContact O-N 2.99Å; L194-P259 HydrophobicContact CB-CB 4.48Å; L194-P259 HydrophobicContact CB-CG 4.26Å; L194-P259 HydrophobicContact CD2-CB 3.68Å; L194-P259 HydrophobicContact CD2-CG 3.91Å; L194-R276 HydrophobicContact CD1-CG 4.14Å; L194-R276 HydrophobicContact CD2-CB 3.99Å; L194-R276 HydrophobicContact CD2-CG 3.81Å; L194-L280 HydrophobicContact CD1-CD1 4.43Å; L194-L280 HydrophobicContact CD1-CD2 4.22Å; L194-L280 HydrophobicContact CD1-CG 4.16Å
195	T	97.2	Very high	95.8	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-38.8	176.1	-70.7	0	0	0	0	112.6	Y182 C191 S193 L198 L199 Y229 M233	Y182-T195 WeakPolarHBondContact CE1-OG1 3.4Å; Y182-T195 PolarHBondContact OH-OG1 3.3Å; C191-T195 PolarHBondContact O-N 3.41Å; C191-T195 PolarHBondContact O-OG1 3Å; S193-T195 VanDerWaalsContact C-N 3.33Å; S193-T195 PolarHBondContact O-N 2.94Å; T195-L198 PolarHBondContact O-N 3.31Å; T195-L199 HydrophobicContact CG2-CD1 4.5Å; T195-L199 HydrophobicContact CG2-CG 4.49Å; T195-L199 VanDerWaalsContact O-CG 3.3Å; T195-L199 WeakPolarHBondContact O-CG 3.38Å; T195-L199 PolarHBondContact O-N 3.23Å; T195-Y229 HydrophobicContact CG2-CE2 4.12Å; T195-Y229 PolarHBondContact OG1-OH 3.17Å; T195-M233 HydrophobicContact CG2-CE 4.23Å; T195-M233 HydrophobicContact CG2-CG 4.41Å
196	R	95.8	Very high	95.8	Very high	178 Å²	178	54.8 Å²	54.8	67%	0.672	26%	0.261	S	S	*	.	H	α-helix	trans	-62.8	-45.3	177.9	-66.9	175.3	-177	175.3	-1	111.7	R192 S193 L194 L198 L199 E200	R192-R196 PolarHBondContact O-N 3.43Å; S193-R196 PolarHBondContact O-N 3.47Å; L194-R196 PolarHBondContact O-N 3.18Å; R196-L198 VanDerWaalsContact C-N 3.35Å; R196-L199 WeakPolarHBondContact O-CB 3.29Å; R196-L199 PolarHBondContact O-N 3.37Å; R196-E200 PolarHBondContact O-N 3.31Å
197	V	96.1	Very high	95.9	Very high	42 Å²	42	60.5 Å²	60.5	26%	0.255	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-46.6	175.4	-176.5	0	0	0	0	110.2	L194 L199 E200 S201 V279 L280	L194-V197 PolarHBondContact O-N 3.21Å; V197-L199 VanDerWaalsContact C-N 3.28Å; V197-L199 PolarHBondContact O-N 2.76Å; V197-E200 PolarHBondContact O-N 2.7Å; V197-E200 VanDerWaalsContact O-N 3.09Å; V197-S201 PolarHBondContact O-N 2.93Å; V197-S201 PolarHBondContact O-OG 3.31Å; V197-S201 VanDerWaalsContact O-OG 3.13Å; V197-V279 HydrophobicContact CG1-CG1 3.68Å; V197-L280 HydrophobicContact CG1-CD2 4.33Å; V197-L280 HydrophobicContact CG2-CD2 4.04Å
198	L	97.7	Very high	95.9	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-30	-179.8	-69.8	170.3	0	0	0	113.5	Y182 L194 T195 R196 E200 Y202 M214 W235 L261 V279	Y182-L198 HydrophobicContact CD1-CD1 4.26Å; Y182-L198 HydrophobicContact CD2-CD1 3.96Å; Y182-L198 HydrophobicContact CE1-CD1 4.1Å; Y182-L198 HydrophobicContact CE2-CD1 3.81Å; Y182-L198 HydrophobicContact CG-CD1 4.19Å; L194-L198 HydrophobicContact CD1-CG 4.41Å; L194-L198 HydrophobicContact CD2-CD1 4.14Å; L194-L198 HydrophobicContact CG-CD1 3.8Å; L194-L198 HydrophobicContact CG-CG 4.11Å; L194-L198 WeakPolarHBondContact O-CG 3.24Å; L194-L198 PolarHBondContact O-N 2.99Å; T195-L198 PolarHBondContact O-N 3.31Å; R196-L198 VanDerWaalsContact C-N 3.35Å; L198-E200 VanDerWaalsContact C-N 3.32Å; L198-Y202 WeakPolarHBondContact O-CB 3.4Å; L198-Y202 PolarHBondContact O-N 3.49Å; L198-M214 HydrophobicContact CB-CE 4.3Å; L198-M214 HydrophobicContact CD1-CE 4Å; L198-M214 HydrophobicContact CD2-CE 4.26Å; L198-M214 HydrophobicContact CG-CE 4.42Å; L198-W235 HydrophobicContact CB-CH2 3.72Å; L198-W235 HydrophobicContact CB-CZ3 4.13Å; L198-L261 HydrophobicContact CD2-CD2 3.64Å; L198-V279 HydrophobicContact CD2-CB 4.48Å; L198-V279 HydrophobicContact CD2-CG1 3.97Å; L198-V279 HydrophobicContact CD2-CG2 4.05Å
199	L	97.4	Very high	96	Very high	33 Å²	33	61 Å²	61	17%	0.173	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-41.5	173.8	-73.4	171.1	0	0	0	111.9	T195 R196 V197 R203 P234 W235	T195-L199 HydrophobicContact CG2-CD1 4.5Å; T195-L199 HydrophobicContact CG2-CG 4.49Å; T195-L199 VanDerWaalsContact O-CG 3.3Å; T195-L199 WeakPolarHBondContact O-CG 3.38Å; T195-L199 PolarHBondContact O-N 3.23Å; R196-L199 WeakPolarHBondContact O-CB 3.29Å; R196-L199 PolarHBondContact O-N 3.37Å; V197-L199 VanDerWaalsContact C-N 3.28Å; V197-L199 PolarHBondContact O-N 2.76Å; L199-R203 WeakPolarHBondContact O-CG 3.43Å; L199-R203 PolarHBondContact O-N 3.37Å; L199-P234 HydrophobicContact CD2-CG 3.92Å; L199-W235 HydrophobicContact CD2-CH2 4.15Å; L199-W235 HydrophobicContact CD2-CZ3 4.05Å; L199-W235 HydrophobicContact CG-CH2 4.39Å
200	E	96.8	Very high	96.1	Very high	131 Å²	131	61.3 Å²	61.3	61%	0.612	31%	0.312	S	S	*	.	H	α-helix	trans	-70.8	-51.9	177	-66.3	176.5	179.3	0	0	109.8	R196 V197 L198 Y202 R203 T204	R196-E200 PolarHBondContact O-N 3.31Å; V197-E200 PolarHBondContact O-N 2.7Å; V197-E200 VanDerWaalsContact O-N 3.09Å; L198-E200 VanDerWaalsContact C-N 3.32Å; E200-Y202 VanDerWaalsContact C-N 3.33Å; E200-Y202 PolarHBondContact O-N 3.19Å; E200-R203 WeakPolarHBondContact O-CB 3.29Å; E200-R203 PolarHBondContact O-N 3.05Å; E200-R203 VanDerWaalsContact O-N 3.07Å; E200-T204 PolarHBondContact O-N 2.81Å; E200-T204 PolarHBondContact O-OG1 3.25Å; E200-T204 VanDerWaalsContact O-OG1 3.07Å
201	S	97.3	Very high	96.2	Very high	4 Å²	4	64.1 Å²	64.1	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-42.4	179.7	-52.6	0	0	0	0	113	V197 R203 T204 V205 V279 C285	V197-S201 PolarHBondContact O-N 2.93Å; V197-S201 PolarHBondContact O-OG 3.31Å; V197-S201 VanDerWaalsContact O-OG 3.13Å; S201-R203 VanDerWaalsContact C-N 3.31Å; S201-R203 PolarHBondContact O-N 3.14Å; S201-T204 PolarHBondContact O-N 2.81Å; S201-V205 WeakPolarHBondContact O-CB 3.45Å; S201-V205 VanDerWaalsContact O-CG2 3.26Å; S201-V205 WeakPolarHBondContact O-CG2 3.29Å; S201-V205 PolarHBondContact O-N 2.92Å; S201-V279 WeakPolarHBondContact OG-CG1 3.43Å; S201-C285 WeakPolarHBondContact CA-SG 3.37Å; S201-C285 WeakPolarHBondContact CB-SG 3.4Å
202	Y	97.8	Very high	96.3	Very high	17 Å²	17	64.3 Å²	64.3	7%	0.067	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-41.1	176.9	178.2	-93.6	0	0	0	112.1	L198 E200 K206 F212 E213 M214 P234 W235	L198-Y202 WeakPolarHBondContact O-CB 3.4Å; L198-Y202 PolarHBondContact O-N 3.49Å; E200-Y202 VanDerWaalsContact C-N 3.33Å; E200-Y202 PolarHBondContact O-N 3.19Å; Y202-K206 HydrophobicContact CD1-CD 4.06Å; Y202-K206 HydrophobicContact CD2-CD 4.29Å; Y202-K206 HydrophobicContact CE1-CD 3.49Å; Y202-K206 VanDerWaalsContact CE1-CD 3.49Å; Y202-K206 HydrophobicContact CE2-CD 3.77Å; Y202-K206 HydrophobicContact CG-CD 4.44Å; Y202-K206 WeakPolarHBondContact O-CB 3.3Å; Y202-K206 WeakPolarHBondContact O-CG 2.94Å; Y202-K206 PolarHBondContact O-N 2.72Å; Y202-K206 PolarHBondContact OH-NZ 2.77Å; Y202-F212 AromaticContact CD2-CD1 3.87Å; Y202-F212 HydrophobicContact CD2-CD1 3.87Å; Y202-F212 AromaticContact CD2-CE1 3.73Å; Y202-F212 HydrophobicContact CD2-CE1 3.73Å; Y202-F212 HydrophobicContact CE2-CD1 4.41Å; Y202-E213 VanDerWaalsContact CE2-OE1 3.3Å; Y202-E213 WeakPolarHBondContact CE2-OE1 3.37Å; Y202-E213 VanDerWaalsContact OH-CD 3.3Å; Y202-E213 PolarHBondContact OH-OE1 3.38Å; Y202-E213 PolarHBondContact OH-OE2 3.34Å; Y202-M214 HydrophobicContact CD2-CB 4.39Å; Y202-M214 HydrophobicContact CD2-CG 3.91Å; Y202-M214 HydrophobicContact CD2-SD 3.7Å; Y202-M214 HydrophobicContact CE2-CB 4.32Å; Y202-M214 HydrophobicContact CE2-CG 4.23Å; Y202-M214 HydrophobicContact CG-SD 4.39Å; Y202-P234 HydrophobicContact CD1-CG 3.82Å; Y202-P234 HydrophobicContact CE1-CB 4.25Å; Y202-P234 HydrophobicContact CE1-CG 3.87Å; Y202-W235 HydrophobicContact CD1-CE3 4.37Å; Y202-W235 AromaticContact CD2-CE3 3.92Å; Y202-W235 HydrophobicContact CD2-CE3 3.92Å; Y202-W235 HydrophobicContact CE2-CB 4Å; Y202-W235 HydrophobicContact CE2-CE3 4.37Å; Y202-W235 AromaticContact CG-CE3 3.9Å; Y202-W235 HydrophobicContact CG-CE3 3.9Å; Y202-W235 HydrophobicContact CG-CZ3 4.31Å
203	R	96.9	Very high	96.4	Very high	140 Å²	140	60.4 Å²	60.4	53%	0.528	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-51.9	176.1	-72.1	173.5	-176.4	159.4	3	110.7	L199 E200 S201 V205 K206 E207	L199-R203 WeakPolarHBondContact O-CG 3.43Å; L199-R203 PolarHBondContact O-N 3.37Å; E200-R203 WeakPolarHBondContact O-CB 3.29Å; E200-R203 PolarHBondContact O-N 3.05Å; E200-R203 VanDerWaalsContact O-N 3.07Å; S201-R203 VanDerWaalsContact C-N 3.31Å; S201-R203 PolarHBondContact O-N 3.14Å; R203-V205 VanDerWaalsContact C-N 3.34Å; R203-V205 PolarHBondContact O-N 3.09Å; R203-K206 PolarHBondContact O-N 3.07Å; R203-E207 WeakPolarHBondContact O-CB 3.46Å; R203-E207 VanDerWaalsContact O-CG 3.32Å; R203-E207 WeakPolarHBondContact O-CG 3.28Å; R203-E207 PolarHBondContact O-N 2.99Å
204	T	97.3	Very high	96.6	Very high	55 Å²	55	57 Å²	57	34%	0.337	28%	0.283	S	S	.	.	H	α-helix	trans	-54.7	-48.8	-179.5	-55.2	0	0	0	0	111.9	E200 S201 K206 E207 S208 C285	E200-T204 PolarHBondContact O-N 2.81Å; E200-T204 PolarHBondContact O-OG1 3.25Å; E200-T204 VanDerWaalsContact O-OG1 3.07Å; S201-T204 PolarHBondContact O-N 2.81Å; T204-K206 PolarHBondContact O-N 2.85Å; T204-E207 PolarHBondContact O-N 3.48Å; T204-S208 PolarHBondContact O-N 2.68Å; T204-C285 HydrophobicContact CG2-CB 3.96Å
205	V	97.4	Very high	96.7	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-45.9	179.7	171.7	0	0	0	0	111	S201 R203 S208 Q210 F212 C285 F288 W290	S201-V205 WeakPolarHBondContact O-CB 3.45Å; S201-V205 VanDerWaalsContact O-CG2 3.26Å; S201-V205 WeakPolarHBondContact O-CG2 3.29Å; S201-V205 PolarHBondContact O-N 2.92Å; R203-V205 VanDerWaalsContact C-N 3.34Å; R203-V205 PolarHBondContact O-N 3.09Å; V205-S208 PolarHBondContact O-N 2.74Å; V205-S208 PolarHBondContact O-OG 2.93Å; V205-Q210 HydrophobicContact CG1-CB 3.75Å; V205-Q210 HydrophobicContact CG1-CG 4.3Å; V205-Q210 WeakPolarHBondContact O-CB 3.39Å; V205-Q210 PolarHBondContact O-N 3.25Å; V205-F212 HydrophobicContact CB-CD1 4Å; V205-F212 HydrophobicContact CG1-CB 3.59Å; V205-F212 HydrophobicContact CG1-CD1 3.7Å; V205-F212 HydrophobicContact CG1-CG 3.81Å; V205-C285 HydrophobicContact CG2-CB 3.74Å; V205-F288 HydrophobicContact CB-CD2 4.45Å; V205-F288 HydrophobicContact CG1-CD1 3.74Å; V205-F288 HydrophobicContact CG1-CD2 3.86Å; V205-F288 HydrophobicContact CG1-CE1 3.64Å; V205-F288 HydrophobicContact CG1-CE2 3.76Å; V205-F288 HydrophobicContact CG1-CG 3.85Å; V205-F288 HydrophobicContact CG1-CZ 3.65Å; V205-F288 HydrophobicContact CG2-CB 4.08Å; V205-F288 HydrophobicContact CG2-CD1 4.48Å; V205-F288 HydrophobicContact CG2-CD2 3.66Å; V205-F288 HydrophobicContact CG2-CE2 4.25Å; V205-F288 HydrophobicContact CG2-CG 3.79Å; V205-W290 HydrophobicContact CG2-CH2 4.25Å; V205-W290 HydrophobicContact CG2-CZ2 4.41Å
206	K	96.4	Very high	96.8	Very high	73 Å²	73	56.7 Å²	56.7	32%	0.317	28%	0.281	S	S	.	.	H	α-helix	trans	-69.2	-36.9	179.6	-68.7	-175.8	80.8	137.5	0	112.7	Y202 R203 T204 S208 G209 F212 E213	Y202-K206 HydrophobicContact CD1-CD 4.06Å; Y202-K206 HydrophobicContact CD2-CD 4.29Å; Y202-K206 HydrophobicContact CE1-CD 3.49Å; Y202-K206 VanDerWaalsContact CE1-CD 3.49Å; Y202-K206 HydrophobicContact CE2-CD 3.77Å; Y202-K206 HydrophobicContact CG-CD 4.44Å; Y202-K206 WeakPolarHBondContact O-CB 3.3Å; Y202-K206 WeakPolarHBondContact O-CG 2.94Å; Y202-K206 PolarHBondContact O-N 2.72Å; Y202-K206 PolarHBondContact OH-NZ 2.77Å; R203-K206 PolarHBondContact O-N 3.07Å; T204-K206 PolarHBondContact O-N 2.85Å; K206-S208 PolarHBondContact O-N 3.38Å; K206-G209 PolarHBondContact O-N 2.68Å; K206-F212 WeakPolarHBondContact CD-O 3.48Å; K206-F212 WeakPolarHBondContact CE-O 3.37Å; K206-F212 HydrophobicContact CG-CB 4.24Å; K206-F212 PolarHBondContact NZ-O 3.06Å; K206-E213 IonicContact NZ-OE2 3.93Å; K206-E213 PolarHBondContact NZ-OE2 3.13Å
207	E	96.6	Very high	96.9	Very high	164 Å²	164	48.4 Å²	48.4	77%	0.766	25%	0.25	S	S	*	.	H	α-helix	trans	-66.4	-26.9	175.7	-73.6	174.4	-177.8	0	0	112.3	R203 T204 G209	R203-E207 WeakPolarHBondContact O-CB 3.46Å; R203-E207 VanDerWaalsContact O-CG 3.32Å; R203-E207 WeakPolarHBondContact O-CG 3.28Å; R203-E207 PolarHBondContact O-N 2.99Å; T204-E207 PolarHBondContact O-N 3.48Å; E207-G209 PolarHBondContact O-N 3.39Å
208	S	94.9	Very high	97	Very high	80 Å²	80	46.6 Å²	46.6	56%	0.559	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-2.4	171.4	79.9	0	0	0	0	114.3	T204 V205 K206 Q210	T204-S208 PolarHBondContact O-N 2.68Å; V205-S208 PolarHBondContact O-N 2.74Å; V205-S208 PolarHBondContact O-OG 2.93Å; K206-S208 PolarHBondContact O-N 3.38Å; S208-Q210 WeakPolarHBondContact OG-CG 3.32Å
209	G	94.1	Very high	96.9	Very high	56 Å²	56	48.4 Å²	48.4	58%	0.577	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	6.4	179.5	0	0	0	0	0	114.6	K206 E207	K206-G209 PolarHBondContact O-N 2.68Å; E207-G209 PolarHBondContact O-N 3.39Å
210	Q	94.6	Very high	96.9	Very high	81 Å²	81	47.2 Å²	47.2	38%	0.379	25%	0.249	S	C	.	.			trans	-73.8	137.2	176.4	-64.4	-66.4	-20.5	0	0	111.3	V205 S208 F212 F288	V205-Q210 HydrophobicContact CG1-CB 3.75Å; V205-Q210 HydrophobicContact CG1-CG 4.3Å; V205-Q210 WeakPolarHBondContact O-CB 3.39Å; V205-Q210 PolarHBondContact O-N 3.25Å; S208-Q210 WeakPolarHBondContact OG-CG 3.32Å; Q210-F212 VanDerWaalsContact C-N 3.31Å; Q210-F212 PolarHBondContact O-N 3.37Å; Q210-F288 HydrophobicContact CB-CD1 4.33Å; Q210-F288 HydrophobicContact CB-CE1 3.96Å; Q210-F288 HydrophobicContact CG-CD1 3.94Å; Q210-F288 HydrophobicContact CG-CE1 4.03Å
211	H	95.4	Very high	96.8	Very high	119 Å²	119	50.3 Å²	50.3	55%	0.551	26%	0.255	S	S	*	.			trans	-75.3	85.5	171.5	-69.2	-86.4	0	0	0	109.2	H177 Y178	H177-H211 CarbonylContact C-O 3.51Å; H177-H211 WeakPolarHBondContact CA-O 3.38Å; Y178-H211 PolarHBondContact N-O 2.73Å
212	F	97.6	Very high	96.8	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.4	-178.8	-178.8	-129.7	0	0	0	111.7	Y178 Y202 V205 K206 Q210 M214 L263 F288	Y178-F212 VanDerWaalsContact O-CD2 3.29Å; Y178-F212 WeakPolarHBondContact O-CD2 3.41Å; Y202-F212 AromaticContact CD2-CD1 3.87Å; Y202-F212 HydrophobicContact CD2-CD1 3.87Å; Y202-F212 AromaticContact CD2-CE1 3.73Å; Y202-F212 HydrophobicContact CD2-CE1 3.73Å; Y202-F212 HydrophobicContact CE2-CD1 4.41Å; V205-F212 HydrophobicContact CB-CD1 4Å; V205-F212 HydrophobicContact CG1-CB 3.59Å; V205-F212 HydrophobicContact CG1-CD1 3.7Å; V205-F212 HydrophobicContact CG1-CG 3.81Å; K206-F212 WeakPolarHBondContact CD-O 3.48Å; K206-F212 WeakPolarHBondContact CE-O 3.37Å; K206-F212 HydrophobicContact CG-CB 4.24Å; K206-F212 PolarHBondContact NZ-O 3.06Å; Q210-F212 VanDerWaalsContact C-N 3.31Å; Q210-F212 PolarHBondContact O-N 3.37Å; F212-M214 HydrophobicContact CE1-CG 3.87Å; F212-M214 HydrophobicContact CE1-SD 3.93Å; F212-M214 HydrophobicContact CE2-CG 4.08Å; F212-M214 HydrophobicContact CZ-CG 3.44Å; F212-M214 VanDerWaalsContact CZ-CG 3.44Å; F212-M214 HydrophobicContact CZ-SD 3.83Å; F212-L263 HydrophobicContact CE2-CD1 3.8Å; F212-F288 HydrophobicContact CB-CZ 4.12Å; F212-F288 HydrophobicContact CD1-CE2 4.5Å; F212-F288 AromaticContact CD2-CE2 3.9Å; F212-F288 HydrophobicContact CD2-CE2 3.9Å; F212-F288 AromaticContact CD2-CZ 3.78Å; F212-F288 HydrophobicContact CD2-CZ 3.78Å; F212-F288 HydrophobicContact CE2-CE2 4.07Å; F212-F288 HydrophobicContact CE2-CZ 4.38Å; F212-F288 HydrophobicContact CG-CE2 4.14Å; F212-F288 AromaticContact CG-CZ 3.97Å; F212-F288 HydrophobicContact CG-CZ 3.97Å; F212-F288 HydrophobicContact CZ-CE2 4.43Å
213	E	97.6	Very high	96.7	Very high	10 Å²	10	53.6 Å²	53.6	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.8	171.2	-168.2	54.8	-83.3	0	0	110.9	L174 H177 Y178 V179 G180 Y202 K206 L236	L174-E213 HydrophobicContact CD2-CB 3.95Å; L174-E213 HydrophobicContact CD2-CG 3.7Å; H177-E213 HydrophobicContact CB-CB 4.44Å; Y178-E213 PolarHBondContact O-N 2.93Å; V179-E213 CarbonylContact C-O 3.45Å; V179-E213 VanDerWaalsContact CA-O 3.3Å; V179-E213 WeakPolarHBondContact CA-O 3.39Å; G180-E213 PolarHBondContact N-O 3.01Å; Y202-E213 VanDerWaalsContact CE2-OE1 3.3Å; Y202-E213 WeakPolarHBondContact CE2-OE1 3.37Å; Y202-E213 VanDerWaalsContact OH-CD 3.3Å; Y202-E213 PolarHBondContact OH-OE1 3.38Å; Y202-E213 PolarHBondContact OH-OE2 3.34Å; K206-E213 IonicContact NZ-OE2 3.93Å; K206-E213 PolarHBondContact NZ-OE2 3.13Å; E213-L236 HydrophobicContact CG-CD1 3.96Å; E213-L236 HydrophobicContact CG-CG 4.11Å
214	M	98.1	Very high	96.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	146.6	176.9	-71.9	175.4	64.2	0	0	111.3	G180 Y182 L198 Y202 F212 W235 L236 L261	G180-M214 CarbonylContact O-C 3.5Å; G180-M214 VanDerWaalsContact O-CA 3.22Å; G180-M214 WeakPolarHBondContact O-CA 3.3Å; G180-M214 WeakPolarHBondContact O-CB 3.31Å; Y182-M214 HydrophobicContact CD1-CE 4.45Å; Y182-M214 HydrophobicContact CG-CE 4.34Å; L198-M214 HydrophobicContact CB-CE 4.3Å; L198-M214 HydrophobicContact CD1-CE 4Å; L198-M214 HydrophobicContact CD2-CE 4.26Å; L198-M214 HydrophobicContact CG-CE 4.42Å; Y202-M214 HydrophobicContact CD2-CB 4.39Å; Y202-M214 HydrophobicContact CD2-CG 3.91Å; Y202-M214 HydrophobicContact CD2-SD 3.7Å; Y202-M214 HydrophobicContact CE2-CB 4.32Å; Y202-M214 HydrophobicContact CE2-CG 4.23Å; Y202-M214 HydrophobicContact CG-SD 4.39Å; F212-M214 HydrophobicContact CE1-CG 3.87Å; F212-M214 HydrophobicContact CE1-SD 3.93Å; F212-M214 HydrophobicContact CE2-CG 4.08Å; F212-M214 HydrophobicContact CZ-CG 3.44Å; F212-M214 VanDerWaalsContact CZ-CG 3.44Å; F212-M214 HydrophobicContact CZ-SD 3.83Å; M214-W235 HydrophobicContact CB-CB 3.62Å; M214-W235 HydrophobicContact CB-CD2 3.87Å; M214-W235 HydrophobicContact CB-CE3 4.27Å; M214-W235 HydrophobicContact CB-CG 3.58Å; M214-W235 HydrophobicContact CE-CD2 4.02Å; M214-W235 HydrophobicContact CE-CE3 4.02Å; M214-W235 HydrophobicContact CE-CH2 4Å; M214-W235 HydrophobicContact CE-CZ2 3.98Å; M214-W235 HydrophobicContact CE-CZ3 4Å; M214-W235 WeakPolarHBondContact O-CB 3.38Å; M214-W235 HydrophobicContact SD-CD2 4.01Å; M214-W235 HydrophobicContact SD-CE3 3.59Å; M214-W235 VanDerWaalsContact SD-CE3 3.59Å; M214-W235 HydrophobicContact SD-CH2 4.41Å; M214-W235 HydrophobicContact SD-CZ3 3.81Å; M214-L236 WeakPolarHBondContact O-CB 3.5Å; M214-L236 PolarHBondContact O-N 2.81Å; M214-L261 HydrophobicContact CE-CD1 4.23Å
215	V	98.4	Very high	96.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	109.9	175.1	-177.9	0	0	0	0	108.7	V157 L161 L174 V179 G180 V181 Y182 L236 V238	V157-V215 HydrophobicContact CG2-CG1 4.4Å; L161-V215 HydrophobicContact CD1-CG2 4.34Å; L161-V215 HydrophobicContact CD2-CG1 4.22Å; L174-V215 HydrophobicContact CD1-CG2 3.78Å; L174-V215 HydrophobicContact CD2-CG2 3.99Å; V179-V215 HydrophobicContact CG1-CG2 4Å; G180-V215 PolarHBondContact O-N 3.21Å; V181-V215 WeakPolarHBondContact CA-O 3.18Å; Y182-V215 PolarHBondContact N-O 2.93Å; V215-L236 CarbonylContact C-O 3.55Å; V215-L236 WeakPolarHBondContact CA-O 3.42Å; V215-V238 HydrophobicContact CG1-CG2 3.92Å
216	F	98.6	Very high	96.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.3	174.3	174.6	-133.7	0	0	0	110.9	Y182 S184 F226 Y229 F230 M233 L236 A237 V238	Y182-F216 HydrophobicContact CD1-CD2 4.09Å; Y182-F216 WeakPolarHBondContact O-CD2 3.44Å; S184-F216 WeakPolarHBondContact O-CE2 3.29Å; F216-F226 HydrophobicContact CD1-CD2 4.33Å; F216-F226 AromaticContact CD1-CE2 3.81Å; F216-F226 HydrophobicContact CD1-CE2 3.81Å; F216-F226 AromaticContact CE1-CD2 3.65Å; F216-F226 HydrophobicContact CE1-CD2 3.65Å; F216-F226 AromaticContact CE1-CE2 3.61Å; F216-F226 HydrophobicContact CE1-CE2 3.61Å; F216-F226 HydrophobicContact CZ-CD2 4.48Å; F216-Y229 HydrophobicContact CE2-CE1 4.44Å; F216-Y229 AromaticContact CZ-CD1 3.94Å; F216-Y229 HydrophobicContact CZ-CD1 3.94Å; F216-Y229 HydrophobicContact CZ-CE1 4.18Å; F216-F230 HydrophobicContact CD1-CB 4.34Å; F216-F230 AromaticContact CD1-CD2 3.89Å; F216-F230 HydrophobicContact CD1-CD2 3.89Å; F216-F230 HydrophobicContact CD1-CG 4.4Å; F216-F230 HydrophobicContact CE1-CB 4.28Å; F216-M233 HydrophobicContact CB-SD 4.23Å; F216-M233 HydrophobicContact CD1-CE 4.45Å; F216-M233 HydrophobicContact CD1-SD 3.9Å; F216-M233 HydrophobicContact CD2-CE 4.47Å; F216-M233 HydrophobicContact CD2-SD 4.25Å; F216-M233 HydrophobicContact CE1-CE 4.28Å; F216-M233 HydrophobicContact CE1-SD 4.3Å; F216-M233 HydrophobicContact CE2-CE 4.35Å; F216-M233 HydrophobicContact CG-SD 3.87Å; F216-M233 HydrophobicContact CZ-CE 4.24Å; F216-L236 WeakPolarHBondContact CB-O 3.16Å; F216-L236 PolarHBondContact N-O 3.28Å; F216-A237 HydrophobicContact CB-CB 4Å; F216-A237 HydrophobicContact CD1-CB 4.02Å; F216-A237 HydrophobicContact CG-CB 4.47Å; F216-A237 WeakPolarHBondContact O-CA 3.39Å; F216-V238 PolarHBondContact O-N 3.42Å
217	V	98.4	Very high	96.6	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	101.8	173.4	-173	0	0	0	0	107.9	V181 Y182 F183 S184 V238 R246 L249	V181-V217 HydrophobicContact CG1-CG2 3.74Å; Y182-V217 PolarHBondContact O-N 3.36Å; F183-V217 WeakPolarHBondContact CA-O 3.43Å; F183-V217 HydrophobicContact CD1-CB 3.7Å; F183-V217 HydrophobicContact CD1-CG1 3.76Å; F183-V217 HydrophobicContact CD1-CG2 4.42Å; F183-V217 HydrophobicContact CE1-CB 3.72Å; F183-V217 HydrophobicContact CE1-CG1 3.57Å; F183-V217 HydrophobicContact CE1-CG2 4.04Å; F183-V217 HydrophobicContact CG-CB 4.33Å; F183-V217 HydrophobicContact CZ-CB 4.34Å; F183-V217 HydrophobicContact CZ-CG1 4.48Å; F183-V217 HydrophobicContact CZ-CG2 4.19Å; S184-V217 PolarHBondContact N-O 2.87Å; V217-V238 HydrophobicContact CG2-CG2 4.19Å; V217-R246 HydrophobicContact CG1-CB 3.96Å; V217-R246 HydrophobicContact CG1-CG 4.02Å; V217-L249 HydrophobicContact CG2-CD1 3.75Å
218	S	97.8	Very high	96.6	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.7	-174.3	176.8	0	0	0	0	113	D220 R246	S218-D220 WeakPolarHBondContact OG-CB 3.44Å; S218-D220 PolarHBondContact OG-N 2.98Å; S218-D220 PolarHBondContact OG-OD2 2.74Å; S218-R246 PolarHBondContact O-NH1 2.82Å
219	A	96.5	Very high	96.7	Very high	40 Å²	40	46.8 Å²	46.8	33%	0.331	24%	0.241	S	C	.	.			trans	-107.6	20.9	164.8	0	0	0	0	0	111.6	S184 A185 W187 I258	S184-A219 PolarHBondContact O-N 2.94Å; A185-A219 HydrophobicContact CB-CB 4.12Å; W187-A219 PolarHBondContact NE1-O 3.23Å; W187-A219 VanDerWaalsContact NE1-O 3.08Å; A219-I258 HydrophobicContact CB-CD1 4.15Å; A219-I258 HydrophobicContact CB-CG2 4.38Å
220	D	96.8	Very high	96.8	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.043	22%	0.215	C	C	.	.			trans	-63.7	157.4	172	-69.9	-70.2	0	0	0	111.3	H186 S218 F226 Y240	H186-D220 VanDerWaalsContact CB-OD1 3.27Å; H186-D220 WeakPolarHBondContact CB-OD1 3.5Å; H186-D220 PolarHBondContact N-OD1 3.16Å; S218-D220 WeakPolarHBondContact OG-CB 3.44Å; S218-D220 PolarHBondContact OG-N 2.98Å; S218-D220 PolarHBondContact OG-OD2 2.74Å; D220-F226 HydrophobicContact CB-CB 4.26Å; D220-Y240 HydrophobicContact CB-CE2 4.23Å; D220-Y240 WeakPolarHBondContact O-CE2 3.26Å; D220-Y240 PolarHBondContact O-OH 3.21Å
221	R	94.9	Very high	96.9	Very high	196 Å²	196	44.3 Å²	44.3	74%	0.74	22%	0.222	S	C	*	.	S	Bend	trans	-97.6	-5.6	-176	-61	178.1	-176.5	174	0.4	113.1	Y240	R221-Y240 PolarHBondContact O-OH 2.78Å
222	S	96.7	Very high	96.8	Very high	34 Å²	34	43.6 Å²	43.6	24%	0.238	22%	0.219	C	C	.	.	S	Bend	trans	-149.5	154.2	175.5	90.8	0	0	0	0	110.9	E224 S225 F226 Y240	S222-E224 VanDerWaalsContact C-N 3.26Å; S222-E224 WeakPolarHBondContact CB-OE2 3.41Å; S222-E224 PolarHBondContact O-N 3.34Å; S222-E224 PolarHBondContact OG-N 2.86Å; S222-E224 PolarHBondContact OG-OE2 3.37Å; S222-S225 PolarHBondContact O-N 3.06Å; S222-S225 PolarHBondContact OG-N 3.33Å; S222-S225 PolarHBondContact OG-OG 3.31Å; S222-S225 VanDerWaalsContact OG-OG 3.09Å; S222-F226 PolarHBondContact O-N 3.17Å; S222-Y240 VanDerWaalsContact C-CZ 3.44Å; S222-Y240 VanDerWaalsContact CA-OH 3.29Å; S222-Y240 WeakPolarHBondContact CA-OH 3.35Å; S222-Y240 PolarHBondContact N-OH 2.85Å; S222-Y240 VanDerWaalsContact N-OH 3.11Å
223	E	96.4	Very high	96.8	Very high	56 Å²	56	43.4 Å²	43.4	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-36.4	176.4	178.1	73.4	-137.2	0	0	111	F226 Q227 Y240	E223-F226 WeakPolarHBondContact O-CB 3.08Å; E223-F226 PolarHBondContact O-N 3.42Å; E223-Q227 HydrophobicContact CG-CG 4.48Å; E223-Q227 WeakPolarHBondContact O-CB 3.29Å; E223-Q227 VanDerWaalsContact O-CG 3.29Å; E223-Q227 WeakPolarHBondContact O-CG 3.13Å; E223-Q227 PolarHBondContact O-N 3.45Å; E223-Q227 PolarHBondContact OE1-NE2 2.79Å; E223-Y240 HydrophobicContact CB-CD1 3.84Å; E223-Y240 HydrophobicContact CB-CE1 4.05Å; E223-Y240 HydrophobicContact CG-CD1 4.45Å; E223-Y240 VanDerWaalsContact OE2-CB 3.29Å; E223-Y240 WeakPolarHBondContact OE2-CB 3.23Å; E223-Y240 WeakPolarHBondContact OE2-CD1 3.33Å
224	E	96.6	Very high	96.7	Very high	131 Å²	131	45.1 Å²	45.1	61%	0.612	23%	0.23	S	C	*	.	H	α-helix	trans	-65.5	-42.9	178.7	-55.2	74.2	-160.8	0	0	111.3	S222 F226 Q227 Q228	S222-E224 VanDerWaalsContact C-N 3.26Å; S222-E224 WeakPolarHBondContact CB-OE2 3.41Å; S222-E224 PolarHBondContact O-N 3.34Å; S222-E224 PolarHBondContact OG-N 2.86Å; S222-E224 PolarHBondContact OG-OE2 3.37Å; E224-F226 VanDerWaalsContact C-N 3.32Å; E224-Q227 PolarHBondContact O-N 3.09Å; E224-Q228 WeakPolarHBondContact O-CB 3.48Å; E224-Q228 PolarHBondContact O-N 3.22Å
225	S	96.1	Very high	96.6	Very high	38 Å²	38	45.1 Å²	45.1	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-64.1	-41.3	176.7	-58.3	0	0	0	0	110.9	S222 Y229	S222-S225 PolarHBondContact O-N 3.06Å; S222-S225 PolarHBondContact OG-N 3.33Å; S222-S225 PolarHBondContact OG-OG 3.31Å; S222-S225 VanDerWaalsContact OG-OG 3.09Å; S225-Y229 WeakPolarHBondContact O-CB 3.02Å; S225-Y229 PolarHBondContact O-N 3.44Å; S225-Y229 VanDerWaalsContact O-N 3.14Å
226	F	97.4	Very high	96.6	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-52.2	173	164.1	-105.7	0	0	0	111.7	L162 F216 D220 S222 E223 E224 Q228 Y229 F230 A237 Y240	L162-F226 HydrophobicContact CD1-CE1 4.09Å; L162-F226 HydrophobicContact CD1-CZ 4.14Å; F216-F226 HydrophobicContact CD1-CD2 4.33Å; F216-F226 AromaticContact CD1-CE2 3.81Å; F216-F226 HydrophobicContact CD1-CE2 3.81Å; F216-F226 AromaticContact CE1-CD2 3.65Å; F216-F226 HydrophobicContact CE1-CD2 3.65Å; F216-F226 AromaticContact CE1-CE2 3.61Å; F216-F226 HydrophobicContact CE1-CE2 3.61Å; F216-F226 HydrophobicContact CZ-CD2 4.48Å; D220-F226 HydrophobicContact CB-CB 4.26Å; S222-F226 PolarHBondContact O-N 3.17Å; E223-F226 WeakPolarHBondContact O-CB 3.08Å; E223-F226 PolarHBondContact O-N 3.42Å; E224-F226 VanDerWaalsContact C-N 3.32Å; F226-Q228 PolarHBondContact O-N 3.2Å; F226-Y229 PolarHBondContact O-N 2.89Å; F226-F230 HydrophobicContact CD2-CB 4.4Å; F226-F230 HydrophobicContact CE1-CD1 4.47Å; F226-F230 HydrophobicContact CE2-CB 4.12Å; F226-F230 HydrophobicContact CE2-CG 4.31Å; F226-F230 HydrophobicContact CZ-CB 4.29Å; F226-F230 HydrophobicContact CZ-CD1 4.06Å; F226-F230 HydrophobicContact CZ-CG 4.2Å; F226-F230 WeakPolarHBondContact O-CB 3.3Å; F226-F230 PolarHBondContact O-N 2.88Å; F226-A237 HydrophobicContact CE2-CB 4.09Å; F226-A237 HydrophobicContact CZ-CB 3.97Å; F226-Y240 HydrophobicContact CB-CD2 3.58Å; F226-Y240 HydrophobicContact CB-CE2 4.26Å; F226-Y240 HydrophobicContact CB-CG 4.06Å; F226-Y240 VanDerWaalsContact CD1-CB 3.48Å; F226-Y240 HydrophobicContact CD1-CD2 4.49Å; F226-Y240 HydrophobicContact CD1-CG 4.25Å; F226-Y240 HydrophobicContact CD2-CD2 4.37Å; F226-Y240 AromaticContact CG-CD2 3.91Å; F226-Y240 HydrophobicContact CG-CD2 3.91Å; F226-Y240 HydrophobicContact CG-CG 4.13Å
227	Q	96.1	Very high	96.6	Very high	89 Å²	89	45.1 Å²	45.1	42%	0.416	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-42.1	-177.5	-73.8	176.6	11.7	0	0	112.1	E223 E224 S231	E223-Q227 HydrophobicContact CG-CG 4.48Å; E223-Q227 WeakPolarHBondContact O-CB 3.29Å; E223-Q227 VanDerWaalsContact O-CG 3.29Å; E223-Q227 WeakPolarHBondContact O-CG 3.13Å; E223-Q227 PolarHBondContact O-N 3.45Å; E223-Q227 PolarHBondContact OE1-NE2 2.79Å; E224-Q227 PolarHBondContact O-N 3.09Å; Q227-S231 WeakPolarHBondContact O-CB 3.37Å; Q227-S231 PolarHBondContact O-N 3.32Å
228	Q	95.5	Very high	96.6	Very high	110 Å²	110	45 Å²	45	51%	0.514	23%	0.229	S	C	.	.	H	α-helix	trans	-58.1	-52.3	176.6	179.7	177.6	-8.2	0	0	110.7	E224 F226 S231	E224-Q228 WeakPolarHBondContact O-CB 3.48Å; E224-Q228 PolarHBondContact O-N 3.22Å; F226-Q228 PolarHBondContact O-N 3.2Å; Q228-S231 WeakPolarHBondContact O-CB 3.42Å; Q228-S231 PolarHBondContact O-N 3.28Å; Q228-S231 PolarHBondContact O-OG 3.49Å
229	Y	96.8	Very high	96.5	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-72.2	-39.9	-175.6	-175.1	-148.3	0	0	0	113	Y182 S184 A185 H186 C191 R192 T195 F216 S225 F226 S231 E232 M233	Y182-Y229 PolarHBondContact OH-OH 3.47Å; S184-Y229 WeakPolarHBondContact OG-CE1 3.49Å; S184-Y229 PolarHBondContact OG-OH 3.2Å; A185-Y229 VanDerWaalsContact C-CE1 3.45Å; H186-Y229 HydrophobicContact CB-CD1 3.89Å; H186-Y229 HydrophobicContact CB-CG 3.83Å; H186-Y229 AromaticContact CD2-CD2 3.9Å; H186-Y229 AromaticContact CD2-CG 3.96Å; H186-Y229 VanDerWaalsContact N-CD1 3.35Å; C191-Y229 PolarHBondContact O-OH 2.82Å; R192-Y229 HydrophobicContact CG-CE2 4.42Å; T195-Y229 HydrophobicContact CG2-CE2 4.12Å; T195-Y229 PolarHBondContact OG1-OH 3.17Å; F216-Y229 HydrophobicContact CE2-CE1 4.44Å; F216-Y229 AromaticContact CZ-CD1 3.94Å; F216-Y229 HydrophobicContact CZ-CD1 3.94Å; F216-Y229 HydrophobicContact CZ-CE1 4.18Å; S225-Y229 WeakPolarHBondContact O-CB 3.02Å; S225-Y229 PolarHBondContact O-N 3.44Å; S225-Y229 VanDerWaalsContact O-N 3.14Å; F226-Y229 PolarHBondContact O-N 2.89Å; Y229-S231 PolarHBondContact O-N 2.76Å; Y229-E232 WeakPolarHBondContact O-CB 3.45Å; Y229-E232 PolarHBondContact O-N 2.74Å; Y229-M233 HydrophobicContact CD1-CE 3.58Å; Y229-M233 HydrophobicContact CD2-CE 3.61Å; Y229-M233 HydrophobicContact CE1-CE 3.41Å; Y229-M233 VanDerWaalsContact CE1-CE 3.41Å; Y229-M233 HydrophobicContact CE2-CE 3.43Å; Y229-M233 VanDerWaalsContact CE2-CE 3.43Å; Y229-M233 HydrophobicContact CG-CE 3.69Å
230	F	97.3	Very high	96.5	Very high	11 Å²	11	45 Å²	45	5%	0.048	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-26.5	176.9	-179	-126.8	0	0	0	112.5	L162 R163 N164 F216 F226 E232 M233 W235 A237	L162-F230 HydrophobicContact CB-CE1 3.95Å; L162-F230 HydrophobicContact CB-CZ 4.32Å; L162-F230 WeakPolarHBondContact O-CZ 3.47Å; R163-F230 VanDerWaalsContact C-CE1 3.47Å; N164-F230 HydrophobicContact CB-CE1 4.19Å; N164-F230 HydrophobicContact CB-CZ 4.2Å; F216-F230 HydrophobicContact CD1-CB 4.34Å; F216-F230 AromaticContact CD1-CD2 3.89Å; F216-F230 HydrophobicContact CD1-CD2 3.89Å; F216-F230 HydrophobicContact CD1-CG 4.4Å; F216-F230 HydrophobicContact CE1-CB 4.28Å; F226-F230 HydrophobicContact CD2-CB 4.4Å; F226-F230 HydrophobicContact CE1-CD1 4.47Å; F226-F230 HydrophobicContact CE2-CB 4.12Å; F226-F230 HydrophobicContact CE2-CG 4.31Å; F226-F230 HydrophobicContact CZ-CB 4.29Å; F226-F230 HydrophobicContact CZ-CD1 4.06Å; F226-F230 HydrophobicContact CZ-CG 4.2Å; F226-F230 WeakPolarHBondContact O-CB 3.3Å; F226-F230 PolarHBondContact O-N 2.88Å; F230-E232 PolarHBondContact O-N 2.93Å; F230-E232 VanDerWaalsContact O-N 3.14Å; F230-M233 HydrophobicContact CD2-CB 4.11Å; F230-M233 HydrophobicContact CD2-SD 4.29Å; F230-M233 HydrophobicContact CE2-CB 4.43Å; F230-M233 PolarHBondContact O-N 3.14Å; F230-W235 VanDerWaalsContact CE2-O 3.31Å; F230-W235 WeakPolarHBondContact CE2-O 3.12Å; F230-A237 HydrophobicContact CD1-CB 4.34Å; F230-A237 HydrophobicContact CD2-CB 3.77Å; F230-A237 HydrophobicContact CE1-CB 4.01Å; F230-A237 HydrophobicContact CE2-CB 3.42Å; F230-A237 VanDerWaalsContact CE2-CB 3.42Å; F230-A237 HydrophobicContact CG-CB 4.23Å; F230-A237 HydrophobicContact CZ-CB 3.55Å
231	S	95.9	Very high	96.5	Very high	74 Å²	74	49.2 Å²	49.2	52%	0.517	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22	175.7	78	0	0	0	0	113.7	Q227 Q228 Y229 M233	Q227-S231 WeakPolarHBondContact O-CB 3.37Å; Q227-S231 PolarHBondContact O-N 3.32Å; Q228-S231 WeakPolarHBondContact O-CB 3.42Å; Q228-S231 PolarHBondContact O-N 3.28Å; Q228-S231 PolarHBondContact O-OG 3.49Å; Y229-S231 PolarHBondContact O-N 2.76Å; S231-M233 VanDerWaalsContact C-N 3.35Å
232	E	94.3	Very high	96.6	Very high	104 Å²	104	42 Å²	42	49%	0.486	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.6	177.8	-58	178.3	-164.8	0	0	112.9	Y229 F230	Y229-E232 WeakPolarHBondContact O-CB 3.45Å; Y229-E232 PolarHBondContact O-N 2.74Å; F230-E232 PolarHBondContact O-N 2.93Å; F230-E232 VanDerWaalsContact O-N 3.14Å
233	M	96.4	Very high	96.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.			trans	-105.9	131.3	-169.9	-59.5	-179	-166.9	0	0	111.8	N164 Y182 T195 F216 Y229 F230 S231 W235	N164-M233 WeakPolarHBondContact CB-O 3.25Å; N164-M233 PolarHBondContact ND2-O 3.15Å; Y182-M233 HydrophobicContact CE1-CE 4.4Å; T195-M233 HydrophobicContact CG2-CE 4.23Å; T195-M233 HydrophobicContact CG2-CG 4.41Å; F216-M233 HydrophobicContact CB-SD 4.23Å; F216-M233 HydrophobicContact CD1-CE 4.45Å; F216-M233 HydrophobicContact CD1-SD 3.9Å; F216-M233 HydrophobicContact CD2-CE 4.47Å; F216-M233 HydrophobicContact CD2-SD 4.25Å; F216-M233 HydrophobicContact CE1-CE 4.28Å; F216-M233 HydrophobicContact CE1-SD 4.3Å; F216-M233 HydrophobicContact CE2-CE 4.35Å; F216-M233 HydrophobicContact CG-SD 3.87Å; F216-M233 HydrophobicContact CZ-CE 4.24Å; Y229-M233 HydrophobicContact CD1-CE 3.58Å; Y229-M233 HydrophobicContact CD2-CE 3.61Å; Y229-M233 HydrophobicContact CE1-CE 3.41Å; Y229-M233 VanDerWaalsContact CE1-CE 3.41Å; Y229-M233 HydrophobicContact CE2-CE 3.43Å; Y229-M233 VanDerWaalsContact CE2-CE 3.43Å; Y229-M233 HydrophobicContact CG-CE 3.69Å; F230-M233 HydrophobicContact CD2-CB 4.11Å; F230-M233 HydrophobicContact CD2-SD 4.29Å; F230-M233 HydrophobicContact CE2-CB 4.43Å; F230-M233 PolarHBondContact O-N 3.14Å; S231-M233 VanDerWaalsContact C-N 3.35Å; M233-W235 VanDerWaalsContact C-N 3.34Å; M233-W235 HydrophobicContact CB-CD2 4.2Å; M233-W235 HydrophobicContact CB-CG 4.44Å; M233-W235 HydrophobicContact CB-CZ2 3.96Å; M233-W235 HydrophobicContact CG-CZ2 3.69Å; M233-W235 HydrophobicContact SD-CZ2 3.74Å; M233-W235 PolarHBondContact SD-NE1 3.3Å
234	P	96.3	Very high	96.2	Very high	46 Å²	46	46.1 Å²	46.1	30%	0.299	25%	0.253	S	S	.	.	S	Bend	trans	-83.2	-9.4	-178.6	33.6	-37.4	0	0	0	113.9	L199 Y202	L199-P234 HydrophobicContact CD2-CG 3.92Å; Y202-P234 HydrophobicContact CD1-CG 3.82Å; Y202-P234 HydrophobicContact CE1-CB 4.25Å; Y202-P234 HydrophobicContact CE1-CG 3.87Å
235	W	96.6	Very high	96.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-96	-173.8	-174	53.3	66.4	0	0	0	112.8	Y182 L198 L199 Y202 M214 F230 M233	Y182-W235 HydrophobicContact CD1-CZ2 4.07Å; Y182-W235 HydrophobicContact CE1-CZ2 4.29Å; L198-W235 HydrophobicContact CB-CH2 3.72Å; L198-W235 HydrophobicContact CB-CZ3 4.13Å; L199-W235 HydrophobicContact CD2-CH2 4.15Å; L199-W235 HydrophobicContact CD2-CZ3 4.05Å; L199-W235 HydrophobicContact CG-CH2 4.39Å; Y202-W235 HydrophobicContact CD1-CE3 4.37Å; Y202-W235 AromaticContact CD2-CE3 3.92Å; Y202-W235 HydrophobicContact CD2-CE3 3.92Å; Y202-W235 HydrophobicContact CE2-CB 4Å; Y202-W235 HydrophobicContact CE2-CE3 4.37Å; Y202-W235 AromaticContact CG-CE3 3.9Å; Y202-W235 HydrophobicContact CG-CE3 3.9Å; Y202-W235 HydrophobicContact CG-CZ3 4.31Å; M214-W235 HydrophobicContact CB-CB 3.62Å; M214-W235 HydrophobicContact CB-CD2 3.87Å; M214-W235 HydrophobicContact CB-CE3 4.27Å; M214-W235 HydrophobicContact CB-CG 3.58Å; M214-W235 HydrophobicContact CE-CD2 4.02Å; M214-W235 HydrophobicContact CE-CE3 4.02Å; M214-W235 HydrophobicContact CE-CH2 4Å; M214-W235 HydrophobicContact CE-CZ2 3.98Å; M214-W235 HydrophobicContact CE-CZ3 4Å; M214-W235 WeakPolarHBondContact O-CB 3.38Å; M214-W235 HydrophobicContact SD-CD2 4.01Å; M214-W235 HydrophobicContact SD-CE3 3.59Å; M214-W235 VanDerWaalsContact SD-CE3 3.59Å; M214-W235 HydrophobicContact SD-CH2 4.41Å; M214-W235 HydrophobicContact SD-CZ3 3.81Å; F230-W235 VanDerWaalsContact CE2-O 3.31Å; F230-W235 WeakPolarHBondContact CE2-O 3.12Å; M233-W235 VanDerWaalsContact C-N 3.34Å; M233-W235 HydrophobicContact CB-CD2 4.2Å; M233-W235 HydrophobicContact CB-CG 4.44Å; M233-W235 HydrophobicContact CB-CZ2 3.96Å; M233-W235 HydrophobicContact CG-CZ2 3.69Å; M233-W235 HydrophobicContact SD-CZ2 3.74Å; M233-W235 PolarHBondContact SD-NE1 3.3Å
236	L	97.9	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	161.1	-175.7	-55.5	-178.4	0	0	0	112.3	L161 L162 R163 T169 L174 E213 M214 V215 F216	L161-L236 HydrophobicContact CB-CB 4.31Å; L161-L236 HydrophobicContact CB-CD1 4.32Å; L161-L236 HydrophobicContact CD1-CB 4.44Å; L161-L236 HydrophobicContact CD1-CD1 3.77Å; L162-L236 CarbonylContact O-C 3.23Å; L162-L236 WeakPolarHBondContact O-CA 3.36Å; R163-L236 HydrophobicContact CG-CD2 3.57Å; T169-L236 HydrophobicContact CG2-CD1 3.78Å; T169-L236 HydrophobicContact CG2-CD2 3.7Å; T169-L236 HydrophobicContact CG2-CG 4.4Å; L174-L236 HydrophobicContact CD2-CD1 3.94Å; E213-L236 HydrophobicContact CG-CD1 3.96Å; E213-L236 HydrophobicContact CG-CG 4.11Å; M214-L236 WeakPolarHBondContact O-CB 3.5Å; M214-L236 PolarHBondContact O-N 2.81Å; V215-L236 CarbonylContact C-O 3.55Å; V215-L236 WeakPolarHBondContact CA-O 3.42Å; F216-L236 WeakPolarHBondContact CB-O 3.16Å; F216-L236 PolarHBondContact N-O 3.28Å
237	A	98.1	Very high	95.9	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.1	171.1	0	0	0	0	0	112.8	L161 L162 F216 F226 F230	L161-A237 CarbonylContact C-O 3.57Å; L161-A237 WeakPolarHBondContact CA-O 3.43Å; L162-A237 HydrophobicContact CB-CB 4.47Å; L162-A237 PolarHBondContact N-O 3.19Å; L162-A237 PolarHBondContact O-N 3.48Å; F216-A237 HydrophobicContact CB-CB 4Å; F216-A237 HydrophobicContact CD1-CB 4.02Å; F216-A237 HydrophobicContact CG-CB 4.47Å; F216-A237 WeakPolarHBondContact O-CA 3.39Å; F226-A237 HydrophobicContact CE2-CB 4.09Å; F226-A237 HydrophobicContact CZ-CB 3.97Å; F230-A237 HydrophobicContact CD1-CB 4.34Å; F230-A237 HydrophobicContact CD2-CB 3.77Å; F230-A237 HydrophobicContact CE1-CB 4.01Å; F230-A237 HydrophobicContact CE2-CB 3.42Å; F230-A237 VanDerWaalsContact CE2-CB 3.42Å; F230-A237 HydrophobicContact CG-CB 4.23Å; F230-A237 HydrophobicContact CZ-CB 3.55Å
238	V	98.1	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.			trans	-70.5	130.5	162.3	-179.1	0	0	0	0	108.1	L161 V215 F216 V217 Y240 D242 R245 R246 L249	L161-V238 HydrophobicContact CD2-CG2 4.18Å; V215-V238 HydrophobicContact CG1-CG2 3.92Å; F216-V238 PolarHBondContact O-N 3.42Å; V217-V238 HydrophobicContact CG2-CG2 4.19Å; V238-Y240 PolarHBondContact O-N 3.44Å; V238-D242 HydrophobicContact CG1-CB 4.43Å; V238-R245 HydrophobicContact CG1-CB 4.24Å; V238-R245 HydrophobicContact CG1-CG 4.01Å; V238-R246 HydrophobicContact CB-CG 4.09Å; V238-R246 HydrophobicContact CG1-CG 3.63Å; V238-L249 HydrophobicContact CG2-CD1 3.65Å
239	P	96.9	Very high	95.6	Very high	15 Å²	15	33.8 Å²	33.8	10%	0.097	19%	0.188	C	C	.	.			trans	-48.6	132	173.8	-25.1	30.5	0	0	0	112.2	P160 L162 S241 D242 R245	P160-P239 VanDerWaalsContact O-CD 3.31Å; P160-P239 WeakPolarHBondContact O-CD 3.3Å; L162-P239 HydrophobicContact CD1-CB 4.14Å; L162-P239 HydrophobicContact CD1-CG 4.31Å; L162-P239 HydrophobicContact CD2-CG 4.3Å; L162-P239 HydrophobicContact CG-CB 4.35Å; L162-P239 HydrophobicContact CG-CG 3.97Å; P239-S241 VanDerWaalsContact C-N 3.27Å; P239-S241 PolarHBondContact O-N 2.85Å; P239-D242 HydrophobicContact CB-CB 4.31Å; P239-D242 WeakPolarHBondContact O-CB 3.42Å; P239-D242 PolarHBondContact O-N 3.06Å; P239-R245 VanDerWaalsContact CD-NH2 3.32Å
240	Y	96.5	Very high	95.5	Very high	29 Å²	29	35.6 Å²	35.6	11%	0.114	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-38.1	-178.2	175.8	-84.8	0	0	0	112.2	D220 R221 S222 E223 F226 V238 D242 R246	D220-Y240 HydrophobicContact CB-CE2 4.23Å; D220-Y240 WeakPolarHBondContact O-CE2 3.26Å; D220-Y240 PolarHBondContact O-OH 3.21Å; R221-Y240 PolarHBondContact O-OH 2.78Å; S222-Y240 VanDerWaalsContact C-CZ 3.44Å; S222-Y240 VanDerWaalsContact CA-OH 3.29Å; S222-Y240 WeakPolarHBondContact CA-OH 3.35Å; S222-Y240 PolarHBondContact N-OH 2.85Å; S222-Y240 VanDerWaalsContact N-OH 3.11Å; E223-Y240 HydrophobicContact CB-CD1 3.84Å; E223-Y240 HydrophobicContact CB-CE1 4.05Å; E223-Y240 HydrophobicContact CG-CD1 4.45Å; E223-Y240 VanDerWaalsContact OE2-CB 3.29Å; E223-Y240 WeakPolarHBondContact OE2-CB 3.23Å; E223-Y240 WeakPolarHBondContact OE2-CD1 3.33Å; F226-Y240 HydrophobicContact CB-CD2 3.58Å; F226-Y240 HydrophobicContact CB-CE2 4.26Å; F226-Y240 HydrophobicContact CB-CG 4.06Å; F226-Y240 VanDerWaalsContact CD1-CB 3.48Å; F226-Y240 HydrophobicContact CD1-CD2 4.49Å; F226-Y240 HydrophobicContact CD1-CG 4.25Å; F226-Y240 HydrophobicContact CD2-CD2 4.37Å; F226-Y240 AromaticContact CG-CD2 3.91Å; F226-Y240 HydrophobicContact CG-CD2 3.91Å; F226-Y240 HydrophobicContact CG-CG 4.13Å; V238-Y240 PolarHBondContact O-N 3.44Å; Y240-D242 PolarHBondContact O-N 3.37Å; Y240-R246 PolarHBondContact O-NE 3.23Å; Y240-R246 PolarHBondContact O-NH2 3.48Å
241	S	95.8	Very high	95.2	Very high	97 Å²	97	36.5 Å²	36.5	68%	0.678	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.7	174.3	59.2	0	0	0	0	114.7	P239 E243	P239-S241 VanDerWaalsContact C-N 3.27Å; P239-S241 PolarHBondContact O-N 2.85Å; S241-E243 VanDerWaalsContact C-N 3.27Å; S241-E243 PolarHBondContact O-N 2.58Å; S241-E243 VanDerWaalsContact O-N 3.1Å
242	D	96.1	Very high	94.9	Very high	44 Å²	44	34.8 Å²	34.8	24%	0.235	19%	0.186	C	C	.	.			trans	-87.8	65.4	176.7	-164.7	-17.6	0	0	0	111.3	V238 P239 Y240 A244 R245 R246	V238-D242 HydrophobicContact CG1-CB 4.43Å; P239-D242 HydrophobicContact CB-CB 4.31Å; P239-D242 WeakPolarHBondContact O-CB 3.42Å; P239-D242 PolarHBondContact O-N 3.06Å; Y240-D242 PolarHBondContact O-N 3.37Å; D242-A244 PolarHBondContact O-N 3.01Å; D242-R245 HydrophobicContact CB-CB 4.34Å; D242-R245 PolarHBondContact O-N 3.13Å; D242-R245 WeakPolarHBondContact OD1-CB 3.49Å; D242-R245 PolarHBondContact OD1-N 3.08Å; D242-R245 WeakPolarHBondContact OD2-CB 3.46Å; D242-R245 IonicContact OD2-CZ 2.72Å; D242-R245 IonicContact OD2-NE 2.76Å; D242-R245 PolarHBondContact OD2-NE 2.93Å; D242-R245 IonicContact OD2-NH2 3.15Å; D242-R245 PolarHBondContact OD2-NH2 3.36Å; D242-R246 WeakPolarHBondContact O-CG 3.47Å; D242-R246 PolarHBondContact O-N 3.01Å; D242-R246 VanDerWaalsContact O-N 3.11Å
243	E	94.1	Very high	94.7	Very high	125 Å²	125	30.3 Å²	30.3	58%	0.584	16%	0.164	S	C	*	.	H	α-helix	trans	-59.2	-36.1	-178.6	-46.4	-161.4	141.9	0	0	112.1	S241 R246 S247	S241-E243 VanDerWaalsContact C-N 3.27Å; S241-E243 PolarHBondContact O-N 2.58Å; S241-E243 VanDerWaalsContact O-N 3.1Å; E243-R246 PolarHBondContact O-N 3.01Å; E243-R246 IonicContact OE1-NH2 2.77Å; E243-S247 WeakPolarHBondContact O-CB 3.33Å; E243-S247 PolarHBondContact O-N 2.89Å
244	A	91.7	Very high	94.3	Very high	53 Å²	53	30.8 Å²	30.8	44%	0.438	17%	0.169	S	C	.	.	H	α-helix	trans	-63.2	-47.1	-180	0	0	0	0	0	111.2	D242 S247 R248	D242-A244 PolarHBondContact O-N 3.01Å; A244-S247 PolarHBondContact O-N 3.33Å; A244-R248 WeakPolarHBondContact O-CG 3.11Å; A244-R248 PolarHBondContact O-N 2.95Å
245	R	94	Very high	94	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-42.7	177.2	-178.8	161.7	39.9	150.4	-0.6	112.3	V156 V157 A158 G159 P160 V238 P239 D242 S247 R248 L249	V156-R245 WeakPolarHBondContact O-CG 3.48Å; V157-R245 WeakPolarHBondContact O-CD 3.33Å; V157-R245 PolarHBondContact O-NH1 3.11Å; V157-R245 VanDerWaalsContact O-NH1 3.14Å; A158-R245 WeakPolarHBondContact O-CD 3.49Å; A158-R245 PolarHBondContact O-NH1 3.01Å; G159-R245 VanDerWaalsContact C-NH1 3.31Å; G159-R245 PolarHBondContact O-NH1 2.79Å; P160-R245 PolarHBondContact O-NH1 2.91Å; P160-R245 PolarHBondContact O-NH2 3.22Å; P160-R245 VanDerWaalsContact O-NH2 3.07Å; V238-R245 HydrophobicContact CG1-CB 4.24Å; V238-R245 HydrophobicContact CG1-CG 4.01Å; P239-R245 VanDerWaalsContact CD-NH2 3.32Å; D242-R245 HydrophobicContact CB-CB 4.34Å; D242-R245 PolarHBondContact O-N 3.13Å; D242-R245 WeakPolarHBondContact OD1-CB 3.49Å; D242-R245 PolarHBondContact OD1-N 3.08Å; D242-R245 WeakPolarHBondContact OD2-CB 3.46Å; D242-R245 IonicContact OD2-CZ 2.72Å; D242-R245 IonicContact OD2-NE 2.76Å; D242-R245 PolarHBondContact OD2-NE 2.93Å; D242-R245 IonicContact OD2-NH2 3.15Å; D242-R245 PolarHBondContact OD2-NH2 3.36Å; R245-S247 VanDerWaalsContact C-N 3.25Å; R245-S247 PolarHBondContact O-N 3.15Å; R245-R248 PolarHBondContact O-N 3.23Å; R245-L249 HydrophobicContact CG-CD1 4.24Å; R245-L249 WeakPolarHBondContact O-CG 3.48Å; R245-L249 PolarHBondContact O-N 3.37Å
246	R	95.9	Very high	93.2	Very high	31 Å²	31	34.4 Å²	34.4	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-41.6	174.4	-66.8	-170.7	-66	116.2	-2.3	111.3	V217 S218 V238 Y240 D242 E243 L249 N250	V217-R246 HydrophobicContact CG1-CB 3.96Å; V217-R246 HydrophobicContact CG1-CG 4.02Å; S218-R246 PolarHBondContact O-NH1 2.82Å; V238-R246 HydrophobicContact CB-CG 4.09Å; V238-R246 HydrophobicContact CG1-CG 3.63Å; Y240-R246 PolarHBondContact O-NE 3.23Å; Y240-R246 PolarHBondContact O-NH2 3.48Å; D242-R246 WeakPolarHBondContact O-CG 3.47Å; D242-R246 PolarHBondContact O-N 3.01Å; D242-R246 VanDerWaalsContact O-N 3.11Å; E243-R246 PolarHBondContact O-N 3.01Å; E243-R246 IonicContact OE1-NH2 2.77Å; R246-L249 PolarHBondContact O-N 3.36Å; R246-N250 PolarHBondContact O-N 2.87Å
247	S	92.8	Very high	92.6	Very high	9 Å²	9	36.2 Å²	36.2	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-68.1	-43.7	176.5	-160.7	0	0	0	0	112.6	R138 D139 E243 A244 R245 L249 N250 R251	R138-S247 PolarHBondContact NH2-OG 3.04Å; D139-S247 VanDerWaalsContact OD2-CB 3.23Å; D139-S247 WeakPolarHBondContact OD2-CB 3.48Å; D139-S247 PolarHBondContact OD2-OG 3.5Å; E243-S247 WeakPolarHBondContact O-CB 3.33Å; E243-S247 PolarHBondContact O-N 2.89Å; A244-S247 PolarHBondContact O-N 3.33Å; R245-S247 VanDerWaalsContact C-N 3.25Å; R245-S247 PolarHBondContact O-N 3.15Å; S247-L249 VanDerWaalsContact C-N 3.31Å; S247-L249 PolarHBondContact O-N 3.34Å; S247-N250 WeakPolarHBondContact O-CB 3.36Å; S247-N250 PolarHBondContact O-N 3.24Å; S247-N250 VanDerWaalsContact O-N 3.15Å; S247-R251 WeakPolarHBondContact O-CG 3.46Å; S247-R251 PolarHBondContact O-N 3.11Å
248	R	92.3	Very high	92.3	Very high	68 Å²	68	38.3 Å²	38.3	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-59	-40.8	175.2	-71.3	-168.6	-64.9	-86.2	-2	112.3	V156 A244 R245 R251 L252	V156-R248 HydrophobicContact CG1-CB 3.71Å; A244-R248 WeakPolarHBondContact O-CG 3.11Å; A244-R248 PolarHBondContact O-N 2.95Å; R245-R248 PolarHBondContact O-N 3.23Å; R248-R251 PolarHBondContact O-N 3.3Å; R248-L252 WeakPolarHBondContact O-CB 3.35Å; R248-L252 PolarHBondContact O-N 3.4Å
249	L	94.7	Very high	92.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-42.4	174.7	-74.5	166.8	0	0	0	112.1	F153 V156 V157 F183 V217 V238 R245 R246 S247 R251 L252 F253	F153-L249 HydrophobicContact CD2-CD2 4.14Å; F153-L249 HydrophobicContact CE2-CD2 3.87Å; V156-L249 HydrophobicContact CB-CD2 4.43Å; V156-L249 HydrophobicContact CG1-CD2 3.74Å; V156-L249 HydrophobicContact CG1-CG 3.91Å; V157-L249 HydrophobicContact CB-CD2 4.16Å; V157-L249 HydrophobicContact CG2-CD1 4.3Å; V157-L249 HydrophobicContact CG2-CD2 4.44Å; F183-L249 HydrophobicContact CE1-CB 4.2Å; F183-L249 HydrophobicContact CZ-CB 4.05Å; V217-L249 HydrophobicContact CG2-CD1 3.75Å; V238-L249 HydrophobicContact CG2-CD1 3.65Å; R245-L249 HydrophobicContact CG-CD1 4.24Å; R245-L249 WeakPolarHBondContact O-CG 3.48Å; R245-L249 PolarHBondContact O-N 3.37Å; R246-L249 PolarHBondContact O-N 3.36Å; S247-L249 VanDerWaalsContact C-N 3.31Å; S247-L249 PolarHBondContact O-N 3.34Å; L249-R251 VanDerWaalsContact C-N 3.34Å; L249-R251 PolarHBondContact O-N 2.97Å; L249-L252 PolarHBondContact O-N 3.03Å; L249-F253 HydrophobicContact CD2-CE2 4.26Å; L249-F253 WeakPolarHBondContact O-CD2 3.45Å; L249-F253 PolarHBondContact O-N 3.1Å
250	N	93.3	Very high	92.1	Very high	39 Å²	39	39.4 Å²	39.4	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-46.3	173.8	-177.1	-56.9	0	0	0	110.9	N132 L135 F183 R246 S247 F253 G254 I255	N132-N250 PolarHBondContact ND2-OD1 3.45Å; L135-N250 HydrophobicContact CD1-CB 4.14Å; L135-N250 VanDerWaalsContact CD1-OD1 3.29Å; L135-N250 WeakPolarHBondContact CD1-OD1 3.44Å; F183-N250 HydrophobicContact CE1-CB 4.26Å; R246-N250 PolarHBondContact O-N 2.87Å; S247-N250 WeakPolarHBondContact O-CB 3.36Å; S247-N250 PolarHBondContact O-N 3.24Å; S247-N250 VanDerWaalsContact O-N 3.15Å; N250-F253 CarbonylContact O-C 3.48Å; N250-F253 PolarHBondContact O-N 3.29Å; N250-G254 WeakPolarHBondContact O-CA 3.48Å; N250-G254 PolarHBondContact O-N 3.01Å; N250-I255 PolarHBondContact O-N 2.86Å; N250-I255 PolarHBondContact OD1-O 3.46Å
251	R	90.8	Very high	92.1	Very high	30 Å²	30	38 Å²	38	11%	0.113	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-45.9	178.1	-67	-171.7	-33	-125	14.1	112.7	L135 D139 E145 S247 R248 L249 F253 G254	L135-R251 HydrophobicContact CB-CG 3.56Å; L135-R251 HydrophobicContact CD1-CG 3.63Å; L135-R251 HydrophobicContact CG-CG 4.24Å; D139-R251 IonicContact OD2-CZ 3.49Å; D139-R251 IonicContact OD2-NH1 2.74Å; D139-R251 PolarHBondContact OD2-NH1 2.89Å; E145-R251 IonicContact OE2-CZ 2.76Å; E145-R251 IonicContact OE2-NH2 3.82Å; E145-R251 PolarHBondContact OE2-NH2 3.14Å; S247-R251 WeakPolarHBondContact O-CG 3.46Å; S247-R251 PolarHBondContact O-N 3.11Å; R248-R251 PolarHBondContact O-N 3.3Å; L249-R251 VanDerWaalsContact C-N 3.34Å; L249-R251 PolarHBondContact O-N 2.97Å; R251-F253 PolarHBondContact O-N 3.33Å; R251-G254 PolarHBondContact O-N 2.97Å
252	L	91.1	Very high	92.2	Very high	38 Å²	38	33.5 Å²	33.5	20%	0.199	18%	0.182	C	C	.	.	H	α-helix	trans	-53.7	-45.1	179.5	176.5	64.4	0	0	0	110.8	P150 K151 F153 V156 R248 L249	P150-L252 HydrophobicContact CB-CD1 4.2Å; K151-L252 VanDerWaalsContact O-CD1 3.24Å; K151-L252 WeakPolarHBondContact O-CD1 3.16Å; F153-L252 HydrophobicContact CB-CD2 4.4Å; F153-L252 HydrophobicContact CD2-CD2 4.31Å; V156-L252 HydrophobicContact CB-CD2 4.04Å; V156-L252 HydrophobicContact CG1-CB 4.49Å; V156-L252 HydrophobicContact CG1-CD2 4.22Å; V156-L252 HydrophobicContact CG2-CD2 4Å; R248-L252 WeakPolarHBondContact O-CB 3.35Å; R248-L252 PolarHBondContact O-N 3.4Å; L249-L252 PolarHBondContact O-N 3.03Å
253	F	90.4	Very high	92.3	Very high	10 Å²	10	31.4 Å²	31.4	4%	0.044	17%	0.171	C	C	.	.	H	α-helix	trans	-94.5	-0.4	-180	-59.1	-53.5	0	0	0	113.8	F153 V181 F183 L249 N250 R251 I255 I262 L264 M270 R273	F153-F253 HydrophobicContact CD2-CE2 4.12Å; F153-F253 AromaticContact CD2-CZ 3.77Å; F153-F253 HydrophobicContact CD2-CZ 3.77Å; F153-F253 HydrophobicContact CE2-CE2 4.31Å; F153-F253 HydrophobicContact CE2-CZ 4.3Å; V181-F253 HydrophobicContact CB-CE2 4.21Å; V181-F253 HydrophobicContact CG1-CD2 4.5Å; V181-F253 HydrophobicContact CG1-CE2 4.13Å; V181-F253 HydrophobicContact CG2-CE2 3.99Å; V181-F253 HydrophobicContact CG2-CZ 4.34Å; F183-F253 AromaticContact CE2-CD2 3.84Å; F183-F253 HydrophobicContact CE2-CD2 3.84Å; F183-F253 AromaticContact CZ-CD2 3.82Å; F183-F253 HydrophobicContact CZ-CD2 3.82Å; L249-F253 HydrophobicContact CD2-CE2 4.26Å; L249-F253 WeakPolarHBondContact O-CD2 3.45Å; L249-F253 PolarHBondContact O-N 3.1Å; N250-F253 CarbonylContact O-C 3.48Å; N250-F253 PolarHBondContact O-N 3.29Å; R251-F253 PolarHBondContact O-N 3.33Å; F253-I255 VanDerWaalsContact C-N 3.29Å; F253-I255 HydrophobicContact CB-CD1 3.65Å; F253-I255 HydrophobicContact CB-CG1 3.93Å; F253-I255 PolarHBondContact O-N 3.08Å; F253-I262 HydrophobicContact CB-CD1 4.45Å; F253-I262 HydrophobicContact CB-CG1 4.09Å; F253-I262 HydrophobicContact CD1-CG1 4.42Å; F253-I262 HydrophobicContact CD1-CG2 4.03Å; F253-I262 HydrophobicContact CD2-CG1 4.29Å; F253-I262 HydrophobicContact CE1-CG2 3.99Å; F253-I262 HydrophobicContact CG-CG1 4.01Å; F253-I262 HydrophobicContact CG-CG2 4.41Å; F253-I262 HydrophobicContact CZ-CG2 4.35Å; F253-L264 HydrophobicContact CE1-CD2 3.97Å; F253-L264 HydrophobicContact CZ-CD1 4.04Å; F253-L264 HydrophobicContact CZ-CD2 4.05Å; F253-M270 HydrophobicContact CD1-CE 3.32Å; F253-M270 HydrophobicContact CE1-CE 3.66Å; F253-M270 HydrophobicContact CG-CE 4.45Å; F253-R273 PolarHBondContact O-NH1 2.89Å
254	G	87.4	Confident	92.4	Very high	10 Å²	10	25.5 Å²	25.5	10%	0.103	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	34.5	178.8	0	0	0	0	0	114	N250 R251 Q256	N250-G254 WeakPolarHBondContact O-CA 3.48Å; N250-G254 PolarHBondContact O-N 3.01Å; R251-G254 PolarHBondContact O-N 2.97Å; G254-Q256 PolarHBondContact O-N 3.18Å; G254-Q256 PolarHBondContact O-NE2 2.86Å
255	I	88.5	Confident	92.6	Very high	11 Å²	11	24.6 Å²	24.6	6%	0.056	13%	0.131	C	C	.	.			trans	-64.6	117.5	-172	-53.1	-62.8	0	0	0	110.9	F183 N250 F253 G257 T260 I262	F183-I255 HydrophobicContact CB-CG2 4.16Å; F183-I255 HydrophobicContact CD1-CG1 3.96Å; F183-I255 HydrophobicContact CD1-CG2 4.35Å; F183-I255 HydrophobicContact CD2-CD1 3.67Å; F183-I255 HydrophobicContact CD2-CG1 3.75Å; F183-I255 HydrophobicContact CE1-CG1 3.87Å; F183-I255 HydrophobicContact CE2-CD1 3.71Å; F183-I255 HydrophobicContact CE2-CG1 3.67Å; F183-I255 HydrophobicContact CG-CD1 4.23Å; F183-I255 HydrophobicContact CG-CG1 3.9Å; F183-I255 HydrophobicContact CG-CG2 4.13Å; F183-I255 HydrophobicContact CZ-CD1 4.28Å; F183-I255 HydrophobicContact CZ-CG1 3.74Å; N250-I255 PolarHBondContact O-N 2.86Å; N250-I255 PolarHBondContact OD1-O 3.46Å; F253-I255 VanDerWaalsContact C-N 3.29Å; F253-I255 HydrophobicContact CB-CD1 3.65Å; F253-I255 HydrophobicContact CB-CG1 3.93Å; F253-I255 PolarHBondContact O-N 3.08Å; I255-G257 VanDerWaalsContact CG2-O 3.31Å; I255-G257 WeakPolarHBondContact CG2-O 3.2Å; I255-T260 HydrophobicContact CD1-CG2 3.64Å; I255-I262 HydrophobicContact CD1-CD1 4.1Å; I255-I262 HydrophobicContact CD1-CG1 4.1Å
256	Q	80.7	Confident	92.6	Very high	111 Å²	111	26 Å²	26	52%	0.519	14%	0.143	S	C	.	.			trans	-99.2	-17.1	179.6	-59.8	-53.6	-62.4	0	0	113.5	G254	G254-Q256 PolarHBondContact O-N 3.18Å; G254-Q256 PolarHBondContact O-NE2 2.86Å
257	G	85.1	Confident	92.4	Very high	39 Å²	39	31.2 Å²	31.2	40%	0.402	17%	0.169	S	C	.	.	S	Bend	trans	-159.8	167.7	-175	0	0	0	0	0	112.8	I255 T260	I255-G257 VanDerWaalsContact CG2-O 3.31Å; I255-G257 WeakPolarHBondContact CG2-O 3.2Å; G257-T260 PolarHBondContact O-OG1 2.75Å
258	I	92.5	Very high	92.3	Very high	43 Å²	43	31.8 Å²	31.8	22%	0.221	18%	0.176	C	C	.	.	S	Bend	trans	-127.1	150.1	176.9	61.2	171.8	0	0	0	110.2	F183 A185 W187 C188 A219	F183-I258 HydrophobicContact CB-CG2 4.14Å; A185-I258 HydrophobicContact CB-CD1 3.59Å; W187-I258 HydrophobicContact CH2-CD1 3.83Å; W187-I258 HydrophobicContact CH2-CG1 4.46Å; W187-I258 HydrophobicContact CZ2-CD1 3.71Å; C188-I258 HydrophobicContact CB-CD1 3.95Å; C188-I258 HydrophobicContact CB-CG1 4.42Å; A219-I258 HydrophobicContact CB-CD1 4.15Å; A219-I258 HydrophobicContact CB-CG2 4.38Å
259	P	95	Very high	92.3	Very high	7 Å²	7	34.3 Å²	34.3	5%	0.045	19%	0.19	C	C	.	.	S	Bend	cis	-75.3	141.7	-3.7	28.3	-30.9	0	0	0	112.6	Y182 F183 P190 C191 L194	Y182-P259 HydrophobicContact CE2-CB 3.98Å; F183-P259 WeakPolarHBondContact O-CA 3.36Å; P190-P259 HydrophobicContact CB-CG 4.43Å; C191-P259 HydrophobicContact CB-CB 4.38Å; C191-P259 VanDerWaalsContact SG-CD 3.6Å; C191-P259 VanDerWaalsContact SG-N 3.44Å; L194-P259 HydrophobicContact CB-CB 4.48Å; L194-P259 HydrophobicContact CB-CG 4.26Å; L194-P259 HydrophobicContact CD2-CB 3.68Å; L194-P259 HydrophobicContact CD2-CG 3.91Å
260	T	95.1	Very high	92.1	Very high	31 Å²	31	37.5 Å²	37.5	19%	0.19	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.1	169.9	-62.2	0	0	0	0	109.6	F183 I255 G257 I262	F183-T260 PolarHBondContact N-O 3.36Å; F183-T260 PolarHBondContact O-N 3.11Å; I255-T260 HydrophobicContact CD1-CG2 3.64Å; G257-T260 PolarHBondContact O-OG1 2.75Å; T260-I262 HydrophobicContact CG2-CD1 3.82Å; T260-I262 HydrophobicContact CG2-CG1 4.33Å
261	L	97.3	Very high	92.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.8	172.5	176.9	66.4	0	0	0	109.1	L198 M214 G275 V279	L198-L261 HydrophobicContact CD2-CD2 3.64Å; M214-L261 HydrophobicContact CE-CD1 4.23Å; L261-G275 WeakPolarHBondContact O-CA 3.41Å; L261-G275 PolarHBondContact O-N 2.95Å; L261-G275 VanDerWaalsContact O-N 3.11Å; L261-V279 HydrophobicContact CD2-CG2 3.89Å
262	I	97	Very high	92.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.8	170.9	-52.7	-58.3	0	0	0	107.8	G180 V181 F183 F253 I255 T260 L264 M270 R273	G180-I262 CarbonylContact C-O 3.53Å; G180-I262 WeakPolarHBondContact CA-O 3.46Å; V181-I262 HydrophobicContact CB-CB 4.33Å; V181-I262 PolarHBondContact N-O 2.74Å; V181-I262 PolarHBondContact O-N 3.2Å; F183-I262 HydrophobicContact CE2-CG1 4.29Å; F253-I262 HydrophobicContact CB-CD1 4.45Å; F253-I262 HydrophobicContact CB-CG1 4.09Å; F253-I262 HydrophobicContact CD1-CG1 4.42Å; F253-I262 HydrophobicContact CD1-CG2 4.03Å; F253-I262 HydrophobicContact CD2-CG1 4.29Å; F253-I262 HydrophobicContact CE1-CG2 3.99Å; F253-I262 HydrophobicContact CG-CG1 4.01Å; F253-I262 HydrophobicContact CG-CG2 4.41Å; F253-I262 HydrophobicContact CZ-CG2 4.35Å; I255-I262 HydrophobicContact CD1-CD1 4.1Å; I255-I262 HydrophobicContact CD1-CG1 4.1Å; T260-I262 HydrophobicContact CG2-CD1 3.82Å; T260-I262 HydrophobicContact CG2-CG1 4.33Å; I262-L264 HydrophobicContact CG2-CD2 3.78Å; I262-L264 HydrophobicContact CG2-CG 4.49Å; I262-M270 HydrophobicContact CG2-CE 3.9Å; I262-M270 HydrophobicContact CG2-CG 4.27Å; I262-R273 HydrophobicContact CD1-CB 4.1Å; I262-R273 HydrophobicContact CD1-CG 4.17Å
263	L	97.8	Very high	92	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.5	172.2	-172.6	70.8	0	0	0	110	F212 I271 T272 F288 P289 W290	F212-L263 HydrophobicContact CE2-CD1 3.8Å; L263-I271 HydrophobicContact CB-CB 4.4Å; L263-I271 HydrophobicContact CD2-CB 4.24Å; L263-I271 HydrophobicContact CD2-CD1 4.01Å; L263-I271 HydrophobicContact CD2-CG2 4.18Å; L263-I271 HydrophobicContact CG-CB 4.33Å; L263-I271 HydrophobicContact CG-CD1 4.16Å; L263-I271 PolarHBondContact O-N 3.1Å; L263-T272 HydrophobicContact CB-CG2 3.86Å; L263-T272 PolarHBondContact N-O 3.36Å; L263-T272 PolarHBondContact O-N 2.73Å; L263-F288 HydrophobicContact CD1-CE2 4.26Å; L263-F288 HydrophobicContact CD2-CE2 4.49Å; L263-P289 HydrophobicContact CD2-CB 4.13Å; L263-P289 WeakPolarHBondContact CD2-O 3.46Å; L263-W290 HydrophobicContact CD2-CB 4.16Å; L263-W290 HydrophobicContact CD2-CE3 4Å
264	L	97.1	Very high	91.8	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	150	176.6	-48.9	178.2	0	0	0	110.7	F153 Y178 V179 V181 F253 I262 H269 M270	F153-L264 HydrophobicContact CB-CD1 4.12Å; F153-L264 HydrophobicContact CD1-CD1 3.45Å; F153-L264 VanDerWaalsContact CD1-CD1 3.45Å; F153-L264 HydrophobicContact CD2-CD1 3.7Å; F153-L264 HydrophobicContact CE1-CD1 3.67Å; F153-L264 HydrophobicContact CE2-CD1 3.9Å; F153-L264 HydrophobicContact CG-CD1 3.46Å; F153-L264 VanDerWaalsContact CG-CD1 3.46Å; F153-L264 HydrophobicContact CZ-CD1 3.89Å; Y178-L264 WeakPolarHBondContact CA-O 3.39Å; V179-L264 HydrophobicContact CB-CB 4.31Å; V179-L264 HydrophobicContact CB-CD1 4.4Å; V179-L264 PolarHBondContact N-O 2.94Å; V179-L264 VanDerWaalsContact N-O 3.07Å; V179-L264 PolarHBondContact O-N 3.29Å; V181-L264 HydrophobicContact CG2-CD1 4.02Å; V181-L264 HydrophobicContact CG2-CG 4.49Å; F253-L264 HydrophobicContact CE1-CD2 3.97Å; F253-L264 HydrophobicContact CZ-CD1 4.04Å; F253-L264 HydrophobicContact CZ-CD2 4.05Å; I262-L264 HydrophobicContact CG2-CD2 3.78Å; I262-L264 HydrophobicContact CG2-CG 4.49Å; L264-H269 CarbonylContact C-O 3.56Å; L264-H269 WeakPolarHBondContact CA-O 3.25Å; L264-M270 HydrophobicContact CD2-CB 4.15Å
265	D	95.6	Very high	92	Very high	33 Å²	33	39.3 Å²	39.3	18%	0.176	21%	0.208	C	C	.	.			trans	-74.4	178.5	168.7	68.9	16.2	0	0	0	112.1	Y178 E267 G268 H269 I271	Y178-D265 HydrophobicContact CE1-CB 4.33Å; D265-E267 PolarHBondContact O-N 3.33Å; D265-E267 WeakPolarHBondContact OD1-CA 3.11Å; D265-E267 PolarHBondContact OD1-N 2.83Å; D265-E267 VanDerWaalsContact OD1-N 3.08Å; D265-G268 PolarHBondContact O-N 2.82Å; D265-G268 PolarHBondContact OD1-N 2.88Å; D265-H269 PolarHBondContact N-O 2.87Å; D265-H269 IonicContact OD1-CG 3.69Å; D265-H269 PolarHBondContact OD1-N 3.49Å; D265-H269 IonicContact OD1-ND1 3.21Å; D265-H269 PolarHBondContact OD1-ND1 3.19Å; D265-H269 WeakPolarHBondContact OD2-CB 3.38Å; D265-H269 IonicContact OD2-CG 3.45Å; D265-H269 IonicContact OD2-ND1 2.65Å; D265-H269 PolarHBondContact OD2-ND1 2.89Å; D265-I271 HydrophobicContact CB-CD1 3.92Å; D265-I271 HydrophobicContact CB-CG1 4.01Å
266	A	94.5	Very high	92.2	Very high	33 Å²	33	44 Å²	44	27%	0.273	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-21.6	-177.8	0	0	0	0	0	113.5	H177	H177-A266 WeakPolarHBondContact O-CA 3.48Å
267	E	91.5	Very high	92.5	Very high	139 Å²	139	39.2 Å²	39.2	65%	0.65	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.4	176.9	-63.6	70.8	-151.7	0	0	112.4	D265 H269	D265-E267 PolarHBondContact O-N 3.33Å; D265-E267 WeakPolarHBondContact OD1-CA 3.11Å; D265-E267 PolarHBondContact OD1-N 2.83Å; D265-E267 VanDerWaalsContact OD1-N 3.08Å; E267-H269 VanDerWaalsContact CB-CE1 3.49Å; E267-H269 WeakPolarHBondContact CB-CE1 3.32Å
268	G	91.5	Very high	92.7	Very high	21 Å²	21	37.8 Å²	37.8	22%	0.216	19%	0.186	C	C	.	.	S	Bend	trans	85.1	12.8	-179.2	0	0	0	0	0	114.4	D265	D265-G268 PolarHBondContact O-N 2.82Å; D265-G268 PolarHBondContact OD1-N 2.88Å
269	H	90.9	Very high	92.7	Very high	121 Å²	121	35.8 Å²	35.8	56%	0.56	18%	0.176	S	C	*	.			trans	-78.1	149.7	169.1	-46	107.6	0	0	0	110.8	L264 D265 E267 I271	L264-H269 CarbonylContact C-O 3.56Å; L264-H269 WeakPolarHBondContact CA-O 3.25Å; D265-H269 PolarHBondContact N-O 2.87Å; D265-H269 IonicContact OD1-CG 3.69Å; D265-H269 PolarHBondContact OD1-N 3.49Å; D265-H269 IonicContact OD1-ND1 3.21Å; D265-H269 PolarHBondContact OD1-ND1 3.19Å; D265-H269 WeakPolarHBondContact OD2-CB 3.38Å; D265-H269 IonicContact OD2-CG 3.45Å; D265-H269 IonicContact OD2-ND1 2.65Å; D265-H269 PolarHBondContact OD2-ND1 2.89Å; E267-H269 VanDerWaalsContact CB-CE1 3.49Å; E267-H269 WeakPolarHBondContact CB-CE1 3.32Å; H269-I271 PolarHBondContact O-N 3.06Å
270	M	91.5	Very high	92.5	Very high	67 Å²	67	38.9 Å²	38.9	33%	0.33	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.4	-178.5	-176.2	176.4	-66.5	0	0	111.9	F253 I262 L264 R273	F253-M270 HydrophobicContact CD1-CE 3.32Å; F253-M270 HydrophobicContact CE1-CE 3.66Å; F253-M270 HydrophobicContact CG-CE 4.45Å; I262-M270 HydrophobicContact CG2-CE 3.9Å; I262-M270 HydrophobicContact CG2-CG 4.27Å; L264-M270 HydrophobicContact CD2-CB 4.15Å; M270-R273 HydrophobicContact CE-CG 4.2Å; M270-R273 HydrophobicContact CG-CG 4.42Å; M270-R273 HydrophobicContact SD-CG 3.26Å; M270-R273 WeakPolarHBondContact SD-CG 3.4Å; M270-R273 VanDerWaalsContact SD-CZ 3.53Å; M270-R273 PolarHBondContact SD-NE 3.47Å
271	I	92.7	Very high	92	Very high	17 Å²	17	40.2 Å²	40.2	9%	0.087	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-56.6	169.3	-64.7	174.3	0	0	0	110	Y178 L263 D265 H269 P289 H291 P292	Y178-I271 HydrophobicContact CD1-CD1 3.64Å; Y178-I271 HydrophobicContact CE1-CD1 3.7Å; L263-I271 HydrophobicContact CB-CB 4.4Å; L263-I271 HydrophobicContact CD2-CB 4.24Å; L263-I271 HydrophobicContact CD2-CD1 4.01Å; L263-I271 HydrophobicContact CD2-CG2 4.18Å; L263-I271 HydrophobicContact CG-CB 4.33Å; L263-I271 HydrophobicContact CG-CD1 4.16Å; L263-I271 PolarHBondContact O-N 3.1Å; D265-I271 HydrophobicContact CB-CD1 3.92Å; D265-I271 HydrophobicContact CB-CG1 4.01Å; H269-I271 PolarHBondContact O-N 3.06Å; I271-P289 HydrophobicContact CD1-CB 4.07Å; I271-P289 HydrophobicContact CD1-CG 4.43Å; I271-P289 WeakPolarHBondContact CG2-O 3.41Å; I271-H291 HydrophobicContact CG2-CB 4.4Å; I271-H291 VanDerWaalsContact CG2-ND1 3.31Å; I271-H291 WeakPolarHBondContact CG2-ND1 3.3Å; I271-P292 WeakPolarHBondContact O-CD 3.44Å; I271-P292 VanDerWaalsContact O-CG 3.25Å; I271-P292 WeakPolarHBondContact O-CG 3.29Å
272	T	90.6	Very high	91.7	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.043	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	146.5	-178.6	-175.5	0	0	0	0	112.4	L263 Q274 E278 W290	L263-T272 HydrophobicContact CB-CG2 3.86Å; L263-T272 PolarHBondContact N-O 3.36Å; L263-T272 PolarHBondContact O-N 2.73Å; T272-Q274 PolarHBondContact OG1-N 3.45Å; T272-E278 HydrophobicContact CG2-CG 4.41Å; T272-W290 HydrophobicContact CG2-CB 4.47Å; T272-W290 WeakPolarHBondContact CG2-O 3.46Å
273	R	88.8	Confident	91.3	Very high	99 Å²	99	45.3 Å²	45.3	37%	0.374	23%	0.23	S	C	.	.	S	Bend	trans	-91.5	-13.2	168.1	-62.4	176.6	171.2	-87.8	-2.5	112.2	F253 I262 M270	F253-R273 PolarHBondContact O-NH1 2.89Å; I262-R273 HydrophobicContact CD1-CB 4.1Å; I262-R273 HydrophobicContact CD1-CG 4.17Å; M270-R273 HydrophobicContact CE-CG 4.2Å; M270-R273 HydrophobicContact CG-CG 4.42Å; M270-R273 HydrophobicContact SD-CG 3.26Å; M270-R273 WeakPolarHBondContact SD-CG 3.4Å; M270-R273 VanDerWaalsContact SD-CZ 3.53Å; M270-R273 PolarHBondContact SD-NE 3.47Å
274	Q	86.6	Confident	91	Very high	42 Å²	42	50.9 Å²	50.9	20%	0.196	26%	0.256	C	S	.	.			trans	-99	25.7	-175	-57.7	-62.4	10.4	0	0	112.5	T272 R276 V277 E278 E308	T272-Q274 PolarHBondContact OG1-N 3.45Å; Q274-R276 PolarHBondContact O-N 3.49Å; Q274-V277 HydrophobicContact CB-CB 4.42Å; Q274-V277 PolarHBondContact O-N 3.41Å; Q274-E278 WeakPolarHBondContact O-CG 3.39Å; Q274-E278 PolarHBondContact O-N 2.99Å; Q274-E308 PolarHBondContact NE2-OE1 3.02Å; Q274-E308 PolarHBondContact NE2-OE2 3.34Å
275	G	92.8	Very high	90.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55	-28.4	-176.3	0	0	0	0	0	113.3	L261 V279	L261-G275 WeakPolarHBondContact O-CA 3.41Å; L261-G275 PolarHBondContact O-N 2.95Å; L261-G275 VanDerWaalsContact O-N 3.11Å; G275-V279 VanDerWaalsContact O-CB 3.28Å; G275-V279 WeakPolarHBondContact O-CB 3.48Å; G275-V279 WeakPolarHBondContact O-CG2 3.45Å; G275-V279 PolarHBondContact O-N 3.42Å
276	R	91	Very high	90.8	Very high	109 Å²	109	58.8 Å²	58.8	41%	0.411	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-50.2	171.1	172	-178.1	173.8	-155.1	-9.3	112	L194 Q274 L280	L194-R276 HydrophobicContact CD1-CG 4.14Å; L194-R276 HydrophobicContact CD2-CB 3.99Å; L194-R276 HydrophobicContact CD2-CG 3.81Å; Q274-R276 PolarHBondContact O-N 3.49Å; R276-L280 HydrophobicContact CG-CD1 4.03Å; R276-L280 WeakPolarHBondContact O-CD1 3.47Å; R276-L280 WeakPolarHBondContact O-CG 3.19Å; R276-L280 PolarHBondContact O-N 2.86Å
277	V	87	Confident	90.6	Very high	12 Å²	12	61.4 Å²	61.4	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-68.8	-45.4	-177.6	177.7	0	0	0	0	109.6	Q274 V279 L280 N281 N302	Q274-V277 HydrophobicContact CB-CB 4.42Å; Q274-V277 PolarHBondContact O-N 3.41Å; V277-V279 PolarHBondContact O-N 3.03Å; V277-L280 PolarHBondContact O-N 2.88Å; V277-N281 WeakPolarHBondContact CG1-ND2 3.25Å; V277-N281 WeakPolarHBondContact O-CB 3.27Å; V277-N281 PolarHBondContact O-N 2.9Å; V277-N302 HydrophobicContact CG1-CB 3.95Å
278	E	90.4	Very high	90.8	Very high	9 Å²	9	56 Å²	56	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-46	-178.8	-59.2	-56.6	151.2	0	0	112.1	T272 Q274 L280 N281 D282 W290	T272-E278 HydrophobicContact CG2-CG 4.41Å; Q274-E278 WeakPolarHBondContact O-CG 3.39Å; Q274-E278 PolarHBondContact O-N 2.99Å; E278-L280 PolarHBondContact O-N 2.5Å; E278-N281 PolarHBondContact O-N 3.42Å; E278-D282 WeakPolarHBondContact O-CB 3.36Å; E278-D282 PolarHBondContact O-N 2.75Å; E278-W290 HydrophobicContact CB-CB 3.72Å; E278-W290 HydrophobicContact CB-CG 3.82Å; E278-W290 HydrophobicContact CG-CB 4.11Å
279	V	92.6	Very high	90.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-40.6	177.9	168.8	0	0	0	0	111.9	V197 L198 S201 L261 G275 V277 N281 D282 W290	V197-V279 HydrophobicContact CG1-CG1 3.68Å; L198-V279 HydrophobicContact CD2-CB 4.48Å; L198-V279 HydrophobicContact CD2-CG1 3.97Å; L198-V279 HydrophobicContact CD2-CG2 4.05Å; S201-V279 WeakPolarHBondContact OG-CG1 3.43Å; L261-V279 HydrophobicContact CD2-CG2 3.89Å; G275-V279 VanDerWaalsContact O-CB 3.28Å; G275-V279 WeakPolarHBondContact O-CB 3.48Å; G275-V279 WeakPolarHBondContact O-CG2 3.45Å; G275-V279 PolarHBondContact O-N 3.42Å; V277-V279 PolarHBondContact O-N 3.03Å; V279-N281 VanDerWaalsContact C-N 3.29Å; V279-N281 PolarHBondContact O-N 3.15Å; V279-D282 CarbonylContact O-C 3.57Å; V279-D282 PolarHBondContact O-N 2.78Å; V279-W290 HydrophobicContact CG2-CD2 4.02Å; V279-W290 HydrophobicContact CG2-CE3 3.77Å; V279-W290 HydrophobicContact CG2-CH2 3.46Å; V279-W290 VanDerWaalsContact CG2-CH2 3.46Å; V279-W290 HydrophobicContact CG2-CZ2 3.65Å; V279-W290 HydrophobicContact CG2-CZ3 3.51Å
280	L	89.4	Confident	91.1	Very high	72 Å²	72	50.2 Å²	50.2	38%	0.377	24%	0.238	S	C	.	.	H	α-helix	trans	-68.2	-31.5	180	-72.3	171.1	0	0	0	112.3	L194 V197 R276 V277 E278	L194-L280 HydrophobicContact CD1-CD1 4.43Å; L194-L280 HydrophobicContact CD1-CD2 4.22Å; L194-L280 HydrophobicContact CD1-CG 4.16Å; V197-L280 HydrophobicContact CG1-CD2 4.33Å; V197-L280 HydrophobicContact CG2-CD2 4.04Å; R276-L280 HydrophobicContact CG-CD1 4.03Å; R276-L280 WeakPolarHBondContact O-CD1 3.47Å; R276-L280 WeakPolarHBondContact O-CG 3.19Å; R276-L280 PolarHBondContact O-N 2.86Å; V277-L280 PolarHBondContact O-N 2.88Å; E278-L280 PolarHBondContact O-N 2.5Å
281	N	85.7	Confident	91	Very high	59 Å²	59	52.1 Å²	52.1	32%	0.316	25%	0.246	S	C	.	.	H	α-helix	trans	-89.6	-1.9	178.7	-66.8	-17	0	0	0	113.1	V277 E278 V279 S301	V277-N281 WeakPolarHBondContact CG1-ND2 3.25Å; V277-N281 WeakPolarHBondContact O-CB 3.27Å; V277-N281 PolarHBondContact O-N 2.9Å; E278-N281 PolarHBondContact O-N 3.42Å; V279-N281 VanDerWaalsContact C-N 3.29Å; V279-N281 PolarHBondContact O-N 3.15Å; N281-S301 PolarHBondContact ND2-OG 3.42Å; N281-S301 PolarHBondContact OD1-OG 2.91Å; N281-S301 VanDerWaalsContact OD1-OG 3.05Å
282	D	90.4	Very high	90.6	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.053	26%	0.26	C	S	.	.			trans	-131.2	67.9	176.5	-178.1	27.1	0	0	0	111.2	E278 V279 E284 C285 R286 L287 W290	E278-D282 WeakPolarHBondContact O-CB 3.36Å; E278-D282 PolarHBondContact O-N 2.75Å; V279-D282 CarbonylContact O-C 3.57Å; V279-D282 PolarHBondContact O-N 2.78Å; D282-E284 PolarHBondContact O-N 2.9Å; D282-E284 VanDerWaalsContact O-N 3.12Å; D282-C285 VanDerWaalsContact CG-CA 3.46Å; D282-C285 PolarHBondContact O-N 2.88Å; D282-C285 WeakPolarHBondContact OD1-CA 3.04Å; D282-C285 PolarHBondContact OD1-N 3.01Å; D282-C285 VanDerWaalsContact OD1-N 3.16Å; D282-C285 WeakPolarHBondContact OD2-CA 3.48Å; D282-R286 PolarHBondContact OD1-N 3.34Å; D282-R286 PolarHBondContact OD2-N 3.44Å; D282-R286 VanDerWaalsContact OD2-N 3.1Å; D282-L287 HydrophobicContact CB-CB 4.41Å; D282-L287 HydrophobicContact CB-CD1 4.34Å; D282-L287 HydrophobicContact CB-CG 4.46Å; D282-L287 WeakPolarHBondContact OD2-CA 3.36Å; D282-L287 WeakPolarHBondContact OD2-CB 3.27Å; D282-L287 PolarHBondContact OD2-N 3.36Å; D282-W290 PolarHBondContact OD2-NE1 2.91Å
283	P	88.7	Confident	90.4	Very high	100 Å²	100	58.1 Å²	58.1	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30	-175.7	-24.3	34.6	0	0	0	113.5
284	E	92.1	Very high	90.5	Very high	117 Å²	117	54.8 Å²	54.8	55%	0.547	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.6	179.2	-65.2	-168.5	-156.2	0	0	113.8	D282 R286	D282-E284 PolarHBondContact O-N 2.9Å; D282-E284 VanDerWaalsContact O-N 3.12Å; E284-R286 HydrophobicContact CB-CG 3.94Å; E284-R286 PolarHBondContact O-N 3.4Å; E284-R286 IonicContact OE1-NH2 3.39Å; E284-R286 PolarHBondContact OE1-NH2 2.9Å; E284-R286 IonicContact OE2-CZ 3.02Å; E284-R286 IonicContact OE2-NE 2.74Å; E284-R286 PolarHBondContact OE2-NE 2.86Å; E284-R286 IonicContact OE2-NH2 2.63Å; E284-R286 PolarHBondContact OE2-NH2 3.19Å
285	C	94.2	Very high	90.9	Very high	13 Å²	13	53.2 Å²	53.2	9%	0.088	26%	0.258	C	S	.	.			trans	58.1	27.6	179.9	-56.2	0	0	0	0	114.1	S201 T204 V205 D282 L287 F288 W290	S201-C285 WeakPolarHBondContact CA-SG 3.37Å; S201-C285 WeakPolarHBondContact CB-SG 3.4Å; T204-C285 HydrophobicContact CG2-CB 3.96Å; V205-C285 HydrophobicContact CG2-CB 3.74Å; D282-C285 VanDerWaalsContact CG-CA 3.46Å; D282-C285 PolarHBondContact O-N 2.88Å; D282-C285 WeakPolarHBondContact OD1-CA 3.04Å; D282-C285 PolarHBondContact OD1-N 3.01Å; D282-C285 VanDerWaalsContact OD1-N 3.16Å; D282-C285 WeakPolarHBondContact OD2-CA 3.48Å; C285-L287 VanDerWaalsContact C-N 3.25Å; C285-L287 PolarHBondContact O-N 2.92Å; C285-F288 PolarHBondContact O-N 3.18Å; C285-W290 HydrophobicContact CB-CZ2 4.36Å
286	R	93.1	Very high	90.8	Very high	188 Å²	188	53.9 Å²	53.9	71%	0.709	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-23	-178.7	-66.2	-177.1	-175	178	4	112.3	D282 E284	D282-R286 PolarHBondContact OD1-N 3.34Å; D282-R286 PolarHBondContact OD2-N 3.44Å; D282-R286 VanDerWaalsContact OD2-N 3.1Å; E284-R286 HydrophobicContact CB-CG 3.94Å; E284-R286 PolarHBondContact O-N 3.4Å; E284-R286 IonicContact OE1-NH2 3.39Å; E284-R286 PolarHBondContact OE1-NH2 2.9Å; E284-R286 IonicContact OE2-CZ 3.02Å; E284-R286 IonicContact OE2-NE 2.74Å; E284-R286 PolarHBondContact OE2-NE 2.86Å; E284-R286 IonicContact OE2-NH2 2.63Å; E284-R286 PolarHBondContact OE2-NH2 3.19Å
287	L	91.7	Very high	90.8	Very high	87 Å²	87	50.3 Å²	50.3	46%	0.455	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	2.7	-178.2	-55.4	179.8	0	0	0	112.5	D282 C285 W290	D282-L287 HydrophobicContact CB-CB 4.41Å; D282-L287 HydrophobicContact CB-CD1 4.34Å; D282-L287 HydrophobicContact CB-CG 4.46Å; D282-L287 WeakPolarHBondContact OD2-CA 3.36Å; D282-L287 WeakPolarHBondContact OD2-CB 3.27Å; D282-L287 PolarHBondContact OD2-N 3.36Å; C285-L287 VanDerWaalsContact C-N 3.25Å; C285-L287 PolarHBondContact O-N 2.92Å; L287-W290 WeakPolarHBondContact O-CA 3.37Å; L287-W290 PolarHBondContact O-N 3.28Å
288	F	94.7	Very high	90.9	Very high	25 Å²	25	49.7 Å²	49.7	11%	0.11	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	132.9	172.9	-173.6	-88.8	0	0	0	110.4	Y178 V205 Q210 F212 L263 C285 W290	Y178-F288 AromaticContact CD2-CE1 3.76Å; Y178-F288 HydrophobicContact CD2-CE1 3.76Å; Y178-F288 AromaticContact CD2-CZ 3.95Å; Y178-F288 HydrophobicContact CD2-CZ 3.95Å; Y178-F288 HydrophobicContact CE2-CE1 4.22Å; Y178-F288 HydrophobicContact CG-CE1 4.09Å; Y178-F288 AromaticContact CG-CZ 3.85Å; Y178-F288 HydrophobicContact CG-CZ 3.85Å; V205-F288 HydrophobicContact CB-CD2 4.45Å; V205-F288 HydrophobicContact CG1-CD1 3.74Å; V205-F288 HydrophobicContact CG1-CD2 3.86Å; V205-F288 HydrophobicContact CG1-CE1 3.64Å; V205-F288 HydrophobicContact CG1-CE2 3.76Å; V205-F288 HydrophobicContact CG1-CG 3.85Å; V205-F288 HydrophobicContact CG1-CZ 3.65Å; V205-F288 HydrophobicContact CG2-CB 4.08Å; V205-F288 HydrophobicContact CG2-CD1 4.48Å; V205-F288 HydrophobicContact CG2-CD2 3.66Å; V205-F288 HydrophobicContact CG2-CE2 4.25Å; V205-F288 HydrophobicContact CG2-CG 3.79Å; Q210-F288 HydrophobicContact CB-CD1 4.33Å; Q210-F288 HydrophobicContact CB-CE1 3.96Å; Q210-F288 HydrophobicContact CG-CD1 3.94Å; Q210-F288 HydrophobicContact CG-CE1 4.03Å; F212-F288 HydrophobicContact CB-CZ 4.12Å; F212-F288 HydrophobicContact CD1-CE2 4.5Å; F212-F288 AromaticContact CD2-CE2 3.9Å; F212-F288 HydrophobicContact CD2-CE2 3.9Å; F212-F288 AromaticContact CD2-CZ 3.78Å; F212-F288 HydrophobicContact CD2-CZ 3.78Å; F212-F288 HydrophobicContact CE2-CE2 4.07Å; F212-F288 HydrophobicContact CE2-CZ 4.38Å; F212-F288 HydrophobicContact CG-CE2 4.14Å; F212-F288 AromaticContact CG-CZ 3.97Å; F212-F288 HydrophobicContact CG-CZ 3.97Å; F212-F288 HydrophobicContact CZ-CE2 4.43Å; L263-F288 HydrophobicContact CD1-CE2 4.26Å; L263-F288 HydrophobicContact CD2-CE2 4.49Å; C285-F288 PolarHBondContact O-N 3.18Å; F288-W290 VanDerWaalsContact CA-N 3.33Å; F288-W290 HydrophobicContact CD2-CD2 4.04Å; F288-W290 AromaticContact CD2-CE3 3.85Å; F288-W290 HydrophobicContact CD2-CE3 3.85Å; F288-W290 AromaticContact CD2-CH2 3.76Å; F288-W290 HydrophobicContact CD2-CH2 3.76Å; F288-W290 HydrophobicContact CD2-CZ2 4Å; F288-W290 AromaticContact CD2-CZ3 3.69Å; F288-W290 HydrophobicContact CD2-CZ3 3.69Å; F288-W290 HydrophobicContact CE2-CE3 4.22Å; F288-W290 HydrophobicContact CE2-CH2 4.3Å; F288-W290 AromaticContact CE2-CZ3 3.93Å; F288-W290 HydrophobicContact CE2-CZ3 3.93Å
289	P	94.8	Very high	90.8	Very high	19 Å²	19	50.9 Å²	50.9	12%	0.123	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.4	53.5	13.6	39.1	-39	0	0	0	114.4	Y178 L263 I271 H291	Y178-P289 HydrophobicContact CD1-CB 3.75Å; Y178-P289 HydrophobicContact CD1-CG 4.4Å; Y178-P289 HydrophobicContact CE1-CB 3.58Å; Y178-P289 HydrophobicContact CE1-CG 3.72Å; Y178-P289 HydrophobicContact CE2-CB 4.44Å; Y178-P289 HydrophobicContact CG-CB 4.28Å; L263-P289 HydrophobicContact CD2-CB 4.13Å; L263-P289 WeakPolarHBondContact CD2-O 3.46Å; I271-P289 HydrophobicContact CD1-CB 4.07Å; I271-P289 HydrophobicContact CD1-CG 4.43Å; I271-P289 WeakPolarHBondContact CG2-O 3.41Å; P289-H291 WeakPolarHBondContact CG-NE2 3.49Å; P289-H291 PolarHBondContact O-N 3.43Å
290	W	93.8	Very high	90.4	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.008	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	39.3	47.6	167.9	-57.6	-50.5	0	0	0	114.3	V205 L263 T272 E278 V279 D282 C285 L287 F288	V205-W290 HydrophobicContact CG2-CH2 4.25Å; V205-W290 HydrophobicContact CG2-CZ2 4.41Å; L263-W290 HydrophobicContact CD2-CB 4.16Å; L263-W290 HydrophobicContact CD2-CE3 4Å; T272-W290 HydrophobicContact CG2-CB 4.47Å; T272-W290 WeakPolarHBondContact CG2-O 3.46Å; E278-W290 HydrophobicContact CB-CB 3.72Å; E278-W290 HydrophobicContact CB-CG 3.82Å; E278-W290 HydrophobicContact CG-CB 4.11Å; V279-W290 HydrophobicContact CG2-CD2 4.02Å; V279-W290 HydrophobicContact CG2-CE3 3.77Å; V279-W290 HydrophobicContact CG2-CH2 3.46Å; V279-W290 VanDerWaalsContact CG2-CH2 3.46Å; V279-W290 HydrophobicContact CG2-CZ2 3.65Å; V279-W290 HydrophobicContact CG2-CZ3 3.51Å; D282-W290 PolarHBondContact OD2-NE1 2.91Å; C285-W290 HydrophobicContact CB-CZ2 4.36Å; L287-W290 WeakPolarHBondContact O-CA 3.37Å; L287-W290 PolarHBondContact O-N 3.28Å; F288-W290 VanDerWaalsContact CA-N 3.33Å; F288-W290 HydrophobicContact CD2-CD2 4.04Å; F288-W290 AromaticContact CD2-CE3 3.85Å; F288-W290 HydrophobicContact CD2-CE3 3.85Å; F288-W290 AromaticContact CD2-CH2 3.76Å; F288-W290 HydrophobicContact CD2-CH2 3.76Å; F288-W290 HydrophobicContact CD2-CZ2 4Å; F288-W290 AromaticContact CD2-CZ3 3.69Å; F288-W290 HydrophobicContact CD2-CZ3 3.69Å; F288-W290 HydrophobicContact CE2-CE3 4.22Å; F288-W290 HydrophobicContact CE2-CH2 4.3Å; F288-W290 AromaticContact CE2-CZ3 3.93Å; F288-W290 HydrophobicContact CE2-CZ3 3.93Å
291	H	89.9	Confident	89.9	Confident	108 Å²	108	57.3 Å²	57.3	50%	0.5	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-62.3	141.4	174.2	-74.7	-65.7	0	0	0	109.7	I271 P289 R293	I271-H291 HydrophobicContact CG2-CB 4.4Å; I271-H291 VanDerWaalsContact CG2-ND1 3.31Å; I271-H291 WeakPolarHBondContact CG2-ND1 3.3Å; P289-H291 WeakPolarHBondContact CG-NE2 3.49Å; P289-H291 PolarHBondContact O-N 3.43Å; H291-R293 PolarHBondContact O-N 3.4Å; H291-R293 VanDerWaalsContact O-N 3.14Å
292	P	84.3	Confident	89.9	Confident	59 Å²	59	54.6 Å²	54.6	38%	0.383	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-53	123.7	176.1	-25.8	33.7	0	0	0	110.5	I271 M339	I271-P292 WeakPolarHBondContact O-CD 3.44Å; I271-P292 VanDerWaalsContact O-CG 3.25Å; I271-P292 WeakPolarHBondContact O-CG 3.29Å; P292-M339 HydrophobicContact CB-CE 4.09Å
293	R	87.1	Confident	89.6	Confident	90 Å²	90	54.9 Å²	54.9	34%	0.34	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-77.3	140.5	177.2	-67.6	-172.1	-70.7	163.3	-1.9	109.8	H291 V295 L296	H291-R293 PolarHBondContact O-N 3.4Å; H291-R293 VanDerWaalsContact O-N 3.14Å; R293-V295 PolarHBondContact O-N 2.81Å; R293-L296 HydrophobicContact CB-CD2 4.03Å
294	P	91	Very high	89.3	Confident	29 Å²	29	54.6 Å²	54.6	19%	0.188	28%	0.275	C	S	.	.	S	Bend	trans	-62.6	-34.4	179.5	-21.6	32.3	0	0	0	113.2	Q332 A335 E336 M339 F353	P294-Q332 HydrophobicContact CB-CG 4.2Å; P294-Q332 HydrophobicContact CG-CG 4.34Å; P294-A335 HydrophobicContact CB-CB 3.78Å; P294-A335 VanDerWaalsContact O-CB 3.26Å; P294-A335 WeakPolarHBondContact O-CB 3.17Å; P294-E336 HydrophobicContact CB-CG 3.68Å; P294-E336 HydrophobicContact CG-CG 3.37Å; P294-M339 VanDerWaalsContact CA-SD 3.54Å; P294-M339 HydrophobicContact CB-SD 3.97Å; P294-M339 HydrophobicContact CG-SD 4.33Å; P294-F353 WeakPolarHBondContact O-CB 3.37Å
295	V	93.8	Very high	88.9	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.055	25%	0.251	C	S	.	.	S	Bend	trans	-131.2	132.6	-179.7	-172.6	0	0	0	0	108.3	R293 K328 I331 Q332 A335 F353 V355	R293-V295 PolarHBondContact O-N 2.81Å; V295-K328 HydrophobicContact CG1-CB 4.36Å; V295-K328 HydrophobicContact CG1-CG 4.1Å; V295-I331 HydrophobicContact CB-CG1 4.49Å; V295-I331 HydrophobicContact CG1-CD1 3.76Å; V295-I331 HydrophobicContact CG1-CG1 3.9Å; V295-I331 HydrophobicContact CG2-CD1 4.33Å; V295-I331 HydrophobicContact CG2-CG1 3.71Å; V295-Q332 VanDerWaalsContact CG2-CA 3.5Å; V295-Q332 HydrophobicContact CG2-CB 3.79Å; V295-A335 HydrophobicContact CG2-CB 4.1Å; V295-F353 HydrophobicContact CG1-CB 4.49Å; V295-F353 HydrophobicContact CG2-CB 4.23Å; V295-V355 HydrophobicContact CG1-CG2 3.79Å
296	L	90.5	Very high	88.6	Confident	14 Å²	14	49.1 Å²	49.1	7%	0.073	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	153.8	175.4	-63.3	176.4	0	0	0	109.9	R293 F353 F354 V355	R293-L296 HydrophobicContact CB-CD2 4.03Å; L296-F353 PolarHBondContact N-O 2.71Å; L296-F354 HydrophobicContact CB-CD1 3.7Å; L296-F354 HydrophobicContact CB-CE1 3.7Å; L296-F354 HydrophobicContact CD1-CE1 3.79Å; L296-F354 HydrophobicContact CD1-CZ 4.06Å; L296-F354 HydrophobicContact CG-CE1 4.38Å; L296-F354 CarbonylContact O-C 3.54Å; L296-F354 WeakPolarHBondContact O-CA 3.41Å; L296-V355 PolarHBondContact O-N 3.03Å
297	E	90.8	Very high	88	Confident	34 Å²	34	46 Å²	46	16%	0.159	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.1	162.4	-179.2	167.8	149.2	0	0	108.5	S299 N302 E321 L324 K328 V355	E297-S299 PolarHBondContact O-N 2.83Å; E297-N302 PolarHBondContact O-ND2 2.77Å; E297-E321 WeakPolarHBondContact OE2-CG 3.31Å; E297-L324 HydrophobicContact CG-CD1 3.67Å; E297-K328 IonicContact OE2-NZ 2.73Å; E297-K328 PolarHBondContact OE2-NZ 3.03Å; E297-V355 WeakPolarHBondContact CA-O 3.29Å
298	L	90.7	Very high	87.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.			trans	-70.8	127.9	176.9	-178.6	65.1	0	0	0	109.5	L306 F354 V355 A356 M361 L365	L298-L306 HydrophobicContact CD1-CD1 3.92Å; L298-L306 HydrophobicContact CD1-CD2 4.32Å; L298-L306 HydrophobicContact CD1-CG 4.22Å; L298-F354 HydrophobicContact CB-CB 4.45Å; L298-F354 HydrophobicContact CB-CD1 4.26Å; L298-F354 HydrophobicContact CD1-CD1 4.23Å; L298-V355 PolarHBondContact N-O 2.96Å; L298-A356 HydrophobicContact CB-CB 4.11Å; L298-A356 HydrophobicContact CD2-CB 4.06Å; L298-M361 HydrophobicContact CG-CG 4.34Å; L298-L365 HydrophobicContact CD2-CD2 3.43Å; L298-L365 VanDerWaalsContact CD2-CD2 3.43Å
299	S	87.2	Confident	86.8	Confident	33 Å²	33	44.6 Å²	44.6	23%	0.231	24%	0.237	C	C	.	.			trans	-149.1	168.3	173.8	70.8	0	0	0	0	110.8	E297 S301 N302 A303	E297-S299 PolarHBondContact O-N 2.83Å; S299-S301 PolarHBondContact O-N 3.21Å; S299-S301 VanDerWaalsContact O-N 3.1Å; S299-S301 PolarHBondContact OG-OG 2.98Å; S299-S301 VanDerWaalsContact OG-OG 3.14Å; S299-N302 PolarHBondContact N-OD1 3.29Å; S299-N302 PolarHBondContact O-N 2.98Å; S299-N302 VanDerWaalsContact O-N 3.15Å; S299-N302 PolarHBondContact O-OD1 2.8Å; S299-N302 VanDerWaalsContact O-OD1 3.04Å; S299-A303 PolarHBondContact O-N 3.16Å
300	E	84.8	Confident	86.7	Confident	157 Å²	157	45 Å²	45	73%	0.734	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.3	176.8	-66	-168.6	159.6	0	0	112.7	N302 M361	E300-N302 VanDerWaalsContact C-N 3.31Å; E300-N302 PolarHBondContact O-N 3.01Å; E300-M361 HydrophobicContact CG-CB 4.25Å; E300-M361 HydrophobicContact CG-SD 4.4Å
301	S	79.8	Confident	86.7	Confident	51 Å²	51	45 Å²	45	36%	0.357	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27	-175.5	79.5	0	0	0	0	113.1	N281 S299	N281-S301 PolarHBondContact ND2-OG 3.42Å; N281-S301 PolarHBondContact OD1-OG 2.91Å; N281-S301 VanDerWaalsContact OD1-OG 3.05Å; S299-S301 PolarHBondContact O-N 3.21Å; S299-S301 VanDerWaalsContact O-N 3.1Å; S299-S301 PolarHBondContact OG-OG 2.98Å; S299-S301 VanDerWaalsContact OG-OG 3.14Å
302	N	83.9	Confident	87.1	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.011	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-1.9	-177.2	70.3	24	0	0	0	114.4	V277 E297 S299 E300 V304 Q305	V277-N302 HydrophobicContact CG1-CB 3.95Å; E297-N302 PolarHBondContact O-ND2 2.77Å; S299-N302 PolarHBondContact N-OD1 3.29Å; S299-N302 PolarHBondContact O-N 2.98Å; S299-N302 VanDerWaalsContact O-N 3.15Å; S299-N302 PolarHBondContact O-OD1 2.8Å; S299-N302 VanDerWaalsContact O-OD1 3.04Å; E300-N302 VanDerWaalsContact C-N 3.31Å; E300-N302 PolarHBondContact O-N 3.01Å; N302-V304 PolarHBondContact O-N 3.22Å; N302-Q305 VanDerWaalsContact O-CB 3.25Å; N302-Q305 WeakPolarHBondContact O-CB 3.18Å; N302-Q305 WeakPolarHBondContact O-CG 3.3Å; N302-Q305 PolarHBondContact O-N 3.08Å
303	A	85.6	Confident	87.7	Confident	16 Å²	16	37 Å²	37	13%	0.132	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-51.8	-29.1	177.6	0	0	0	0	0	113.9	S299 Q305 L306 M361	S299-A303 PolarHBondContact O-N 3.16Å; A303-Q305 PolarHBondContact O-N 2.85Å; A303-Q305 VanDerWaalsContact O-N 3.15Å; A303-L306 VanDerWaalsContact O-CB 3.26Å; A303-L306 WeakPolarHBondContact O-CB 3.47Å; A303-L306 WeakPolarHBondContact O-CG 3.26Å; A303-L306 PolarHBondContact O-N 3.42Å; A303-M361 HydrophobicContact CB-CE 3.49Å; A303-M361 VanDerWaalsContact CB-CE 3.49Å; A303-M361 HydrophobicContact CB-SD 3.72Å
304	V	81.1	Confident	88.2	Confident	94 Å²	94	32.8 Å²	32.8	57%	0.57	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-58	-26	174.2	-63.4	0	0	0	0	113.4	N302 L306 H307	N302-V304 PolarHBondContact O-N 3.22Å; V304-L306 PolarHBondContact O-N 2.8Å; V304-H307 PolarHBondContact O-N 3.25Å
305	Q	83.9	Confident	88.3	Confident	8 Å²	8	31.4 Å²	31.4	4%	0.037	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-68.9	-21.5	177.9	-62.8	-173.6	41.9	0	0	112.6	N302 A303 H307 E308 L352 F354	N302-Q305 VanDerWaalsContact O-CB 3.25Å; N302-Q305 WeakPolarHBondContact O-CB 3.18Å; N302-Q305 WeakPolarHBondContact O-CG 3.3Å; N302-Q305 PolarHBondContact O-N 3.08Å; A303-Q305 PolarHBondContact O-N 2.85Å; A303-Q305 VanDerWaalsContact O-N 3.15Å; Q305-H307 PolarHBondContact O-N 3.34Å; Q305-H307 VanDerWaalsContact O-N 3.09Å; Q305-E308 WeakPolarHBondContact O-CB 3.48Å; Q305-E308 PolarHBondContact O-N 3.34Å; Q305-L352 HydrophobicContact CB-CD1 4.24Å; Q305-F354 HydrophobicContact CB-CZ 4.04Å
306	L	87.3	Confident	88.2	Confident	6 Å²	6	32.2 Å²	32.2	3%	0.031	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-60.5	-19.9	173.9	-63.6	173.6	0	0	0	112.8	L298 A303 V304 C311 V313 F354 M361 L365 M383	L298-L306 HydrophobicContact CD1-CD1 3.92Å; L298-L306 HydrophobicContact CD1-CD2 4.32Å; L298-L306 HydrophobicContact CD1-CG 4.22Å; A303-L306 VanDerWaalsContact O-CB 3.26Å; A303-L306 WeakPolarHBondContact O-CB 3.47Å; A303-L306 WeakPolarHBondContact O-CG 3.26Å; A303-L306 PolarHBondContact O-N 3.42Å; V304-L306 PolarHBondContact O-N 2.8Å; L306-C311 HydrophobicContact CD2-CB 3.9Å; L306-V313 HydrophobicContact CD2-CG2 4.41Å; L306-F354 HydrophobicContact CD2-CD2 4.27Å; L306-F354 HydrophobicContact CD2-CE2 4.16Å; L306-M361 HydrophobicContact CD1-CE 4.5Å; L306-L365 HydrophobicContact CD1-CD1 3.79Å; L306-L365 HydrophobicContact CD1-CD2 3.89Å; L306-L365 HydrophobicContact CD1-CG 4.45Å; L306-M383 HydrophobicContact CB-CE 4.49Å; L306-M383 HydrophobicContact CB-CG 4.44Å; L306-M383 VanDerWaalsContact O-CG 3.24Å; L306-M383 WeakPolarHBondContact O-CG 3.33Å
307	H	81.8	Confident	88.1	Confident	123 Å²	123	36.3 Å²	36.3	57%	0.569	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-93	-6.3	175.6	-66	-75.5	0	0	0	113.8	V304 Q305 G309	V304-H307 PolarHBondContact O-N 3.25Å; Q305-H307 PolarHBondContact O-N 3.34Å; Q305-H307 VanDerWaalsContact O-N 3.09Å; H307-G309 VanDerWaalsContact C-N 3.33Å
308	E	78	Confident	87.6	Confident	68 Å²	68	35.2 Å²	35.2	32%	0.318	20%	0.195	S	C	.	.	S	Bend	trans	-80.7	-15.6	-177.9	-66.8	-173.3	-177.5	0	0	113.3	K111 Q274 Q305	K111-E308 VanDerWaalsContact CD-O 3.3Å; K111-E308 WeakPolarHBondContact CD-O 3.3Å; K111-E308 WeakPolarHBondContact CE-O 3.41Å; K111-E308 PolarHBondContact NZ-O 3.06Å; Q274-E308 PolarHBondContact NE2-OE1 3.02Å; Q274-E308 PolarHBondContact NE2-OE2 3.34Å; Q305-E308 WeakPolarHBondContact O-CB 3.48Å; Q305-E308 PolarHBondContact O-N 3.34Å
309	G	82.9	Confident	86.5	Confident	15 Å²	15	42.9 Å²	42.9	16%	0.155	23%	0.231	C	C	.	.	S	Bend	trans	167.2	-173.3	176.9	0	0	0	0	0	111.5	H307 C311	H307-G309 VanDerWaalsContact C-N 3.33Å; G309-C311 PolarHBondContact O-N 2.67Å; G309-C311 PolarHBondContact O-SG 3.44Å
310	P	91.6	Very high	85.6	Confident	27 Å²	27	47.7 Å²	47.7	18%	0.175	25%	0.249	C	C	.	.			trans	-57	138	172.3	-23.7	34.4	0	0	0	111.5	L351 L352 I380 L381 D382 F408	P310-L351 HydrophobicContact CB-CD1 3.85Å; P310-L351 WeakPolarHBondContact O-CA 3.29Å; P310-L352 PolarHBondContact O-N 3.06Å; P310-I380 HydrophobicContact CB-CG2 4.4Å; P310-L381 CarbonylContact C-O 3.54Å; P310-L381 WeakPolarHBondContact CA-O 3.49Å; P310-D382 HydrophobicContact CB-CB 4.47Å; P310-D382 HydrophobicContact CG-CB 4.37Å; P310-F408 HydrophobicContact CB-CE1 3.72Å; P310-F408 HydrophobicContact CB-CZ 3.56Å; P310-F408 HydrophobicContact CG-CE1 4.1Å; P310-F408 HydrophobicContact CG-CZ 3.8Å
311	C	95.4	Very high	84.4	Confident	1 Å²	1	47 Å²	47	1%	0.007	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.1	-179.5	-61.3	0	0	0	0	109.5	L306 G309 V313 L352 F354 I380 L381	L306-C311 HydrophobicContact CD2-CB 3.9Å; G309-C311 PolarHBondContact O-N 2.67Å; G309-C311 PolarHBondContact O-SG 3.44Å; C311-V313 HydrophobicContact CB-CG2 4.41Å; C311-L352 CarbonylContact C-O 3.59Å; C311-L352 WeakPolarHBondContact CA-O 3.32Å; C311-F354 HydrophobicContact CB-CD2 4.01Å; C311-F354 HydrophobicContact CB-CE2 4.03Å; C311-I380 CarbonylContact O-C 3.59Å; C311-I380 WeakPolarHBondContact O-CA 3.29Å; C311-L381 PolarHBondContact N-O 3.49Å; C311-L381 PolarHBondContact O-N 2.99Å
312	L	97.8	Very high	83.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.4	163.6	-176.5	147.4	0	0	0	108	I331 L351 L352 F353 F354 L378 T379 I380 V401 V405	L312-I331 HydrophobicContact CD2-CD1 4.01Å; L312-L351 HydrophobicContact CB-CD1 4.28Å; L312-L351 HydrophobicContact CB-CD2 4.15Å; L312-L351 HydrophobicContact CB-CG 4.25Å; L312-L352 PolarHBondContact N-O 2.53Å; L312-F353 HydrophobicContact CB-CD1 4.12Å; L312-F353 HydrophobicContact CB-CE1 4.26Å; L312-F353 HydrophobicContact CD1-CD1 4.32Å; L312-F353 HydrophobicContact CD1-CE1 3.93Å; L312-F353 HydrophobicContact CD2-CD1 3.9Å; L312-F353 HydrophobicContact CD2-CE1 4.33Å; L312-F353 HydrophobicContact CG-CD1 4.34Å; L312-F353 HydrophobicContact CG-CE1 4.42Å; L312-F354 PolarHBondContact O-N 2.82Å; L312-L378 HydrophobicContact CD1-CD1 4.05Å; L312-L378 HydrophobicContact CD2-CD1 3.76Å; L312-L378 HydrophobicContact CG-CD1 4Å; L312-T379 CarbonylContact C-O 3.48Å; L312-T379 VanDerWaalsContact CA-O 3.27Å; L312-T379 WeakPolarHBondContact CA-O 3.45Å; L312-I380 HydrophobicContact CB-CG1 4.09Å; L312-I380 HydrophobicContact CD1-CG1 4.24Å; L312-I380 HydrophobicContact CG-CG1 4.28Å; L312-V401 HydrophobicContact CD1-CG1 4.23Å; L312-V405 HydrophobicContact CD1-CG2 3.36Å
313	V	97	Very high	83.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	117.8	175.7	-169.1	0	0	0	0	108.2	L306 C311 F315 F354 A356 T379 L381	L306-V313 HydrophobicContact CD2-CG2 4.41Å; C311-V313 HydrophobicContact CB-CG2 4.41Å; V313-F315 HydrophobicContact CB-CD2 4.42Å; V313-F315 HydrophobicContact CB-CE2 3.87Å; V313-F315 HydrophobicContact CB-CZ 4.27Å; V313-F315 HydrophobicContact CG1-CD1 4.45Å; V313-F315 HydrophobicContact CG1-CD2 3.98Å; V313-F315 HydrophobicContact CG1-CE1 4.1Å; V313-F315 HydrophobicContact CG1-CE2 3.59Å; V313-F315 HydrophobicContact CG1-CG 4.39Å; V313-F315 HydrophobicContact CG1-CZ 3.66Å; V313-F354 WeakPolarHBondContact CA-O 3.38Å; V313-F354 HydrophobicContact CG1-CB 4.3Å; V313-F354 HydrophobicContact CG2-CB 4.26Å; V313-A356 HydrophobicContact CG1-CB 3.79Å; V313-T379 PolarHBondContact N-O 3.49Å; V313-T379 PolarHBondContact O-N 2.84Å; V313-T379 PolarHBondContact O-OG1 2.82Å; V313-T379 VanDerWaalsContact O-OG1 3.11Å; V313-L381 HydrophobicContact CG2-CD1 4Å; V313-L381 HydrophobicContact CG2-CG 4.48Å
314	L	96.4	Very high	83.3	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	106.6	169.9	172.9	56.6	0	0	0	108.3	V316 A327 L330 I331 F354 V355 A356 L378 I396	L314-V316 HydrophobicContact CD1-CG1 4.4Å; L314-V316 HydrophobicContact CG-CG1 4.2Å; L314-A327 HydrophobicContact CD2-CB 3.88Å; L314-L330 HydrophobicContact CD2-CD2 4.06Å; L314-I331 HydrophobicContact CB-CD1 4.22Å; L314-I331 HydrophobicContact CD2-CG2 3.77Å; L314-F354 PolarHBondContact N-O 3.37Å; L314-V355 CarbonylContact O-C 3.51Å; L314-V355 VanDerWaalsContact O-CA 3.31Å; L314-V355 WeakPolarHBondContact O-CA 3.41Å; L314-A356 PolarHBondContact O-N 3.37Å; L314-L378 HydrophobicContact CB-CD1 4.39Å; L314-L378 HydrophobicContact CD1-CD1 4.45Å; L314-I396 HydrophobicContact CD1-CD1 3.35Å; L314-I396 HydrophobicContact CD1-CG2 4.32Å
315	F	94.3	Very high	83.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	139.7	172.7	-59.8	-95.7	0	0	0	110.4	V313 A356 L365 R366 L371 P376 L377 T379	V313-F315 HydrophobicContact CB-CD2 4.42Å; V313-F315 HydrophobicContact CB-CE2 3.87Å; V313-F315 HydrophobicContact CB-CZ 4.27Å; V313-F315 HydrophobicContact CG1-CD1 4.45Å; V313-F315 HydrophobicContact CG1-CD2 3.98Å; V313-F315 HydrophobicContact CG1-CE1 4.1Å; V313-F315 HydrophobicContact CG1-CE2 3.59Å; V313-F315 HydrophobicContact CG1-CG 4.39Å; V313-F315 HydrophobicContact CG1-CZ 3.66Å; F315-A356 CarbonylContact C-O 3.56Å; F315-A356 VanDerWaalsContact CA-O 3.29Å; F315-A356 WeakPolarHBondContact CA-O 3.22Å; F315-A356 HydrophobicContact CD1-CB 3.49Å; F315-A356 VanDerWaalsContact CD1-CB 3.49Å; F315-A356 HydrophobicContact CE1-CB 3.75Å; F315-A356 HydrophobicContact CG-CB 4.18Å; F315-L365 HydrophobicContact CE1-CD2 4.42Å; F315-L365 HydrophobicContact CZ-CD2 3.96Å; F315-L365 HydrophobicContact CZ-CG 4.4Å; F315-R366 HydrophobicContact CD1-CG 4.2Å; F315-R366 VanDerWaalsContact CD1-NE 3.31Å; F315-R366 HydrophobicContact CE1-CG 3.69Å; F315-R366 VanDerWaalsContact CG-CZ 3.46Å; F315-R366 HydrophobicContact CZ-CG 3.97Å; F315-L371 HydrophobicContact CE2-CD1 3.68Å; F315-L371 HydrophobicContact CZ-CD1 3.89Å; F315-P376 CarbonylContact O-C 3.49Å; F315-P376 WeakPolarHBondContact O-CA 3.48Å; F315-L377 HydrophobicContact CB-CB 4.2Å; F315-L377 HydrophobicContact CD2-CB 4.34Å; F315-L377 HydrophobicContact CD2-CD2 4.34Å; F315-L377 PolarHBondContact N-O 3.35Å; F315-L377 PolarHBondContact O-N 2.97Å; F315-T379 HydrophobicContact CD2-CG2 4.47Å; F315-T379 HydrophobicContact CE2-CG2 4.29Å
316	V	92.3	Very high	84	Confident	26 Å²	26	55.8 Å²	55.8	16%	0.158	30%	0.297	C	S	.	.			trans	-138.6	148.1	178.2	-72.4	0	0	0	0	110.2	L314 T318 L324 A327 V355 A356 P376	L314-V316 HydrophobicContact CD1-CG1 4.4Å; L314-V316 HydrophobicContact CG-CG1 4.2Å; V316-T318 HydrophobicContact CG2-CG2 3.91Å; V316-T318 PolarHBondContact O-N 2.94Å; V316-L324 HydrophobicContact CG2-CD2 3.35Å; V316-A327 HydrophobicContact CG1-CB 3.92Å; V316-A327 HydrophobicContact CG2-CB 4.31Å; V316-V355 HydrophobicContact CG2-CG1 3.88Å; V316-A356 PolarHBondContact N-O 3.29Å; V316-P376 HydrophobicContact CG1-CB 4.24Å
317	D	87.5	Confident	84.3	Confident	99 Å²	99	56 Å²	56	53%	0.529	30%	0.3	S	S	.	.	S	Bend	trans	-79.8	84.8	179.1	-65.8	-17	0	0	0	109.7	A375	D317-A375 WeakPolarHBondContact OD1-CB 3.45Å
318	T	79.9	Confident	84.9	Confident	11 Å²	11	51.2 Å²	51.2	7%	0.067	28%	0.277	C	S	.	.			trans	-154	139.4	169.9	176.2	0	0	0	0	111.9	V316 E320 E323 L324 G357 E358	V316-T318 HydrophobicContact CG2-CG2 3.91Å; V316-T318 PolarHBondContact O-N 2.94Å; T318-E320 PolarHBondContact OG1-N 3.43Å; T318-E323 HydrophobicContact CG2-CB 4.11Å; T318-E323 WeakPolarHBondContact OG1-CB 3.38Å; T318-E323 PolarHBondContact OG1-OE2 3.23Å; T318-L324 HydrophobicContact CG2-CD2 3.27Å; T318-L324 HydrophobicContact CG2-CG 3.97Å; T318-G357 WeakPolarHBondContact O-CA 3.47Å; T318-E358 PolarHBondContact O-N 2.75Å
319	E	68.8	Low	85.7	Confident	162 Å²	162	53.9 Å²	53.9	76%	0.757	29%	0.29	S	S	*	.	S	Bend	trans	-92.8	-7.8	178.2	-61.3	-177.7	170.6	0	0	112.7	E358	E319-E358 HydrophobicContact CG-CB 4.15Å
320	E	67.2	Low	86.3	Confident	133 Å²	133	55.3 Å²	55.3	62%	0.621	29%	0.294	S	S	*	.	S	Bend	trans	-114.7	130.4	-173.2	-67.3	-167.6	-174.2	0	0	113.9	T318 G322 E323	T318-E320 PolarHBondContact OG1-N 3.43Å; E320-G322 PolarHBondContact O-N 3.37Å; E320-G322 VanDerWaalsContact O-N 3.1Å; E320-E323 HydrophobicContact CB-CG 4.11Å; E320-E323 WeakPolarHBondContact O-CB 3.43Å; E320-E323 PolarHBondContact O-N 2.8Å
321	E	59.6	Low	86.5	Confident	144 Å²	144	54 Å²	54	67%	0.673	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-54.4	-32.9	-177.5	-173.4	171.1	-167.4	0	0	114.1	E297 E323	E297-E321 WeakPolarHBondContact OE2-CG 3.31Å; E321-E323 VanDerWaalsContact C-N 3.35Å
322	G	62.5	Low	86.6	Confident	64 Å²	64	57 Å²	57	66%	0.66	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-76.6	-18.1	178.3	0	0	0	0	0	114.7	E320	E320-G322 PolarHBondContact O-N 3.37Å; E320-G322 VanDerWaalsContact O-N 3.1Å
323	E	76.6	Confident	86.5	Confident	114 Å²	114	60.6 Å²	60.6	53%	0.533	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-88.8	-8.6	-179.7	-67.3	-167.6	166.4	0	0	112.5	T318 E320 E321 E325 P326	T318-E323 HydrophobicContact CG2-CB 4.11Å; T318-E323 WeakPolarHBondContact OG1-CB 3.38Å; T318-E323 PolarHBondContact OG1-OE2 3.23Å; E320-E323 HydrophobicContact CB-CG 4.11Å; E320-E323 WeakPolarHBondContact O-CB 3.43Å; E320-E323 PolarHBondContact O-N 2.8Å; E321-E323 VanDerWaalsContact C-N 3.35Å; E323-E325 VanDerWaalsContact C-N 3.32Å; E323-P326 WeakPolarHBondContact O-CD 3.41Å
324	L	87.6	Confident	86.5	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-78.4	-15.5	172.1	-61.6	176	0	0	0	113.1	E297 V316 T318 A327 K328 V355	E297-L324 HydrophobicContact CG-CD1 3.67Å; V316-L324 HydrophobicContact CG2-CD2 3.35Å; T318-L324 HydrophobicContact CG2-CD2 3.27Å; T318-L324 HydrophobicContact CG2-CG 3.97Å; L324-A327 WeakPolarHBondContact O-CB 3.39Å; L324-A327 PolarHBondContact O-N 2.83Å; L324-A327 VanDerWaalsContact O-N 3.11Å; L324-K328 WeakPolarHBondContact O-CG 3.24Å; L324-K328 PolarHBondContact O-N 3.15Å; L324-V355 HydrophobicContact CB-CG1 4.29Å; L324-V355 HydrophobicContact CD2-CG1 3.85Å
325	E	89	Confident	86.5	Confident	88 Å²	88	61 Å²	61	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-57.8	-44	-174.8	-163.2	64.2	-166.3	0	0	113.6	E323 A327 K328 E329	E323-E325 VanDerWaalsContact C-N 3.32Å; E325-A327 VanDerWaalsContact C-N 3.27Å; E325-A327 PolarHBondContact O-N 2.81Å; E325-K328 WeakPolarHBondContact O-CB 3.24Å; E325-K328 PolarHBondContact O-N 3.01Å; E325-K328 VanDerWaalsContact O-N 3.09Å; E325-E329 HydrophobicContact CG-CG 4.47Å; E325-E329 WeakPolarHBondContact O-CG 3.36Å; E325-E329 PolarHBondContact O-N 2.68Å
326	P	91.5	Very high	86.5	Confident	83 Å²	83	65.2 Å²	65.2	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-60.1	-36.3	176.2	-23.7	35.5	0	0	0	113.1	E323 L330	E323-P326 WeakPolarHBondContact O-CD 3.41Å; P326-L330 WeakPolarHBondContact O-CB 3.43Å; P326-L330 PolarHBondContact O-N 3.24Å
327	A	93.2	Very high	86.7	Confident	11 Å²	11	69.9 Å²	69.9	9%	0.091	36%	0.363	C	S	.	.	H	α-helix	trans	-71.5	-35.5	176.8	0	0	0	0	0	111.7	L314 V316 L324 E325 L330 I331 V355	L314-A327 HydrophobicContact CD2-CB 3.88Å; V316-A327 HydrophobicContact CG1-CB 3.92Å; V316-A327 HydrophobicContact CG2-CB 4.31Å; L324-A327 WeakPolarHBondContact O-CB 3.39Å; L324-A327 PolarHBondContact O-N 2.83Å; L324-A327 VanDerWaalsContact O-N 3.11Å; E325-A327 VanDerWaalsContact C-N 3.27Å; E325-A327 PolarHBondContact O-N 2.81Å; A327-L330 WeakPolarHBondContact O-CB 3.42Å; A327-L330 PolarHBondContact O-N 2.78Å; A327-I331 PolarHBondContact O-N 2.83Å; A327-V355 HydrophobicContact CB-CG1 3.63Å; A327-V355 HydrophobicContact CB-CG2 4.17Å
328	K	93.8	Very high	87	Confident	22 Å²	22	65.8 Å²	65.8	10%	0.096	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-51.3	171.8	-68.3	169.2	-177.8	160.7	0	110.2	V295 E297 L324 E325 L330 I331 Q332 V355	V295-K328 HydrophobicContact CG1-CB 4.36Å; V295-K328 HydrophobicContact CG1-CG 4.1Å; E297-K328 IonicContact OE2-NZ 2.73Å; E297-K328 PolarHBondContact OE2-NZ 3.03Å; L324-K328 WeakPolarHBondContact O-CG 3.24Å; L324-K328 PolarHBondContact O-N 3.15Å; E325-K328 WeakPolarHBondContact O-CB 3.24Å; E325-K328 PolarHBondContact O-N 3.01Å; E325-K328 VanDerWaalsContact O-N 3.09Å; K328-L330 PolarHBondContact O-N 3.18Å; K328-I331 PolarHBondContact O-N 2.99Å; K328-Q332 WeakPolarHBondContact O-CB 3.27Å; K328-Q332 PolarHBondContact O-N 3.29Å; K328-V355 HydrophobicContact CB-CG2 4.44Å; K328-V355 HydrophobicContact CG-CB 4.24Å; K328-V355 HydrophobicContact CG-CG2 3.74Å
329	E	94.4	Very high	87.5	Confident	124 Å²	124	67.6 Å²	67.6	58%	0.579	35%	0.349	S	S	*	.	H	α-helix	trans	-57.5	-35.7	177.5	-72.4	-176.1	162.8	0	0	112.5	E325 P333	E325-E329 HydrophobicContact CG-CG 4.47Å; E325-E329 WeakPolarHBondContact O-CG 3.36Å; E325-E329 PolarHBondContact O-N 2.68Å; E329-P333 WeakPolarHBondContact O-CD 3.36Å
330	L	95.4	Very high	88.6	Confident	45 Å²	45	62.7 Å²	62.7	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-61.3	-43.8	178.2	-173.3	77.7	0	0	0	112.7	L314 P326 A327 K328 I334 I396 P398	L314-L330 HydrophobicContact CD2-CD2 4.06Å; P326-L330 WeakPolarHBondContact O-CB 3.43Å; P326-L330 PolarHBondContact O-N 3.24Å; A327-L330 WeakPolarHBondContact O-CB 3.42Å; A327-L330 PolarHBondContact O-N 2.78Å; K328-L330 PolarHBondContact O-N 3.18Å; L330-I334 WeakPolarHBondContact O-CD1 3.45Å; L330-I396 HydrophobicContact CD2-CB 4.4Å; L330-I396 HydrophobicContact CD2-CG2 3.83Å; L330-P398 HydrophobicContact CD1-CG 3.8Å
331	I	96.9	Very high	89.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-100.5	-16.8	-173	71.7	-179	0	0	0	113.4	V295 L312 L314 A327 K328 I334 A335 F353 V355 V401	V295-I331 HydrophobicContact CB-CG1 4.49Å; V295-I331 HydrophobicContact CG1-CD1 3.76Å; V295-I331 HydrophobicContact CG1-CG1 3.9Å; V295-I331 HydrophobicContact CG2-CD1 4.33Å; V295-I331 HydrophobicContact CG2-CG1 3.71Å; L312-I331 HydrophobicContact CD2-CD1 4.01Å; L314-I331 HydrophobicContact CB-CD1 4.22Å; L314-I331 HydrophobicContact CD2-CG2 3.77Å; A327-I331 PolarHBondContact O-N 2.83Å; K328-I331 PolarHBondContact O-N 2.99Å; I331-I334 WeakPolarHBondContact O-CB 3.46Å; I331-I334 PolarHBondContact O-N 3.05Å; I331-I334 VanDerWaalsContact O-N 3.15Å; I331-A335 PolarHBondContact O-N 3.39Å; I331-A335 VanDerWaalsContact O-N 3.1Å; I331-F353 HydrophobicContact CD1-CB 4.48Å; I331-F353 HydrophobicContact CD1-CD1 4.39Å; I331-V355 HydrophobicContact CD1-CG2 3.81Å; I331-V355 HydrophobicContact CG1-CG2 4.49Å; I331-V401 HydrophobicContact CB-CG1 4.34Å; I331-V401 HydrophobicContact CG2-CG1 3.98Å; I331-V401 HydrophobicContact CG2-CG2 4Å
332	Q	96.4	Very high	91.2	Very high	64 Å²	64	56.5 Å²	56.5	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-56.4	-46.7	-177.7	171	172.6	-18.1	0	0	114.2	P294 V295 K328 I334 A335 E336	P294-Q332 HydrophobicContact CB-CG 4.2Å; P294-Q332 HydrophobicContact CG-CG 4.34Å; V295-Q332 VanDerWaalsContact CG2-CA 3.5Å; V295-Q332 HydrophobicContact CG2-CB 3.79Å; K328-Q332 WeakPolarHBondContact O-CB 3.27Å; K328-Q332 PolarHBondContact O-N 3.29Å; Q332-I334 PolarHBondContact O-N 3.41Å; Q332-A335 WeakPolarHBondContact O-CB 3.47Å; Q332-A335 PolarHBondContact O-N 2.89Å; Q332-A335 VanDerWaalsContact O-N 3.1Å; Q332-E336 HydrophobicContact CG-CG 4.13Å; Q332-E336 WeakPolarHBondContact CG-OE1 3.04Å; Q332-E336 PolarHBondContact NE2-OE1 2.76Å; Q332-E336 WeakPolarHBondContact O-CG 3.42Å; Q332-E336 PolarHBondContact O-N 2.79Å
333	P	96.9	Very high	92.4	Very high	76 Å²	76	61.6 Å²	61.6	49%	0.494	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-32.3	179.1	-25.6	34.7	0	0	0	113.2	E329 K337	E329-P333 WeakPolarHBondContact O-CD 3.36Å; P333-K337 VanDerWaalsContact O-CB 3.29Å; P333-K337 WeakPolarHBondContact O-CB 3.31Å; P333-K337 PolarHBondContact O-N 3.45Å; P333-K337 VanDerWaalsContact O-N 3.12Å
334	I	97	Very high	92.9	Very high	10 Å²	10	60.4 Å²	60.4	5%	0.051	32%	0.318	C	S	.	.	H	α-helix	trans	-71.3	-46.2	176.9	-61.8	91.8	0	0	0	109.9	L330 I331 Q332 K337 I338 F353 P398 V401 E402 V405	L330-I334 WeakPolarHBondContact O-CD1 3.45Å; I331-I334 WeakPolarHBondContact O-CB 3.46Å; I331-I334 PolarHBondContact O-N 3.05Å; I331-I334 VanDerWaalsContact O-N 3.15Å; Q332-I334 PolarHBondContact O-N 3.41Å; I334-K337 PolarHBondContact O-N 3Å; I334-I338 HydrophobicContact CG2-CD1 3.93Å; I334-I338 WeakPolarHBondContact O-CD1 3.07Å; I334-I338 WeakPolarHBondContact O-CG1 3.13Å; I334-I338 PolarHBondContact O-N 2.94Å; I334-I338 VanDerWaalsContact O-N 3.11Å; I334-F353 HydrophobicContact CG2-CE1 4.25Å; I334-F353 HydrophobicContact CG2-CZ 4.36Å; I334-P398 HydrophobicContact CD1-CB 4.17Å; I334-V401 HydrophobicContact CD1-CB 4.43Å; I334-V401 HydrophobicContact CD1-CG1 4.28Å; I334-V401 HydrophobicContact CG1-CG1 4.36Å; I334-V401 HydrophobicContact CG2-CG1 4.5Å; I334-E402 HydrophobicContact CG1-CB 4.07Å; I334-V405 HydrophobicContact CG2-CG2 4.38Å
335	A	96.1	Very high	92.7	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-48	177.2	0	0	0	0	0	111.8	P294 V295 I331 Q332 K337 I338 M339 F353	P294-A335 HydrophobicContact CB-CB 3.78Å; P294-A335 VanDerWaalsContact O-CB 3.26Å; P294-A335 WeakPolarHBondContact O-CB 3.17Å; V295-A335 HydrophobicContact CG2-CB 4.1Å; I331-A335 PolarHBondContact O-N 3.39Å; I331-A335 VanDerWaalsContact O-N 3.1Å; Q332-A335 WeakPolarHBondContact O-CB 3.47Å; Q332-A335 PolarHBondContact O-N 2.89Å; Q332-A335 VanDerWaalsContact O-N 3.1Å; A335-K337 PolarHBondContact O-N 3.42Å; A335-I338 PolarHBondContact O-N 3.41Å; A335-M339 WeakPolarHBondContact O-CG 3.43Å; A335-M339 PolarHBondContact O-N 3.37Å; A335-F353 HydrophobicContact CB-CB 4.12Å; A335-F353 HydrophobicContact CB-CD1 3.91Å; A335-F353 HydrophobicContact CB-CD2 3.58Å; A335-F353 HydrophobicContact CB-CE1 4.25Å; A335-F353 HydrophobicContact CB-CE2 3.96Å; A335-F353 HydrophobicContact CB-CG 3.59Å; A335-F353 HydrophobicContact CB-CZ 4.29Å
336	E	95.1	Very high	92.2	Very high	88 Å²	88	68.9 Å²	68.9	41%	0.411	36%	0.356	S	S	.	.	H	α-helix	trans	-58.7	-45.4	177.2	-73.8	177.7	175	0	0	112.2	P294 Q332 I338 M339 A340	P294-E336 HydrophobicContact CB-CG 3.68Å; P294-E336 HydrophobicContact CG-CG 3.37Å; Q332-E336 HydrophobicContact CG-CG 4.13Å; Q332-E336 WeakPolarHBondContact CG-OE1 3.04Å; Q332-E336 PolarHBondContact NE2-OE1 2.76Å; Q332-E336 WeakPolarHBondContact O-CG 3.42Å; Q332-E336 PolarHBondContact O-N 2.79Å; E336-I338 VanDerWaalsContact C-N 3.28Å; E336-I338 PolarHBondContact O-N 2.87Å; E336-M339 PolarHBondContact O-N 3.19Å; E336-A340 VanDerWaalsContact O-CB 3.28Å; E336-A340 WeakPolarHBondContact O-CB 3.08Å; E336-A340 PolarHBondContact O-N 3.3Å
337	K	95.2	Very high	91.5	Very high	124 Å²	124	69 Å²	69	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-40.7	177.5	-177.5	179	-179.4	179.3	0	111.6	P333 I334 A335 K341 E402	P333-K337 VanDerWaalsContact O-CB 3.29Å; P333-K337 WeakPolarHBondContact O-CB 3.31Å; P333-K337 PolarHBondContact O-N 3.45Å; P333-K337 VanDerWaalsContact O-N 3.12Å; I334-K337 PolarHBondContact O-N 3Å; A335-K337 PolarHBondContact O-N 3.42Å; K337-K341 VanDerWaalsContact O-CB 3.31Å; K337-K341 WeakPolarHBondContact O-CB 3.36Å; K337-K341 PolarHBondContact O-N 3.21Å; K337-K341 VanDerWaalsContact O-N 3.09Å; K337-E402 IonicContact NZ-OE1 3.42Å; K337-E402 PolarHBondContact NZ-OE1 2.92Å
338	I	93.7	Very high	90.8	Very high	14 Å²	14	73.2 Å²	73.2	7%	0.072	37%	0.367	C	S	.	.	H	α-helix	trans	-71.6	-48.4	178.3	-67	162.9	0	0	0	110.2	I334 A335 E336 A340 K341 Y342 T349 P350 F353 V405	I334-I338 HydrophobicContact CG2-CD1 3.93Å; I334-I338 WeakPolarHBondContact O-CD1 3.07Å; I334-I338 WeakPolarHBondContact O-CG1 3.13Å; I334-I338 PolarHBondContact O-N 2.94Å; I334-I338 VanDerWaalsContact O-N 3.11Å; A335-I338 PolarHBondContact O-N 3.41Å; E336-I338 VanDerWaalsContact C-N 3.28Å; E336-I338 PolarHBondContact O-N 2.87Å; I338-A340 VanDerWaalsContact C-N 3.32Å; I338-A340 PolarHBondContact O-N 3.48Å; I338-K341 WeakPolarHBondContact O-CB 3.42Å; I338-K341 PolarHBondContact O-N 3.19Å; I338-K341 VanDerWaalsContact O-N 3.15Å; I338-Y342 HydrophobicContact CG2-CD2 3.88Å; I338-Y342 HydrophobicContact CG2-CE2 4.04Å; I338-Y342 WeakPolarHBondContact O-CD2 3.34Å; I338-Y342 PolarHBondContact O-N 2.91Å; I338-T349 HydrophobicContact CG2-CG2 3.89Å; I338-P350 HydrophobicContact CG2-CG 4.31Å; I338-F353 HydrophobicContact CD1-CE2 4.08Å; I338-F353 HydrophobicContact CD1-CZ 3.6Å; I338-V405 HydrophobicContact CD1-CB 4.44Å; I338-V405 HydrophobicContact CD1-CG1 3.34Å
339	M	91.7	Very high	90.4	Very high	48 Å²	48	74.4 Å²	74.4	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-55.8	-46.9	176.7	-72.8	175.1	69.5	0	0	111.7	P292 P294 A335 E336 K341 Y342 K343 T349	P292-M339 HydrophobicContact CB-CE 4.09Å; P294-M339 VanDerWaalsContact CA-SD 3.54Å; P294-M339 HydrophobicContact CB-SD 3.97Å; P294-M339 HydrophobicContact CG-SD 4.33Å; A335-M339 WeakPolarHBondContact O-CG 3.43Å; A335-M339 PolarHBondContact O-N 3.37Å; E336-M339 PolarHBondContact O-N 3.19Å; M339-K341 PolarHBondContact O-N 3.11Å; M339-Y342 PolarHBondContact O-N 3.37Å; M339-K343 WeakPolarHBondContact O-CB 3.35Å; M339-K343 PolarHBondContact O-N 3.36Å; M339-T349 HydrophobicContact CG-CG2 3.95Å
340	A	91.6	Very high	90.1	Very high	60 Å²	60	70.4 Å²	70.4	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-61.7	-43	177.5	0	0	0	0	0	112.1	E336 I338 Y342 A344	E336-A340 VanDerWaalsContact O-CB 3.28Å; E336-A340 WeakPolarHBondContact O-CB 3.08Å; E336-A340 PolarHBondContact O-N 3.3Å; I338-A340 VanDerWaalsContact C-N 3.32Å; I338-A340 PolarHBondContact O-N 3.48Å; A340-Y342 PolarHBondContact O-N 2.92Å; A340-A344 WeakPolarHBondContact O-CB 3.45Å; A340-A344 PolarHBondContact O-N 3.46Å
341	K	92.7	Very high	89.9	Confident	110 Å²	110	68.3 Å²	68.3	48%	0.478	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-42.8	177.8	178.6	-174.5	177.2	-173.2	0	112.5	K337 I338 M339 K345	K337-K341 VanDerWaalsContact O-CB 3.31Å; K337-K341 WeakPolarHBondContact O-CB 3.36Å; K337-K341 PolarHBondContact O-N 3.21Å; K337-K341 VanDerWaalsContact O-N 3.09Å; I338-K341 WeakPolarHBondContact O-CB 3.42Å; I338-K341 PolarHBondContact O-N 3.19Å; I338-K341 VanDerWaalsContact O-N 3.15Å; M339-K341 PolarHBondContact O-N 3.11Å; K341-K345 WeakPolarHBondContact O-CG 3.19Å
342	Y	88.8	Confident	89.7	Confident	37 Å²	37	70.7 Å²	70.7	15%	0.145	36%	0.362	C	S	.	.	H	α-helix	trans	-83.1	-33.7	-178.7	-78.1	-93.1	0	0	0	112.3	I338 M339 A340 A344 K345 E346 E347 P350	I338-Y342 HydrophobicContact CG2-CD2 3.88Å; I338-Y342 HydrophobicContact CG2-CE2 4.04Å; I338-Y342 WeakPolarHBondContact O-CD2 3.34Å; I338-Y342 PolarHBondContact O-N 2.91Å; M339-Y342 PolarHBondContact O-N 3.37Å; A340-Y342 PolarHBondContact O-N 2.92Å; Y342-A344 VanDerWaalsContact C-N 3.31Å; Y342-A344 PolarHBondContact O-N 3.4Å; Y342-K345 CarbonylContact O-C 3.54Å; Y342-K345 PolarHBondContact O-N 2.84Å; Y342-E346 PolarHBondContact O-N 3.37Å; Y342-E347 CarbonylContact C-O 3.59Å; Y342-E347 HydrophobicContact CD1-CB 3.88Å; Y342-E347 PolarHBondContact O-N 3.48Å; Y342-P350 HydrophobicContact CD2-CG 4.1Å; Y342-P350 HydrophobicContact CE1-CG 4.02Å; Y342-P350 HydrophobicContact CE2-CG 3.57Å
343	K	86.7	Confident	89.7	Confident	170 Å²	170	67.9 Å²	67.9	74%	0.739	35%	0.349	S	S	*	.	H	α-helix	trans	-57.5	-43.7	169.4	-175.2	176.5	-179.1	177.8	0	111.5	M339 K345 E346	M339-K343 WeakPolarHBondContact O-CB 3.35Å; M339-K343 PolarHBondContact O-N 3.36Å; K343-K345 PolarHBondContact O-N 3.22Å; K343-E346 PolarHBondContact O-N 3.35Å
344	A	87.6	Confident	89.6	Confident	90 Å²	90	64.3 Å²	64.3	74%	0.744	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19	176.4	0	0	0	0	0	114	A340 Y342	A340-A344 WeakPolarHBondContact O-CB 3.45Å; A340-A344 PolarHBondContact O-N 3.46Å; Y342-A344 VanDerWaalsContact C-N 3.31Å; Y342-A344 PolarHBondContact O-N 3.4Å
345	K	83.6	Confident	89.5	Confident	103 Å²	103	63.8 Å²	63.8	45%	0.448	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-0.5	175.2	-65.9	179	176.6	-168.6	0	113.3	K127 K341 Y342 K343 E347	K127-K345 PolarHBondContact NZ-O 3.4Å; K341-K345 WeakPolarHBondContact O-CG 3.19Å; Y342-K345 CarbonylContact O-C 3.54Å; Y342-K345 PolarHBondContact O-N 2.84Å; K343-K345 PolarHBondContact O-N 3.22Å; K345-E347 VanDerWaalsContact C-N 3.25Å; K345-E347 HydrophobicContact CB-CB 4.27Å; K345-E347 HydrophobicContact CB-CG 4.02Å; K345-E347 PolarHBondContact O-N 2.92Å
346	E	77.3	Confident	89.4	Confident	168 Å²	168	63.8 Å²	63.8	79%	0.785	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	47.2	-169.8	-55	175.1	171.7	0	0	111.2	K127 Y342 K343	K127-E346 PolarHBondContact NZ-O 3.4Å; Y342-E346 PolarHBondContact O-N 3.37Å; K343-E346 PolarHBondContact O-N 3.35Å
347	E	78.3	Confident	89.3	Confident	86 Å²	86	60 Å²	60	40%	0.402	31%	0.307	S	S	.	.			trans	-122	151.5	178.7	-73.7	174.8	-172.3	0	0	110	Y342 K345	Y342-E347 CarbonylContact C-O 3.59Å; Y342-E347 HydrophobicContact CD1-CB 3.88Å; Y342-E347 PolarHBondContact O-N 3.48Å; K345-E347 VanDerWaalsContact C-N 3.25Å; K345-E347 HydrophobicContact CB-CB 4.27Å; K345-E347 HydrophobicContact CB-CG 4.02Å; K345-E347 PolarHBondContact O-N 2.92Å
348	E	77.5	Confident	89	Confident	99 Å²	99	58.4 Å²	58.4	46%	0.463	30%	0.302	S	S	.	.			trans	-67.1	142.6	172.1	-69	-176.3	-168.1	0	0	110.1	K111 R131	K111-E348 VanDerWaalsContact CE-OE2 3.3Å; K111-E348 WeakPolarHBondContact CE-OE2 3.32Å; K111-E348 IonicContact NZ-OE2 3.43Å; K111-E348 PolarHBondContact NZ-OE2 3.44Å; R131-E348 IonicContact CZ-OE1 3.51Å; R131-E348 IonicContact NH2-OE1 3.91Å; R131-E348 PolarHBondContact NH2-OE1 3.02Å; R131-E348 IonicContact NH2-OE2 3.53Å; R131-E348 PolarHBondContact NH2-OE2 3.26Å
349	T	85.5	Confident	88.7	Confident	47 Å²	47	60.4 Å²	60.4	29%	0.288	31%	0.313	S	S	.	.			trans	-60.9	127.9	174.4	-47.9	0	0	0	0	109.4	I338 M339 L351	I338-T349 HydrophobicContact CG2-CG2 3.89Å; M339-T349 HydrophobicContact CG-CG2 3.95Å; T349-L351 VanDerWaalsContact C-N 3.27Å; T349-L351 WeakPolarHBondContact CG2-O 3.42Å; T349-L351 PolarHBondContact O-N 3.24Å
350	P	87.7	Confident	88.6	Confident	39 Å²	39	64.3 Å²	64.3	25%	0.253	34%	0.335	S	S	.	.	S	Bend	trans	-78.2	-10.4	-173.1	33.5	-40.9	0	0	0	114.1	I338 Y342 L409	I338-P350 HydrophobicContact CG2-CG 4.31Å; Y342-P350 HydrophobicContact CD2-CG 4.1Å; Y342-P350 HydrophobicContact CE1-CG 4.02Å; Y342-P350 HydrophobicContact CE2-CG 3.57Å; P350-L409 HydrophobicContact CB-CD2 3.84Å; P350-L409 HydrophobicContact CG-CD1 4.46Å; P350-L409 HydrophobicContact CG-CD2 3.52Å
351	L	91.5	Very high	88.6	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	32%	0.319	C	S	.	.			trans	-146	126	-172.1	-173.6	65.6	0	0	0	108.9	P310 L312 T349 F353 I380 V405 F408	P310-L351 HydrophobicContact CB-CD1 3.85Å; P310-L351 WeakPolarHBondContact O-CA 3.29Å; L312-L351 HydrophobicContact CB-CD1 4.28Å; L312-L351 HydrophobicContact CB-CD2 4.15Å; L312-L351 HydrophobicContact CB-CG 4.25Å; T349-L351 VanDerWaalsContact C-N 3.27Å; T349-L351 WeakPolarHBondContact CG2-O 3.42Å; T349-L351 PolarHBondContact O-N 3.24Å; L351-F353 HydrophobicContact CB-CE2 4.19Å; L351-F353 HydrophobicContact CD2-CE1 4.43Å; L351-F353 HydrophobicContact CD2-CE2 4.02Å; L351-F353 HydrophobicContact CD2-CZ 3.72Å; L351-F353 HydrophobicContact CG-CE2 4Å; L351-F353 HydrophobicContact CG-CZ 4.2Å; L351-I380 HydrophobicContact CD1-CG1 4.43Å; L351-I380 HydrophobicContact CD1-CG2 3.97Å; L351-I380 HydrophobicContact CD2-CD1 4.36Å; L351-V405 HydrophobicContact CD2-CB 4.31Å; L351-V405 HydrophobicContact CD2-CG1 3.58Å; L351-V405 HydrophobicContact CD2-CG2 3.87Å; L351-F408 HydrophobicContact CD1-CD1 4.38Å; L351-F408 HydrophobicContact CD1-CE1 4.14Å
352	L	92.3	Very high	88.6	Confident	49 Å²	49	57.9 Å²	57.9	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	155.2	169.2	-61.7	176.2	0	0	0	109.9	Q305 P310 C311 L312 F354	Q305-L352 HydrophobicContact CB-CD1 4.24Å; P310-L352 PolarHBondContact O-N 3.06Å; C311-L352 CarbonylContact C-O 3.59Å; C311-L352 WeakPolarHBondContact CA-O 3.32Å; L312-L352 PolarHBondContact N-O 2.53Å; L352-F354 HydrophobicContact CB-CD2 4.36Å; L352-F354 HydrophobicContact CB-CE2 3.65Å; L352-F354 HydrophobicContact CB-CZ 4.45Å; L352-F354 HydrophobicContact CD1-CE2 4.25Å; L352-F354 HydrophobicContact CD1-CZ 4.47Å
353	F	96.1	Very high	88.7	Confident	6 Å²	6	60 Å²	60	3%	0.026	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.2	-177.6	-70.3	-106.7	0	0	0	110	P294 V295 L296 L312 I331 I334 A335 I338 L351 V405	P294-F353 WeakPolarHBondContact O-CB 3.37Å; V295-F353 HydrophobicContact CG1-CB 4.49Å; V295-F353 HydrophobicContact CG2-CB 4.23Å; L296-F353 PolarHBondContact N-O 2.71Å; L312-F353 HydrophobicContact CB-CD1 4.12Å; L312-F353 HydrophobicContact CB-CE1 4.26Å; L312-F353 HydrophobicContact CD1-CD1 4.32Å; L312-F353 HydrophobicContact CD1-CE1 3.93Å; L312-F353 HydrophobicContact CD2-CD1 3.9Å; L312-F353 HydrophobicContact CD2-CE1 4.33Å; L312-F353 HydrophobicContact CG-CD1 4.34Å; L312-F353 HydrophobicContact CG-CE1 4.42Å; I331-F353 HydrophobicContact CD1-CB 4.48Å; I331-F353 HydrophobicContact CD1-CD1 4.39Å; I334-F353 HydrophobicContact CG2-CE1 4.25Å; I334-F353 HydrophobicContact CG2-CZ 4.36Å; A335-F353 HydrophobicContact CB-CB 4.12Å; A335-F353 HydrophobicContact CB-CD1 3.91Å; A335-F353 HydrophobicContact CB-CD2 3.58Å; A335-F353 HydrophobicContact CB-CE1 4.25Å; A335-F353 HydrophobicContact CB-CE2 3.96Å; A335-F353 HydrophobicContact CB-CG 3.59Å; A335-F353 HydrophobicContact CB-CZ 4.29Å; I338-F353 HydrophobicContact CD1-CE2 4.08Å; I338-F353 HydrophobicContact CD1-CZ 3.6Å; L351-F353 HydrophobicContact CB-CE2 4.19Å; L351-F353 HydrophobicContact CD2-CE1 4.43Å; L351-F353 HydrophobicContact CD2-CE2 4.02Å; L351-F353 HydrophobicContact CD2-CZ 3.72Å; L351-F353 HydrophobicContact CG-CE2 4Å; L351-F353 HydrophobicContact CG-CZ 4.2Å; F353-V405 HydrophobicContact CE1-CG2 4.08Å; F353-V405 HydrophobicContact CZ-CG1 4.38Å; F353-V405 HydrophobicContact CZ-CG2 4.13Å
354	F	95.8	Very high	89.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.8	178.2	-64.5	-92.4	0	0	0	111	L296 L298 Q305 L306 C311 L312 V313 L314 L352	L296-F354 HydrophobicContact CB-CD1 3.7Å; L296-F354 HydrophobicContact CB-CE1 3.7Å; L296-F354 HydrophobicContact CD1-CE1 3.79Å; L296-F354 HydrophobicContact CD1-CZ 4.06Å; L296-F354 HydrophobicContact CG-CE1 4.38Å; L296-F354 CarbonylContact O-C 3.54Å; L296-F354 WeakPolarHBondContact O-CA 3.41Å; L298-F354 HydrophobicContact CB-CB 4.45Å; L298-F354 HydrophobicContact CB-CD1 4.26Å; L298-F354 HydrophobicContact CD1-CD1 4.23Å; Q305-F354 HydrophobicContact CB-CZ 4.04Å; L306-F354 HydrophobicContact CD2-CD2 4.27Å; L306-F354 HydrophobicContact CD2-CE2 4.16Å; C311-F354 HydrophobicContact CB-CD2 4.01Å; C311-F354 HydrophobicContact CB-CE2 4.03Å; L312-F354 PolarHBondContact O-N 2.82Å; V313-F354 WeakPolarHBondContact CA-O 3.38Å; V313-F354 HydrophobicContact CG1-CB 4.3Å; V313-F354 HydrophobicContact CG2-CB 4.26Å; L314-F354 PolarHBondContact N-O 3.37Å; L352-F354 HydrophobicContact CB-CD2 4.36Å; L352-F354 HydrophobicContact CB-CE2 3.65Å; L352-F354 HydrophobicContact CB-CZ 4.45Å; L352-F354 HydrophobicContact CD1-CE2 4.25Å; L352-F354 HydrophobicContact CD1-CZ 4.47Å
355	V	95.4	Very high	89.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.8	158.5	-174.9	0	0	0	0	107.7	V295 L296 E297 L298 L314 V316 L324 A327 K328 I331	V295-V355 HydrophobicContact CG1-CG2 3.79Å; L296-V355 PolarHBondContact O-N 3.03Å; E297-V355 WeakPolarHBondContact CA-O 3.29Å; L298-V355 PolarHBondContact N-O 2.96Å; L314-V355 CarbonylContact O-C 3.51Å; L314-V355 VanDerWaalsContact O-CA 3.31Å; L314-V355 WeakPolarHBondContact O-CA 3.41Å; V316-V355 HydrophobicContact CG2-CG1 3.88Å; L324-V355 HydrophobicContact CB-CG1 4.29Å; L324-V355 HydrophobicContact CD2-CG1 3.85Å; A327-V355 HydrophobicContact CB-CG1 3.63Å; A327-V355 HydrophobicContact CB-CG2 4.17Å; K328-V355 HydrophobicContact CB-CG2 4.44Å; K328-V355 HydrophobicContact CG-CB 4.24Å; K328-V355 HydrophobicContact CG-CG2 3.74Å; I331-V355 HydrophobicContact CD1-CG2 3.81Å; I331-V355 HydrophobicContact CG1-CG2 4.49Å
356	A	94.1	Very high	90	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.1	179.7	0	0	0	0	0	109.4	L298 V313 L314 F315 V316	L298-A356 HydrophobicContact CB-CB 4.11Å; L298-A356 HydrophobicContact CD2-CB 4.06Å; V313-A356 HydrophobicContact CG1-CB 3.79Å; L314-A356 PolarHBondContact O-N 3.37Å; F315-A356 CarbonylContact C-O 3.56Å; F315-A356 VanDerWaalsContact CA-O 3.29Å; F315-A356 WeakPolarHBondContact CA-O 3.22Å; F315-A356 HydrophobicContact CD1-CB 3.49Å; F315-A356 VanDerWaalsContact CD1-CB 3.49Å; F315-A356 HydrophobicContact CE1-CB 3.75Å; F315-A356 HydrophobicContact CG-CB 4.18Å; V316-A356 PolarHBondContact N-O 3.29Å
357	G	92	Very high	90.8	Very high	7 Å²	7	45.4 Å²	45.4	7%	0.072	24%	0.243	C	C	.	.			trans	-93.3	-157.3	174.2	0	0	0	0	0	112.4	T318 S362	T318-G357 WeakPolarHBondContact O-CA 3.47Å; G357-S362 WeakPolarHBondContact O-CB 3.19Å; G357-S362 PolarHBondContact O-OG 2.95Å
358	E	88.2	Confident	91.5	Very high	91 Å²	91	47.5 Å²	47.5	43%	0.425	25%	0.248	S	C	.	.	S	Bend	trans	-91.6	93.2	170.4	-67.2	-174	170.4	0	0	109.5	T318 E319	T318-E358 PolarHBondContact O-N 2.75Å; E319-E358 HydrophobicContact CG-CB 4.15Å
359	D	88.5	Confident	92.3	Very high	56 Å²	56	42.8 Å²	42.8	30%	0.299	23%	0.226	S	C	.	.	S	Bend	trans	-147.4	164.6	175	65.5	30.3	0	0	0	112.1	M361 S362 D363	D359-M361 PolarHBondContact O-N 2.88Å; D359-M361 VanDerWaalsContact O-N 3.09Å; D359-M361 PolarHBondContact OD1-N 3.16Å; D359-S362 PolarHBondContact O-N 2.9Å; D359-S362 VanDerWaalsContact O-N 3.1Å; D359-S362 WeakPolarHBondContact OD1-CB 3.27Å; D359-S362 PolarHBondContact OD1-N 2.86Å; D359-S362 PolarHBondContact OD1-OG 3.33Å; D359-D363 PolarHBondContact O-N 3.38Å
360	D	90	Very high	92.7	Very high	130 Å²	130	46.4 Å²	46.4	70%	0.695	24%	0.243	S	C	*	.	H	α-helix	trans	-54.7	-32.2	-178.3	-74.3	-17.9	0	0	0	112.7	S364	D360-S364 VanDerWaalsContact O-CB 3.25Å; D360-S364 WeakPolarHBondContact O-CB 3.47Å; D360-S364 PolarHBondContact O-N 2.99Å; D360-S364 PolarHBondContact O-OG 3.45Å
361	M	91.1	Very high	93.1	Very high	35 Å²	35	45.2 Å²	45.2	17%	0.172	24%	0.235	C	C	.	.	H	α-helix	trans	-73.8	-43.9	-179.3	179.4	62	-133.9	0	0	111.1	L298 E300 A303 L306 D359 S364 L365	L298-M361 HydrophobicContact CG-CG 4.34Å; E300-M361 HydrophobicContact CG-CB 4.25Å; E300-M361 HydrophobicContact CG-SD 4.4Å; A303-M361 HydrophobicContact CB-CE 3.49Å; A303-M361 VanDerWaalsContact CB-CE 3.49Å; A303-M361 HydrophobicContact CB-SD 3.72Å; L306-M361 HydrophobicContact CD1-CE 4.5Å; D359-M361 PolarHBondContact O-N 2.88Å; D359-M361 VanDerWaalsContact O-N 3.09Å; D359-M361 PolarHBondContact OD1-N 3.16Å; M361-S364 PolarHBondContact O-N 3.11Å; M361-L365 HydrophobicContact CE-CB 4.39Å; M361-L365 WeakPolarHBondContact O-CB 3.41Å; M361-L365 PolarHBondContact O-N 3.43Å
362	S	92.4	Very high	93	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-41.1	178.5	-59.3	0	0	0	0	110.6	G357 D359 L365 R366	G357-S362 WeakPolarHBondContact O-CB 3.19Å; G357-S362 PolarHBondContact O-OG 2.95Å; D359-S362 PolarHBondContact O-N 2.9Å; D359-S362 VanDerWaalsContact O-N 3.1Å; D359-S362 WeakPolarHBondContact OD1-CB 3.27Å; D359-S362 PolarHBondContact OD1-N 2.86Å; D359-S362 PolarHBondContact OD1-OG 3.33Å; S362-L365 PolarHBondContact O-N 3.4Å; S362-R366 WeakPolarHBondContact O-CG 2.75Å; S362-R366 PolarHBondContact O-N 3Å
363	D	92.1	Very high	92.8	Very high	83 Å²	83	53.7 Å²	53.7	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-49.8	173.1	-72.4	-12.1	0	0	0	111.5	D359 L365 R366 D367	D359-D363 PolarHBondContact O-N 3.38Å; D363-L365 PolarHBondContact O-N 3.21Å; D363-R366 PolarHBondContact O-N 3.41Å; D363-R366 VanDerWaalsContact O-N 3.1Å; D363-D367 PolarHBondContact O-N 2.62Å
364	S	93.9	Very high	92.4	Very high	73 Å²	73	56.9 Å²	56.9	51%	0.51	31%	0.306	S	S	.	.	H	α-helix	trans	-57.3	-38.6	176.2	-65.3	0	0	0	0	112.1	D360 M361 Y368	D360-S364 VanDerWaalsContact O-CB 3.25Å; D360-S364 WeakPolarHBondContact O-CB 3.47Å; D360-S364 PolarHBondContact O-N 2.99Å; D360-S364 PolarHBondContact O-OG 3.45Å; M361-S364 PolarHBondContact O-N 3.11Å; S364-Y368 VanDerWaalsContact O-CB 3.26Å; S364-Y368 WeakPolarHBondContact O-CB 3.22Å; S364-Y368 PolarHBondContact O-N 3.08Å
365	L	94.9	Very high	92	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-67.5	-45.3	176.4	178.7	61.9	0	0	0	111.6	L298 L306 F315 M361 S362 D363 Y368 T369 L381 M383	L298-L365 HydrophobicContact CD2-CD2 3.43Å; L298-L365 VanDerWaalsContact CD2-CD2 3.43Å; L306-L365 HydrophobicContact CD1-CD1 3.79Å; L306-L365 HydrophobicContact CD1-CD2 3.89Å; L306-L365 HydrophobicContact CD1-CG 4.45Å; F315-L365 HydrophobicContact CE1-CD2 4.42Å; F315-L365 HydrophobicContact CZ-CD2 3.96Å; F315-L365 HydrophobicContact CZ-CG 4.4Å; M361-L365 HydrophobicContact CE-CB 4.39Å; M361-L365 WeakPolarHBondContact O-CB 3.41Å; M361-L365 PolarHBondContact O-N 3.43Å; S362-L365 PolarHBondContact O-N 3.4Å; D363-L365 PolarHBondContact O-N 3.21Å; L365-Y368 PolarHBondContact O-N 2.82Å; L365-T369 HydrophobicContact CD1-CG2 4.04Å; L365-T369 WeakPolarHBondContact O-CB 3.48Å; L365-T369 WeakPolarHBondContact O-CG2 3.44Å; L365-T369 PolarHBondContact O-N 3.42Å; L365-T369 PolarHBondContact O-OG1 2.59Å; L365-L381 HydrophobicContact CD1-CD1 4.03Å; L365-L381 HydrophobicContact CD2-CD1 3.96Å; L365-L381 HydrophobicContact CG-CD1 4.14Å; L365-M383 HydrophobicContact CD1-CE 3.39Å
366	R	94.8	Very high	91.8	Very high	17 Å²	17	61.2 Å²	61.2	6%	0.064	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-46.1	177.5	-75.2	175.7	177.6	-85.2	24	111.1	F315 S362 D363 T369 N370 L371 P372 E373 L377	F315-R366 HydrophobicContact CD1-CG 4.2Å; F315-R366 VanDerWaalsContact CD1-NE 3.31Å; F315-R366 HydrophobicContact CE1-CG 3.69Å; F315-R366 VanDerWaalsContact CG-CZ 3.46Å; F315-R366 HydrophobicContact CZ-CG 3.97Å; S362-R366 WeakPolarHBondContact O-CG 2.75Å; S362-R366 PolarHBondContact O-N 3Å; D363-R366 PolarHBondContact O-N 3.41Å; D363-R366 VanDerWaalsContact O-N 3.1Å; R366-T369 CarbonylContact O-C 3.5Å; R366-T369 PolarHBondContact O-N 2.86Å; R366-T369 PolarHBondContact O-OG1 3.44Å; R366-N370 WeakPolarHBondContact O-CA 3.42Å; R366-N370 PolarHBondContact O-N 3.03Å; R366-L371 HydrophobicContact CB-CB 4.27Å; R366-L371 HydrophobicContact CG-CB 4.25Å; R366-L371 HydrophobicContact CG-CD1 4.46Å; R366-L371 PolarHBondContact O-N 3.27Å; R366-P372 PolarHBondContact NH1-O 3.39Å; R366-E373 PolarHBondContact NH2-O 3.29Å; R366-L377 VanDerWaalsContact NH1-CD2 3.3Å
367	D	94.3	Very high	91.8	Very high	127 Å²	127	61.9 Å²	61.9	68%	0.679	34%	0.34	S	S	*	.	H	α-helix	trans	-60.7	-50.6	176.7	-83.3	-10	0	0	0	111.8	D363 T369 N370	D363-D367 PolarHBondContact O-N 2.62Å; D367-T369 PolarHBondContact O-N 2.94Å; D367-N370 PolarHBondContact O-N 3.34Å; D367-N370 VanDerWaalsContact O-N 3.13Å
368	Y	93.4	Very high	92	Very high	130 Å²	130	61.6 Å²	61.6	51%	0.51	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-34.2	179.7	-178.7	-99.9	0	0	0	112.2	S364 L365 M383 I418	S364-Y368 VanDerWaalsContact O-CB 3.26Å; S364-Y368 WeakPolarHBondContact O-CB 3.22Å; S364-Y368 PolarHBondContact O-N 3.08Å; L365-Y368 PolarHBondContact O-N 2.82Å; Y368-M383 HydrophobicContact CD1-SD 4.38Å; Y368-M383 HydrophobicContact CE1-SD 4.02Å; Y368-I418 HydrophobicContact CD1-CG2 4.36Å; Y368-I418 HydrophobicContact CE1-CG2 4.07Å
369	T	94.4	Very high	92.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-97.3	0.8	-178.9	59	0	0	0	0	114.2	L365 R366 D367 L371 L381 M383 K388 I418	L365-T369 HydrophobicContact CD1-CG2 4.04Å; L365-T369 WeakPolarHBondContact O-CB 3.48Å; L365-T369 WeakPolarHBondContact O-CG2 3.44Å; L365-T369 PolarHBondContact O-N 3.42Å; L365-T369 PolarHBondContact O-OG1 2.59Å; R366-T369 CarbonylContact O-C 3.5Å; R366-T369 PolarHBondContact O-N 2.86Å; R366-T369 PolarHBondContact O-OG1 3.44Å; D367-T369 PolarHBondContact O-N 2.94Å; T369-L371 VanDerWaalsContact C-N 3.27Å; T369-L371 PolarHBondContact O-N 3.37Å; T369-L371 VanDerWaalsContact OG1-CD1 3.22Å; T369-L371 WeakPolarHBondContact OG1-CD1 3.48Å; T369-L371 VanDerWaalsContact OG1-CG 3.23Å; T369-L371 WeakPolarHBondContact OG1-CG 3.33Å; T369-L381 HydrophobicContact CG2-CD1 4.23Å; T369-L381 HydrophobicContact CG2-CD2 4.21Å; T369-M383 HydrophobicContact CG2-CE 3.71Å; T369-M383 HydrophobicContact CG2-SD 4.28Å; T369-K388 WeakPolarHBondContact O-CD 3.37Å; T369-K388 PolarHBondContact O-NZ 2.85Å; T369-I418 HydrophobicContact CG2-CD1 4.14Å; T369-I418 HydrophobicContact CG2-CG1 4.46Å; T369-I418 HydrophobicContact CG2-CG2 4.24Å
370	N	94.5	Very high	92.9	Very high	123 Å²	123	54.6 Å²	54.6	66%	0.658	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	45.6	-177.3	-175.4	37.8	0	0	0	111.9	R366 D367 K388	R366-N370 WeakPolarHBondContact O-CA 3.42Å; R366-N370 PolarHBondContact O-N 3.03Å; D367-N370 PolarHBondContact O-N 3.34Å; D367-N370 VanDerWaalsContact O-N 3.13Å; N370-K388 PolarHBondContact O-NZ 3.38Å
371	L	94.4	Very high	93.2	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.073	27%	0.269	C	S	.	.			trans	-85.1	152.1	177.2	-72.7	173	0	0	0	111.4	F315 R366 T369 L377 T379 L381 K388 V390	F315-L371 HydrophobicContact CE2-CD1 3.68Å; F315-L371 HydrophobicContact CZ-CD1 3.89Å; R366-L371 HydrophobicContact CB-CB 4.27Å; R366-L371 HydrophobicContact CG-CB 4.25Å; R366-L371 HydrophobicContact CG-CD1 4.46Å; R366-L371 PolarHBondContact O-N 3.27Å; T369-L371 VanDerWaalsContact C-N 3.27Å; T369-L371 PolarHBondContact O-N 3.37Å; T369-L371 VanDerWaalsContact OG1-CD1 3.22Å; T369-L371 WeakPolarHBondContact OG1-CD1 3.48Å; T369-L371 VanDerWaalsContact OG1-CG 3.23Å; T369-L371 WeakPolarHBondContact OG1-CG 3.33Å; L371-L377 HydrophobicContact CB-CD2 4.25Å; L371-L377 HydrophobicContact CD2-CD2 4.35Å; L371-T379 HydrophobicContact CD1-CG2 4.06Å; L371-T379 HydrophobicContact CD2-CG2 3.77Å; L371-L381 HydrophobicContact CD1-CD2 4.24Å; L371-K388 HydrophobicContact CD2-CD 4Å; L371-V390 HydrophobicContact CD2-CG2 3.64Å
372	P	90.7	Very high	93.2	Very high	67 Å²	67	47.8 Å²	47.8	44%	0.435	27%	0.266	S	S	.	.			trans	-58.9	147.5	169.8	-19.6	31.6	0	0	0	111.2	R366	R366-P372 PolarHBondContact NH1-O 3.39Å
373	E	87.9	Confident	92.9	Very high	162 Å²	162	48.8 Å²	48.8	76%	0.757	27%	0.271	S	S	*	.	S	Bend	trans	-74.7	-30.1	176	-69.5	175.5	-175	0	0	112.5	R366 A375	R366-E373 PolarHBondContact NH2-O 3.29Å; E373-A375 PolarHBondContact O-N 3.5Å
374	A	87.5	Confident	92.1	Very high	73 Å²	73	46.4 Å²	46.4	60%	0.603	26%	0.261	S	S	*	.			trans	-57.8	134.9	-177	0	0	0	0	0	112.2
375	A	86.8	Confident	91.4	Very high	19 Å²	19	45.4 Å²	45.4	16%	0.157	26%	0.257	C	S	.	.	S	Bend	trans	-119.6	165	168.3	0	0	0	0	0	111.5	D317 E373	D317-A375 WeakPolarHBondContact OD1-CB 3.45Å; E373-A375 PolarHBondContact O-N 3.5Å
376	P	92	Very high	90.9	Very high	73 Å²	73	52.3 Å²	52.3	47%	0.474	28%	0.283	S	S	.	.	S	Bend	cis	-72.3	140.4	-0.1	36.1	-38.8	0	0	0	111.6	F315 V316 I396	F315-P376 CarbonylContact O-C 3.49Å; F315-P376 WeakPolarHBondContact O-CA 3.48Å; V316-P376 HydrophobicContact CG1-CB 4.24Å; P376-I396 HydrophobicContact CB-CD1 3.67Å; P376-I396 HydrophobicContact CG-CD1 4.01Å; P376-I396 HydrophobicContact CG-CG1 4.38Å
377	L	94.1	Very high	90.7	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.073	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.4	-176.8	-173.1	72.6	0	0	0	111.1	F315 R366 L371 T379 V390	F315-L377 HydrophobicContact CB-CB 4.2Å; F315-L377 HydrophobicContact CD2-CB 4.34Å; F315-L377 HydrophobicContact CD2-CD2 4.34Å; F315-L377 PolarHBondContact N-O 3.35Å; F315-L377 PolarHBondContact O-N 2.97Å; R366-L377 VanDerWaalsContact NH1-CD2 3.3Å; L371-L377 HydrophobicContact CB-CD2 4.25Å; L371-L377 HydrophobicContact CD2-CD2 4.35Å; L377-T379 HydrophobicContact CD2-CG2 3.66Å; L377-T379 HydrophobicContact CG-CG2 3.71Å; L377-V390 HydrophobicContact CD1-CG1 3.82Å
378	L	96.6	Very high	90.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.5	175.9	-173.8	66.9	0	0	0	110.8	L312 L314 K391 I396 V400 V401 F404	L312-L378 HydrophobicContact CD1-CD1 4.05Å; L312-L378 HydrophobicContact CD2-CD1 3.76Å; L312-L378 HydrophobicContact CG-CD1 4Å; L314-L378 HydrophobicContact CB-CD1 4.39Å; L314-L378 HydrophobicContact CD1-CD1 4.45Å; L378-K391 HydrophobicContact CB-CB 4.15Å; L378-K391 HydrophobicContact CD2-CB 4.17Å; L378-K391 HydrophobicContact CD2-CG 4.22Å; L378-K391 HydrophobicContact CG-CB 4.35Å; L378-K391 PolarHBondContact O-N 3.36Å; L378-I396 HydrophobicContact CB-CD1 4Å; L378-I396 HydrophobicContact CD2-CG2 4.49Å; L378-V400 HydrophobicContact CD2-CG1 4.43Å; L378-V401 HydrophobicContact CD1-CG2 4.3Å; L378-V401 HydrophobicContact CD2-CB 4.46Å; L378-V401 HydrophobicContact CD2-CG2 3.91Å; L378-F404 HydrophobicContact CD2-CB 4.25Å; L378-F404 HydrophobicContact CD2-CD1 3.62Å; L378-F404 HydrophobicContact CD2-CE1 4.31Å; L378-F404 HydrophobicContact CD2-CG 4.23Å; L378-F404 HydrophobicContact CG-CD1 3.8Å; L378-F404 HydrophobicContact CG-CE1 4.02Å
379	T	97.3	Very high	91	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.6	-178.9	69.2	0	0	0	0	112.1	L312 V313 F315 L371 L377 Y389 V390	L312-T379 CarbonylContact C-O 3.48Å; L312-T379 VanDerWaalsContact CA-O 3.27Å; L312-T379 WeakPolarHBondContact CA-O 3.45Å; V313-T379 PolarHBondContact N-O 3.49Å; V313-T379 PolarHBondContact O-N 2.84Å; V313-T379 PolarHBondContact O-OG1 2.82Å; V313-T379 VanDerWaalsContact O-OG1 3.11Å; F315-T379 HydrophobicContact CD2-CG2 4.47Å; F315-T379 HydrophobicContact CE2-CG2 4.29Å; L371-T379 HydrophobicContact CD1-CG2 4.06Å; L371-T379 HydrophobicContact CD2-CG2 3.77Å; L377-T379 HydrophobicContact CD2-CG2 3.66Å; L377-T379 HydrophobicContact CG-CG2 3.71Å; T379-Y389 CarbonylContact C-O 3.57Å; T379-Y389 VanDerWaalsContact CA-O 3.25Å; T379-Y389 WeakPolarHBondContact CA-O 2.91Å; T379-V390 HydrophobicContact CG2-CG2 4.39Å
380	I	97.8	Very high	91	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.1	159.8	-66.4	168.2	0	0	0	107.6	P310 C311 L312 L351 K388 Y389 F404 F408	P310-I380 HydrophobicContact CB-CG2 4.4Å; C311-I380 CarbonylContact O-C 3.59Å; C311-I380 WeakPolarHBondContact O-CA 3.29Å; L312-I380 HydrophobicContact CB-CG1 4.09Å; L312-I380 HydrophobicContact CD1-CG1 4.24Å; L312-I380 HydrophobicContact CG-CG1 4.28Å; L351-I380 HydrophobicContact CD1-CG1 4.43Å; L351-I380 HydrophobicContact CD1-CG2 3.97Å; L351-I380 HydrophobicContact CD2-CD1 4.36Å; I380-K388 CarbonylContact O-C 3.4Å; I380-K388 WeakPolarHBondContact O-CA 3.48Å; I380-Y389 HydrophobicContact CB-CD2 4.15Å; I380-Y389 HydrophobicContact CG2-CD2 4.1Å; I380-Y389 PolarHBondContact N-O 3.16Å; I380-Y389 WeakPolarHBondContact O-CD2 3.44Å; I380-Y389 PolarHBondContact O-N 2.89Å; I380-F404 HydrophobicContact CB-CE1 4.36Å; I380-F404 HydrophobicContact CD1-CD1 3.97Å; I380-F404 HydrophobicContact CD1-CE1 3.77Å; I380-F404 HydrophobicContact CD1-CZ 4.21Å; I380-F404 HydrophobicContact CG1-CD1 4.21Å; I380-F404 HydrophobicContact CG1-CE1 3.65Å; I380-F404 HydrophobicContact CG1-CZ 4.21Å; I380-F408 HydrophobicContact CD1-CB 3.51Å; I380-F408 HydrophobicContact CD1-CD1 4.02Å; I380-F408 HydrophobicContact CD1-CD2 4.06Å; I380-F408 HydrophobicContact CD1-CG 3.58Å; I380-F408 HydrophobicContact CG2-CD1 4.29Å; I380-F408 HydrophobicContact CG2-CD2 3.9Å; I380-F408 HydrophobicContact CG2-CE1 4.12Å; I380-F408 HydrophobicContact CG2-CE2 3.72Å; I380-F408 HydrophobicContact CG2-CG 4.2Å; I380-F408 HydrophobicContact CG2-CZ 3.84Å
381	L	96.1	Very high	91	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.2	-179.7	-57.2	178.7	0	0	0	109.2	P310 C311 V313 L365 T369 L371 M383 K388	P310-L381 CarbonylContact C-O 3.54Å; P310-L381 WeakPolarHBondContact CA-O 3.49Å; C311-L381 PolarHBondContact N-O 3.49Å; C311-L381 PolarHBondContact O-N 2.99Å; V313-L381 HydrophobicContact CG2-CD1 4Å; V313-L381 HydrophobicContact CG2-CG 4.48Å; L365-L381 HydrophobicContact CD1-CD1 4.03Å; L365-L381 HydrophobicContact CD2-CD1 3.96Å; L365-L381 HydrophobicContact CG-CD1 4.14Å; T369-L381 HydrophobicContact CG2-CD1 4.23Å; T369-L381 HydrophobicContact CG2-CD2 4.21Å; L371-L381 HydrophobicContact CD1-CD2 4.24Å; L381-M383 HydrophobicContact CB-CE 4.29Å; L381-M383 HydrophobicContact CD1-CE 4.11Å; L381-K388 HydrophobicContact CD2-CB 3.68Å
382	D	91.3	Very high	90.5	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.112	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	89.5	170.9	-174	-14.4	0	0	0	108.6	P310 S384 A385 R386 A387	P310-D382 HydrophobicContact CB-CB 4.47Å; P310-D382 HydrophobicContact CG-CB 4.37Å; D382-S384 PolarHBondContact O-N 3.28Å; D382-S384 WeakPolarHBondContact OD1-CB 3.42Å; D382-S384 PolarHBondContact OD1-N 3.07Å; D382-S384 VanDerWaalsContact OD1-N 3.08Å; D382-S384 PolarHBondContact OD1-OG 3.04Å; D382-A385 HydrophobicContact CB-CB 4.04Å; D382-A385 VanDerWaalsContact CG-CB 3.4Å; D382-A385 CarbonylContact O-C 3.52Å; D382-A385 PolarHBondContact O-N 2.53Å; D382-A385 PolarHBondContact OD1-N 3.21Å; D382-A385 VanDerWaalsContact OD2-CB 3.29Å; D382-A385 WeakPolarHBondContact OD2-CB 3.44Å; D382-R386 WeakPolarHBondContact O-CA 3.35Å; D382-R386 PolarHBondContact O-N 2.85Å; D382-A387 PolarHBondContact N-O 3.4Å; D382-A387 PolarHBondContact O-N 3.44Å
383	M	86.3	Confident	90.3	Very high	22 Å²	22	46.4 Å²	46.4	11%	0.108	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-31	179.1	-61.4	-56.7	-179.7	0	0	112.1	L306 L365 Y368 T369 L381 R386 I418	L306-M383 HydrophobicContact CB-CE 4.49Å; L306-M383 HydrophobicContact CB-CG 4.44Å; L306-M383 VanDerWaalsContact O-CG 3.24Å; L306-M383 WeakPolarHBondContact O-CG 3.33Å; L365-M383 HydrophobicContact CD1-CE 3.39Å; Y368-M383 HydrophobicContact CD1-SD 4.38Å; Y368-M383 HydrophobicContact CE1-SD 4.02Å; T369-M383 HydrophobicContact CG2-CE 3.71Å; T369-M383 HydrophobicContact CG2-SD 4.28Å; L381-M383 HydrophobicContact CB-CE 4.29Å; L381-M383 HydrophobicContact CD1-CE 4.11Å; M383-R386 PolarHBondContact O-N 3.19Å; M383-I418 HydrophobicContact SD-CD1 4Å
384	S	75.3	Confident	89.9	Confident	33 Å²	33	48.6 Å²	48.6	23%	0.231	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-38.8	-178.4	83.4	0	0	0	0	111.3	N108 D382 R386	N108-S384 WeakPolarHBondContact CB-OG 3.25Å; N108-S384 PolarHBondContact ND2-O 3.12Å; N108-S384 PolarHBondContact ND2-OG 3.04Å; N108-S384 VanDerWaalsContact ND2-OG 3.13Å; N108-S384 WeakPolarHBondContact OD1-CB 3.43Å; N108-S384 PolarHBondContact OD1-O 3.46Å; D382-S384 PolarHBondContact O-N 3.28Å; D382-S384 WeakPolarHBondContact OD1-CB 3.42Å; D382-S384 PolarHBondContact OD1-N 3.07Å; D382-S384 VanDerWaalsContact OD1-N 3.08Å; D382-S384 PolarHBondContact OD1-OG 3.04Å; S384-R386 VanDerWaalsContact C-N 3.3Å
385	A	79.7	Confident	89.9	Confident	51 Å²	51	52 Å²	52	42%	0.421	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.3	173.9	0	0	0	0	0	113.2	N108 D382 A387	N108-A385 PolarHBondContact ND2-N 3.45Å; D382-A385 HydrophobicContact CB-CB 4.04Å; D382-A385 VanDerWaalsContact CG-CB 3.4Å; D382-A385 CarbonylContact O-C 3.52Å; D382-A385 PolarHBondContact O-N 2.53Å; D382-A385 PolarHBondContact OD1-N 3.21Å; D382-A385 VanDerWaalsContact OD2-CB 3.29Å; D382-A385 WeakPolarHBondContact OD2-CB 3.44Å; A385-A387 HydrophobicContact CB-CB 4.11Å; A385-A387 PolarHBondContact O-N 2.88Å
386	R	84.4	Confident	90.2	Very high	152 Å²	152	51.9 Å²	51.9	57%	0.574	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	44.7	-169	-62.6	-170.7	59.5	134.4	6.4	111.8	D382 M383 S384 I418	D382-R386 WeakPolarHBondContact O-CA 3.35Å; D382-R386 PolarHBondContact O-N 2.85Å; M383-R386 PolarHBondContact O-N 3.19Å; S384-R386 VanDerWaalsContact C-N 3.3Å; R386-I418 HydrophobicContact CB-CB 4.47Å; R386-I418 PolarHBondContact NH2-O 3.32Å; R386-I418 PolarHBondContact O-N 3.22Å
387	A	91	Very high	90.3	Very high	8 Å²	8	50.5 Å²	50.5	7%	0.066	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140.9	-176.4	0	0	0	0	0	110.8	D382 A385 Y389 P415 E416 I418	D382-A387 PolarHBondContact N-O 3.4Å; D382-A387 PolarHBondContact O-N 3.44Å; A385-A387 HydrophobicContact CB-CB 4.11Å; A385-A387 PolarHBondContact O-N 2.88Å; A387-Y389 HydrophobicContact CB-CE2 4.2Å; A387-P415 HydrophobicContact CB-CB 3.85Å; A387-E416 CarbonylContact C-O 3.54Å; A387-E416 VanDerWaalsContact CA-O 3.28Å; A387-E416 WeakPolarHBondContact CA-O 3.47Å; A387-I418 WeakPolarHBondContact O-CD1 3.17Å
388	K	95.8	Very high	90.4	Very high	9 Å²	9	53 Å²	53	4%	0.039	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.2	169.2	69	-170.6	175.9	-172.4	0	109.9	T369 N370 L371 I380 L381 E416 I418	T369-K388 WeakPolarHBondContact O-CD 3.37Å; T369-K388 PolarHBondContact O-NZ 2.85Å; N370-K388 PolarHBondContact O-NZ 3.38Å; L371-K388 HydrophobicContact CD2-CD 4Å; I380-K388 CarbonylContact O-C 3.4Å; I380-K388 WeakPolarHBondContact O-CA 3.48Å; L381-K388 HydrophobicContact CD2-CB 3.68Å; K388-E416 HydrophobicContact CG-CB 3.77Å; K388-E416 PolarHBondContact N-O 2.86Å; K388-E416 PolarHBondContact O-N 3.2Å; K388-I418 HydrophobicContact CB-CD1 4.44Å; K388-I418 HydrophobicContact CB-CG1 4.05Å; K388-I418 HydrophobicContact CG-CG1 4.45Å
389	Y	96.7	Very high	90.3	Very high	33 Å²	33	56 Å²	56	13%	0.129	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	121.4	174.3	-52.9	-97.3	0	0	0	106.2	T379 I380 A387 F408 L413 K414 P415	T379-Y389 CarbonylContact C-O 3.57Å; T379-Y389 VanDerWaalsContact CA-O 3.25Å; T379-Y389 WeakPolarHBondContact CA-O 2.91Å; I380-Y389 HydrophobicContact CB-CD2 4.15Å; I380-Y389 HydrophobicContact CG2-CD2 4.1Å; I380-Y389 PolarHBondContact N-O 3.16Å; I380-Y389 WeakPolarHBondContact O-CD2 3.44Å; I380-Y389 PolarHBondContact O-N 2.89Å; A387-Y389 HydrophobicContact CB-CE2 4.2Å; Y389-F408 HydrophobicContact CD2-CD2 4.08Å; Y389-F408 AromaticContact CD2-CE2 3.91Å; Y389-F408 HydrophobicContact CD2-CE2 3.91Å; Y389-F408 HydrophobicContact CE1-CD2 4.46Å; Y389-F408 AromaticContact CE2-CD2 3.99Å; Y389-F408 HydrophobicContact CE2-CD2 3.99Å; Y389-F408 AromaticContact CE2-CE2 3.48Å; Y389-F408 HydrophobicContact CE2-CE2 3.48Å; Y389-F408 VanDerWaalsContact CE2-CE2 3.48Å; Y389-F408 HydrophobicContact CG-CD2 4.41Å; Y389-F408 AromaticContact CZ-CE2 3.82Å; Y389-L413 HydrophobicContact CD1-CB 3.5Å; Y389-L413 VanDerWaalsContact CD1-CB 3.5Å; Y389-L413 HydrophobicContact CD1-CD1 4.16Å; Y389-L413 HydrophobicContact CE1-CB 3.86Å; Y389-L413 HydrophobicContact CG-CB 4.44Å; Y389-L413 HydrophobicContact CG-CD1 4.34Å; Y389-K414 WeakPolarHBondContact CD1-O 3.46Å; Y389-P415 VanDerWaalsContact CE1-CA 3.44Å; Y389-P415 HydrophobicContact CE1-CB 3.73Å; Y389-P415 HydrophobicContact CE1-CG 4.48Å
390	V	95.7	Very high	90.3	Very high	38 Å²	38	57.5 Å²	57.5	23%	0.23	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.2	-177.4	-175.9	0	0	0	0	108.5	L371 L377 T379	L371-V390 HydrophobicContact CD2-CG2 3.64Å; L377-V390 HydrophobicContact CD1-CG1 3.82Å; T379-V390 HydrophobicContact CG2-CG2 4.39Å
391	K	94.3	Very high	90.3	Very high	69 Å²	69	57.5 Å²	57.5	30%	0.3	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	98.1	175	-174.8	63.1	171.7	-176.2	0	109	L378 V393 V400 F404	L378-K391 HydrophobicContact CB-CB 4.15Å; L378-K391 HydrophobicContact CD2-CB 4.17Å; L378-K391 HydrophobicContact CD2-CG 4.22Å; L378-K391 HydrophobicContact CG-CB 4.35Å; L378-K391 PolarHBondContact O-N 3.36Å; K391-V393 HydrophobicContact CD-CG1 4.25Å; K391-V393 HydrophobicContact CG-CG1 4.04Å; K391-V393 HydrophobicContact CG-CG2 4.46Å; K391-V393 PolarHBondContact O-N 2.91Å; K391-V400 HydrophobicContact CG-CG1 4.13Å; K391-F404 HydrophobicContact CB-CD1 4.08Å; K391-F404 HydrophobicContact CB-CD2 3.92Å; K391-F404 HydrophobicContact CB-CE1 3.95Å; K391-F404 HydrophobicContact CB-CE2 3.8Å; K391-F404 HydrophobicContact CB-CG 4.06Å; K391-F404 HydrophobicContact CB-CZ 3.82Å; K391-F404 HydrophobicContact CD-CD2 3.98Å; K391-F404 HydrophobicContact CD-CE2 4.38Å; K391-F404 HydrophobicContact CD-CG 4.43Å; K391-F404 HydrophobicContact CG-CD2 4.17Å; K391-F404 HydrophobicContact CG-CG 4.22Å
392	D	84.2	Confident	90.3	Very high	154 Å²	154	60.2 Å²	60.2	82%	0.824	32%	0.319	S	S	*	.			trans	-80.2	109.2	175	-170.3	11.2	0	0	0	109.8
393	V	85.5	Confident	90.6	Very high	42 Å²	42	62.5 Å²	62.5	26%	0.255	33%	0.334	S	S	.	.			trans	-145.3	146.9	179.3	-71.4	0	0	0	0	110	K391 E395 I396 V400	K391-V393 HydrophobicContact CD-CG1 4.25Å; K391-V393 HydrophobicContact CG-CG1 4.04Å; K391-V393 HydrophobicContact CG-CG2 4.46Å; K391-V393 PolarHBondContact O-N 2.91Å; V393-E395 VanDerWaalsContact C-N 3.32Å; V393-E395 PolarHBondContact O-N 3.05Å; V393-I396 HydrophobicContact CG2-CG1 3.92Å; V393-V400 HydrophobicContact CG1-CG1 4.05Å; V393-V400 HydrophobicContact CG2-CG1 4.11Å
394	E	79.3	Confident	91.1	Very high	208 Å²	208	61.8 Å²	61.8	97%	0.972	33%	0.33	S	S	*	.	S	Bend	trans	-67	-33.1	176.6	-66.7	-178.2	172.4	0	0	112.6
395	E	88.3	Confident	92.2	Very high	144 Å²	144	60.3 Å²	60.3	67%	0.673	32%	0.32	S	S	*	.	S	Bend	trans	-139	132.2	180	-169.1	-178.3	-177.6	0	0	110.6	V393 T397	V393-E395 VanDerWaalsContact C-N 3.32Å; V393-E395 PolarHBondContact O-N 3.05Å; E395-T397 HydrophobicContact CG-CG2 4.08Å
396	I	92.7	Very high	92.9	Very high	18 Å²	18	62.9 Å²	62.9	9%	0.092	32%	0.323	C	S	.	.			trans	-92.4	110.2	176.6	-56.1	176.5	0	0	0	108.2	L314 L330 P376 L378 V393 V401	L314-I396 HydrophobicContact CD1-CD1 3.35Å; L314-I396 HydrophobicContact CD1-CG2 4.32Å; L330-I396 HydrophobicContact CD2-CB 4.4Å; L330-I396 HydrophobicContact CD2-CG2 3.83Å; P376-I396 HydrophobicContact CB-CD1 3.67Å; P376-I396 HydrophobicContact CG-CD1 4.01Å; P376-I396 HydrophobicContact CG-CG1 4.38Å; L378-I396 HydrophobicContact CB-CD1 4Å; L378-I396 HydrophobicContact CD2-CG2 4.49Å; V393-I396 HydrophobicContact CG2-CG1 3.92Å; I396-V401 HydrophobicContact CG2-CG2 3.63Å
397	T	94.8	Very high	93.5	Very high	44 Å²	44	57.6 Å²	57.6	27%	0.27	31%	0.307	S	S	.	.			trans	-114.6	161.8	176.2	66.8	0	0	0	0	111.1	E395 A399 V400 V401	E395-T397 HydrophobicContact CG-CG2 4.08Å; T397-A399 PolarHBondContact O-N 3.02Å; T397-A399 VanDerWaalsContact O-N 3.15Å; T397-V400 WeakPolarHBondContact O-CB 3.36Å; T397-V400 PolarHBondContact O-N 3.41Å; T397-V400 WeakPolarHBondContact OG1-CG2 3.28Å; T397-V400 PolarHBondContact OG1-N 3.1Å; T397-V401 WeakPolarHBondContact O-CG2 3.43Å; T397-V401 PolarHBondContact O-N 3.22Å
398	P	95.3	Very high	93.7	Very high	66 Å²	66	58.4 Å²	58.4	43%	0.429	31%	0.309	S	S	.	.	H	α-helix	trans	-55.7	-35	177.6	-27.2	37.1	0	0	0	113.2	L330 I334 V401 E402	L330-P398 HydrophobicContact CD1-CG 3.8Å; I334-P398 HydrophobicContact CD1-CB 4.17Å; P398-V401 PolarHBondContact O-N 3.22Å; P398-E402 VanDerWaalsContact O-CB 3.31Å; P398-E402 WeakPolarHBondContact O-CB 3.35Å; P398-E402 PolarHBondContact O-N 2.79Å
399	A	95.7	Very high	93.4	Very high	62 Å²	62	60.7 Å²	60.7	51%	0.512	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-37.3	177.7	0	0	0	0	0	112.7	T397 T403	T397-A399 PolarHBondContact O-N 3.02Å; T397-A399 VanDerWaalsContact O-N 3.15Å; A399-T403 WeakPolarHBondContact O-CB 3.42Å; A399-T403 PolarHBondContact O-N 2.69Å; A399-T403 PolarHBondContact O-OG1 2.93Å
400	V	96.8	Very high	93.1	Very high	33 Å²	33	61.7 Å²	61.7	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-47.3	174.6	170.8	0	0	0	0	110.1	L378 K391 V393 T397 T403 F404	L378-V400 HydrophobicContact CD2-CG1 4.43Å; K391-V400 HydrophobicContact CG-CG1 4.13Å; V393-V400 HydrophobicContact CG1-CG1 4.05Å; V393-V400 HydrophobicContact CG2-CG1 4.11Å; T397-V400 WeakPolarHBondContact O-CB 3.36Å; T397-V400 PolarHBondContact O-N 3.41Å; T397-V400 WeakPolarHBondContact OG1-CG2 3.28Å; T397-V400 PolarHBondContact OG1-N 3.1Å; V400-T403 PolarHBondContact O-N 2.86Å; V400-F404 WeakPolarHBondContact O-CB 3.49Å; V400-F404 PolarHBondContact O-N 3.1Å
401	V	97.2	Very high	92.8	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.8	-48.1	178.3	178.2	0	0	0	0	110.4	L312 I331 I334 L378 I396 T397 P398 T403 F404 V405	L312-V401 HydrophobicContact CD1-CG1 4.23Å; I331-V401 HydrophobicContact CB-CG1 4.34Å; I331-V401 HydrophobicContact CG2-CG1 3.98Å; I331-V401 HydrophobicContact CG2-CG2 4Å; I334-V401 HydrophobicContact CD1-CB 4.43Å; I334-V401 HydrophobicContact CD1-CG1 4.28Å; I334-V401 HydrophobicContact CG1-CG1 4.36Å; I334-V401 HydrophobicContact CG2-CG1 4.5Å; L378-V401 HydrophobicContact CD1-CG2 4.3Å; L378-V401 HydrophobicContact CD2-CB 4.46Å; L378-V401 HydrophobicContact CD2-CG2 3.91Å; I396-V401 HydrophobicContact CG2-CG2 3.63Å; T397-V401 WeakPolarHBondContact O-CG2 3.43Å; T397-V401 PolarHBondContact O-N 3.22Å; P398-V401 PolarHBondContact O-N 3.22Å; V401-T403 PolarHBondContact O-N 3.13Å; V401-F404 PolarHBondContact O-N 3.44Å; V401-V405 HydrophobicContact CG1-CG2 4.45Å; V401-V405 WeakPolarHBondContact O-CG2 3.41Å; V401-V405 PolarHBondContact O-N 3.33Å
402	E	96.9	Very high	92.8	Very high	58 Å²	58	71.5 Å²	71.5	27%	0.271	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-45.6	179	-179.6	165.2	-152.2	0	0	112	I334 K337 P398 F404 V405 Q406	I334-E402 HydrophobicContact CG1-CB 4.07Å; K337-E402 IonicContact NZ-OE1 3.42Å; K337-E402 PolarHBondContact NZ-OE1 2.92Å; P398-E402 VanDerWaalsContact O-CB 3.31Å; P398-E402 WeakPolarHBondContact O-CB 3.35Å; P398-E402 PolarHBondContact O-N 2.79Å; E402-F404 PolarHBondContact O-N 3.37Å; E402-V405 PolarHBondContact O-N 3.34Å; E402-Q406 HydrophobicContact CG-CG 4.38Å; E402-Q406 VanDerWaalsContact CG-NE2 3.34Å; E402-Q406 WeakPolarHBondContact O-CB 3.5Å; E402-Q406 VanDerWaalsContact O-CG 3.25Å; E402-Q406 WeakPolarHBondContact O-CG 3.4Å; E402-Q406 PolarHBondContact O-N 3.17Å; E402-Q406 PolarHBondContact OE1-NE2 3.4Å
403	T	97	Very high	93.2	Very high	69 Å²	69	66 Å²	66	42%	0.423	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-45	178	-56.7	0	0	0	0	111	A399 V400 V401 V405 Q406 D407	A399-T403 WeakPolarHBondContact O-CB 3.42Å; A399-T403 PolarHBondContact O-N 2.69Å; A399-T403 PolarHBondContact O-OG1 2.93Å; V400-T403 PolarHBondContact O-N 2.86Å; V401-T403 PolarHBondContact O-N 3.13Å; T403-V405 PolarHBondContact O-N 3.1Å; T403-Q406 PolarHBondContact O-N 3.12Å; T403-D407 WeakPolarHBondContact O-CB 3.3Å; T403-D407 PolarHBondContact O-N 2.93Å
404	F	97.4	Very high	93.5	Very high	6 Å²	6	72.8 Å²	72.8	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-61.3	-44.7	-179.7	-174	-130.8	0	0	0	111.9	L378 I380 K391 V400 V401 E402 D407 F408 L413	L378-F404 HydrophobicContact CD2-CB 4.25Å; L378-F404 HydrophobicContact CD2-CD1 3.62Å; L378-F404 HydrophobicContact CD2-CE1 4.31Å; L378-F404 HydrophobicContact CD2-CG 4.23Å; L378-F404 HydrophobicContact CG-CD1 3.8Å; L378-F404 HydrophobicContact CG-CE1 4.02Å; I380-F404 HydrophobicContact CB-CE1 4.36Å; I380-F404 HydrophobicContact CD1-CD1 3.97Å; I380-F404 HydrophobicContact CD1-CE1 3.77Å; I380-F404 HydrophobicContact CD1-CZ 4.21Å; I380-F404 HydrophobicContact CG1-CD1 4.21Å; I380-F404 HydrophobicContact CG1-CE1 3.65Å; I380-F404 HydrophobicContact CG1-CZ 4.21Å; K391-F404 HydrophobicContact CB-CD1 4.08Å; K391-F404 HydrophobicContact CB-CD2 3.92Å; K391-F404 HydrophobicContact CB-CE1 3.95Å; K391-F404 HydrophobicContact CB-CE2 3.8Å; K391-F404 HydrophobicContact CB-CG 4.06Å; K391-F404 HydrophobicContact CB-CZ 3.82Å; K391-F404 HydrophobicContact CD-CD2 3.98Å; K391-F404 HydrophobicContact CD-CE2 4.38Å; K391-F404 HydrophobicContact CD-CG 4.43Å; K391-F404 HydrophobicContact CG-CD2 4.17Å; K391-F404 HydrophobicContact CG-CG 4.22Å; V400-F404 WeakPolarHBondContact O-CB 3.49Å; V400-F404 PolarHBondContact O-N 3.1Å; V401-F404 PolarHBondContact O-N 3.44Å; E402-F404 PolarHBondContact O-N 3.37Å; F404-D407 PolarHBondContact O-N 3.05Å; F404-F408 PolarHBondContact O-N 3.35Å; F404-L413 HydrophobicContact CD2-CD1 3.63Å; F404-L413 HydrophobicContact CD2-CD2 4.1Å; F404-L413 HydrophobicContact CE2-CD1 3.35Å; F404-L413 HydrophobicContact CE2-CD2 4.18Å; F404-L413 HydrophobicContact CE2-CG 4.41Å; F404-L413 HydrophobicContact CZ-CD1 4.1Å
405	V	96.8	Very high	94.1	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-66.3	-42.4	176.3	176.1	0	0	0	0	111.8	L312 I334 I338 L351 F353 V401 E402 T403 D407 F408 L409	L312-V405 HydrophobicContact CD1-CG2 3.36Å; I334-V405 HydrophobicContact CG2-CG2 4.38Å; I338-V405 HydrophobicContact CD1-CB 4.44Å; I338-V405 HydrophobicContact CD1-CG1 3.34Å; L351-V405 HydrophobicContact CD2-CB 4.31Å; L351-V405 HydrophobicContact CD2-CG1 3.58Å; L351-V405 HydrophobicContact CD2-CG2 3.87Å; F353-V405 HydrophobicContact CE1-CG2 4.08Å; F353-V405 HydrophobicContact CZ-CG1 4.38Å; F353-V405 HydrophobicContact CZ-CG2 4.13Å; V401-V405 HydrophobicContact CG1-CG2 4.45Å; V401-V405 WeakPolarHBondContact O-CG2 3.41Å; V401-V405 PolarHBondContact O-N 3.33Å; E402-V405 PolarHBondContact O-N 3.34Å; T403-V405 PolarHBondContact O-N 3.1Å; V405-D407 VanDerWaalsContact C-N 3.34Å; V405-D407 PolarHBondContact O-N 3.08Å; V405-F408 WeakPolarHBondContact O-CB 3.48Å; V405-F408 PolarHBondContact O-N 2.85Å; V405-L409 HydrophobicContact CG1-CD1 3.93Å; V405-L409 HydrophobicContact CG1-CG 4.23Å; V405-L409 VanDerWaalsContact O-CG 3.3Å; V405-L409 WeakPolarHBondContact O-CG 3.35Å; V405-L409 PolarHBondContact O-N 2.95Å
406	Q	95.6	Very high	94.4	Very high	106 Å²	106	63.9 Å²	63.9	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-41.8	178.1	-74.9	179.5	13.9	0	0	112.1	E402 T403 L409 A410	E402-Q406 HydrophobicContact CG-CG 4.38Å; E402-Q406 VanDerWaalsContact CG-NE2 3.34Å; E402-Q406 WeakPolarHBondContact O-CB 3.5Å; E402-Q406 VanDerWaalsContact O-CG 3.25Å; E402-Q406 WeakPolarHBondContact O-CG 3.4Å; E402-Q406 PolarHBondContact O-N 3.17Å; E402-Q406 PolarHBondContact OE1-NE2 3.4Å; T403-Q406 PolarHBondContact O-N 3.12Å; Q406-L409 PolarHBondContact O-N 2.99Å; Q406-A410 VanDerWaalsContact O-CB 3.26Å; Q406-A410 WeakPolarHBondContact O-CB 3.28Å; Q406-A410 PolarHBondContact O-N 3.21Å
407	D	96.5	Very high	94.2	Very high	41 Å²	41	68.1 Å²	68.1	22%	0.219	37%	0.368	C	S	.	.	H	α-helix	trans	-68.6	-35	177.4	-75.7	-21.8	0	0	0	112	T403 F404 V405 A410 E411 K412 L413	T403-D407 WeakPolarHBondContact O-CB 3.3Å; T403-D407 PolarHBondContact O-N 2.93Å; F404-D407 PolarHBondContact O-N 3.05Å; V405-D407 VanDerWaalsContact C-N 3.34Å; V405-D407 PolarHBondContact O-N 3.08Å; D407-A410 PolarHBondContact O-N 3.49Å; D407-E411 PolarHBondContact O-N 3.38Å; D407-K412 HydrophobicContact CB-CB 4.2Å; D407-K412 PolarHBondContact O-N 3.01Å; D407-K412 WeakPolarHBondContact OD1-CD 3.46Å; D407-K412 IonicContact OD1-NZ 3.81Å; D407-K412 PolarHBondContact OD1-NZ 2.93Å; D407-L413 HydrophobicContact CB-CD2 3.65Å; D407-L413 HydrophobicContact CB-CG 3.97Å
408	F	95.1	Very high	93.9	Very high	25 Å²	25	68 Å²	68	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-52.6	171.8	177.9	-106.3	0	0	0	111.5	P310 L351 I380 Y389 F404 V405 A410 E411 L413	P310-F408 HydrophobicContact CB-CE1 3.72Å; P310-F408 HydrophobicContact CB-CZ 3.56Å; P310-F408 HydrophobicContact CG-CE1 4.1Å; P310-F408 HydrophobicContact CG-CZ 3.8Å; L351-F408 HydrophobicContact CD1-CD1 4.38Å; L351-F408 HydrophobicContact CD1-CE1 4.14Å; I380-F408 HydrophobicContact CD1-CB 3.51Å; I380-F408 HydrophobicContact CD1-CD1 4.02Å; I380-F408 HydrophobicContact CD1-CD2 4.06Å; I380-F408 HydrophobicContact CD1-CG 3.58Å; I380-F408 HydrophobicContact CG2-CD1 4.29Å; I380-F408 HydrophobicContact CG2-CD2 3.9Å; I380-F408 HydrophobicContact CG2-CE1 4.12Å; I380-F408 HydrophobicContact CG2-CE2 3.72Å; I380-F408 HydrophobicContact CG2-CG 4.2Å; I380-F408 HydrophobicContact CG2-CZ 3.84Å; Y389-F408 HydrophobicContact CD2-CD2 4.08Å; Y389-F408 AromaticContact CD2-CE2 3.91Å; Y389-F408 HydrophobicContact CD2-CE2 3.91Å; Y389-F408 HydrophobicContact CE1-CD2 4.46Å; Y389-F408 AromaticContact CE2-CD2 3.99Å; Y389-F408 HydrophobicContact CE2-CD2 3.99Å; Y389-F408 AromaticContact CE2-CE2 3.48Å; Y389-F408 HydrophobicContact CE2-CE2 3.48Å; Y389-F408 VanDerWaalsContact CE2-CE2 3.48Å; Y389-F408 HydrophobicContact CG-CD2 4.41Å; Y389-F408 AromaticContact CZ-CE2 3.82Å; F404-F408 PolarHBondContact O-N 3.35Å; V405-F408 WeakPolarHBondContact O-CB 3.48Å; V405-F408 PolarHBondContact O-N 2.85Å; F408-A410 PolarHBondContact O-N 3.21Å; F408-E411 PolarHBondContact O-N 3.24Å; F408-L413 HydrophobicContact CB-CD1 3.63Å; F408-L413 HydrophobicContact CB-CG 4.37Å; F408-L413 HydrophobicContact CD2-CD1 4.27Å; F408-L413 HydrophobicContact CG-CD1 4.45Å
409	L	90.7	Very high	93.8	Very high	56 Å²	56	68.1 Å²	68.1	29%	0.293	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-22.1	-179.3	-66.1	178.2	0	0	0	113.1	P350 V405 Q406 E411	P350-L409 HydrophobicContact CB-CD2 3.84Å; P350-L409 HydrophobicContact CG-CD1 4.46Å; P350-L409 HydrophobicContact CG-CD2 3.52Å; V405-L409 HydrophobicContact CG1-CD1 3.93Å; V405-L409 HydrophobicContact CG1-CG 4.23Å; V405-L409 VanDerWaalsContact O-CG 3.3Å; V405-L409 WeakPolarHBondContact O-CG 3.35Å; V405-L409 PolarHBondContact O-N 2.95Å; Q406-L409 PolarHBondContact O-N 2.99Å; L409-E411 VanDerWaalsContact C-N 3.35Å
410	A	89.8	Confident	93.7	Very high	55 Å²	55	68.4 Å²	68.4	46%	0.455	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.1	173.9	0	0	0	0	0	113.6	Q406 D407 F408 K412	Q406-A410 VanDerWaalsContact O-CB 3.26Å; Q406-A410 WeakPolarHBondContact O-CB 3.28Å; Q406-A410 PolarHBondContact O-N 3.21Å; D407-A410 PolarHBondContact O-N 3.49Å; F408-A410 PolarHBondContact O-N 3.21Å; A410-K412 HydrophobicContact CB-CD 4.11Å; A410-K412 HydrophobicContact CB-CG 4.02Å; A410-K412 PolarHBondContact O-N 2.89Å
411	E	89.4	Confident	93.6	Very high	163 Å²	163	70.3 Å²	70.3	76%	0.762	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	31	-176.9	-57.3	-173	-176.3	0	0	113.7	D407 F408 L409	D407-E411 PolarHBondContact O-N 3.38Å; F408-E411 PolarHBondContact O-N 3.24Å; L409-E411 VanDerWaalsContact C-N 3.35Å
412	K	93.6	Very high	93.4	Very high	149 Å²	149	74.5 Å²	74.5	65%	0.648	38%	0.384	S	S	*	.			trans	-90.9	-20.6	-179.9	-66	175.8	-175	170.4	0	113.6	D407 A410	D407-K412 HydrophobicContact CB-CB 4.2Å; D407-K412 PolarHBondContact O-N 3.01Å; D407-K412 WeakPolarHBondContact OD1-CD 3.46Å; D407-K412 IonicContact OD1-NZ 3.81Å; D407-K412 PolarHBondContact OD1-NZ 2.93Å; A410-K412 HydrophobicContact CB-CD 4.11Å; A410-K412 HydrophobicContact CB-CG 4.02Å; A410-K412 PolarHBondContact O-N 2.89Å
413	L	93.1	Very high	93.1	Very high	40 Å²	40	75.5 Å²	75.5	21%	0.209	39%	0.391	C	S	.	.	S	Bend	trans	-75.1	144.2	-179.9	-59.9	-177.4	0	0	0	111	Y389 F404 D407 F408	Y389-L413 HydrophobicContact CD1-CB 3.5Å; Y389-L413 VanDerWaalsContact CD1-CB 3.5Å; Y389-L413 HydrophobicContact CD1-CD1 4.16Å; Y389-L413 HydrophobicContact CE1-CB 3.86Å; Y389-L413 HydrophobicContact CG-CB 4.44Å; Y389-L413 HydrophobicContact CG-CD1 4.34Å; F404-L413 HydrophobicContact CD2-CD1 3.63Å; F404-L413 HydrophobicContact CD2-CD2 4.1Å; F404-L413 HydrophobicContact CE2-CD1 3.35Å; F404-L413 HydrophobicContact CE2-CD2 4.18Å; F404-L413 HydrophobicContact CE2-CG 4.41Å; F404-L413 HydrophobicContact CZ-CD1 4.1Å; D407-L413 HydrophobicContact CB-CD2 3.65Å; D407-L413 HydrophobicContact CB-CG 3.97Å; F408-L413 HydrophobicContact CB-CD1 3.63Å; F408-L413 HydrophobicContact CB-CG 4.37Å; F408-L413 HydrophobicContact CD2-CD1 4.27Å; F408-L413 HydrophobicContact CG-CD1 4.45Å
414	K	91	Very high	92.9	Very high	184 Å²	184	75.9 Å²	75.9	80%	0.8	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-85.4	123.2	174.9	-172.3	-178.9	176.2	-171.6	0	109.3	Y389	Y389-K414 WeakPolarHBondContact CD1-O 3.46Å
415	P	92.4	Very high	92.6	Very high	70 Å²	70	80.9 Å²	80.9	46%	0.455	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-73.4	142.1	176.7	28	-32.8	0	0	0	111.4	A387 Y389	A387-P415 HydrophobicContact CB-CB 3.85Å; Y389-P415 VanDerWaalsContact CE1-CA 3.44Å; Y389-P415 HydrophobicContact CE1-CB 3.73Å; Y389-P415 HydrophobicContact CE1-CG 4.48Å
416	E	94	Very high	92.2	Very high	94 Å²	94	87 Å²	87	44%	0.439	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.2	163.7	-66.3	177.7	-162.5	0	0	109.5	A387 K388	A387-E416 CarbonylContact C-O 3.54Å; A387-E416 VanDerWaalsContact CA-O 3.28Å; A387-E416 WeakPolarHBondContact CA-O 3.47Å; K388-E416 HydrophobicContact CG-CB 3.77Å; K388-E416 PolarHBondContact N-O 2.86Å; K388-E416 PolarHBondContact O-N 3.2Å
417	P	90.3	Very high	92	Very high	107 Å²	107	85.4 Å²	85.4	70%	0.695	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	144.9	-179.7	28.6	-33.7	0	0	0	112.3
418	I	87.6	Confident	91.5	Very high	41 Å²	41	89.5 Å²	89.5	21%	0.21	46%	0.461	C	S	.	.			trans	-88.6	0	165.3	-64.4	176.9	0	0	0	109.8	Y368 T369 M383 R386 A387 K388	Y368-I418 HydrophobicContact CD1-CG2 4.36Å; Y368-I418 HydrophobicContact CE1-CG2 4.07Å; T369-I418 HydrophobicContact CG2-CD1 4.14Å; T369-I418 HydrophobicContact CG2-CG1 4.46Å; T369-I418 HydrophobicContact CG2-CG2 4.24Å; M383-I418 HydrophobicContact SD-CD1 4Å; R386-I418 HydrophobicContact CB-CB 4.47Å; R386-I418 PolarHBondContact NH2-O 3.32Å; R386-I418 PolarHBondContact O-N 3.22Å; A387-I418 WeakPolarHBondContact O-CD1 3.17Å; K388-I418 HydrophobicContact CB-CD1 4.44Å; K388-I418 HydrophobicContact CB-CG1 4.05Å; K388-I418 HydrophobicContact CG-CG1 4.45Å

Retrieved 418 of 418 residues in 87.2 ms (Link to these results)

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