A0A077ZBP4_TRITR Loading...

SGT1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBP4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 625 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	27.6	Very low	62.2	Low	247 Å²	247	81.1 Å²	81.1	100%	1.217	44%	0.442	S	S	*	.				0	81.8	0	-74.4	176.6	170.9	0	0	106
2	T	28.8	Very low	65	Low	118 Å²	118	74.3 Å²	74.3	72%	0.724	41%	0.405	S	S	*	.			trans	-87.5	115	173.4	41.6	0	0	0	0	105.8	F5	T2-F5 HydrophobicContact CG2-CE2 4.12Å
3	S	37	Very low	67.3	Low	66 Å²	66	71.9 Å²	71.9	46%	0.462	39%	0.386	S	S	.	.			trans	-48.7	147	158.8	-174.6	0	0	0	0	107.9	F5	S3-F5 VanDerWaalsContact C-N 3.34Å; S3-F5 PolarHBondContact O-N 2.87Å
4	P	39.5	Very low	69.3	Low	111 Å²	111	66.9 Å²	66.9	72%	0.721	36%	0.359	S	S	*	.			trans	-55.9	107.7	165.7	24.4	-30.2	0	0	0	106.4	T6	P4-T6 PolarHBondContact O-N 3.1Å
5	F	49.9	Very low	71	Confident	76 Å²	76	63.7 Å²	63.7	33%	0.333	34%	0.34	S	S	.	.			trans	-59.7	112.8	172.8	-81.1	-87.6	0	0	0	105.1	T2 S3 E11	T2-F5 HydrophobicContact CG2-CE2 4.12Å; S3-F5 VanDerWaalsContact C-N 3.34Å; S3-F5 PolarHBondContact O-N 2.87Å; F5-E11 HydrophobicContact CE1-CG 4.15Å; F5-E11 WeakPolarHBondContact CE1-OE1 3.15Å
6	T	61.7	Low	72.4	Confident	60 Å²	60	61.9 Å²	61.9	37%	0.368	33%	0.328	S	S	.	.			trans	-73.7	135.9	169.7	17	0	0	0	0	104.9	P4 D8 V9 H63	P4-T6 PolarHBondContact O-N 3.1Å; T6-D8 WeakPolarHBondContact CB-OD1 3.04Å; T6-D8 PolarHBondContact O-N 2.99Å; T6-V9 PolarHBondContact O-N 2.71Å; T6-V9 WeakPolarHBondContact OG1-CG2 3.13Å; T6-H63 PolarHBondContact OG1-CE1 2.88Å
7	E	75.7	Confident	73.3	Confident	150 Å²	150	59.2 Å²	59.2	70%	0.701	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.9	-169.6	-68.2	175.5	170.6	0	0	113	Y64 Y95	E7-Y64 PolarHBondContact O-OH 2.82Å; E7-Y95 HydrophobicContact CB-CG 4.39Å; E7-Y95 HydrophobicContact CG-CD2 4.42Å; E7-Y95 WeakPolarHBondContact O-CD1 3.43Å; E7-Y95 WeakPolarHBondContact O-CE1 3.4Å
8	D	86.6	Confident	73.9	Confident	48 Å²	48	57.4 Å²	57.4	26%	0.257	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	33.9	-171	63.5	-27.7	0	0	0	113.7	T6 H63 Y64 G65	T6-D8 WeakPolarHBondContact CB-OD1 3.04Å; T6-D8 PolarHBondContact O-N 2.99Å; D8-H63 CarbonylContact O-C 3.58Å; D8-H63 WeakPolarHBondContact O-CA 3.47Å; D8-H63 IonicContact OD1-ND1 3Å; D8-H63 IonicContact OD2-ND1 2.72Å; D8-Y64 HydrophobicContact CB-CE2 4.32Å; D8-Y64 VanDerWaalsContact O-CD1 3.25Å; D8-Y64 WeakPolarHBondContact O-CD1 3.34Å; D8-Y64 PolarHBondContact O-N 2.75Å; D8-G65 WeakPolarHBondContact CB-O 3.4Å; D8-G65 WeakPolarHBondContact OD2-CA 3Å
9	V	90.5	Very high	74.2	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.6	-175.5	172.5	0	0	0	0	112.9	T6 E11 K61 V62 H63 D94	T6-V9 PolarHBondContact O-N 2.71Å; T6-V9 WeakPolarHBondContact OG1-CG2 3.13Å; V9-E11 HydrophobicContact CG1-CG 3.88Å; V9-K61 HydrophobicContact CG1-CD 3.9Å; V9-K61 HydrophobicContact CG1-CG 3.47Å; V9-K61 VanDerWaalsContact CG1-CG 3.47Å; V9-V62 WeakPolarHBondContact CA-O 3.48Å; V9-H63 WeakPolarHBondContact CG2-CE1 3.43Å; V9-H63 WeakPolarHBondContact CG2-ND1 3.48Å; V9-D94 WeakPolarHBondContact O-CA 3.31Å; V9-D94 WeakPolarHBondContact O-CB 3.48Å
10	V	93	Very high	74.3	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.6	160.9	178.6	0	0	0	0	110.9	Y12 K61 V62 Y64 E71 V74 D94 F99	V10-Y12 HydrophobicContact CG1-CD1 4.22Å; V10-K61 CarbonylContact O-C 3.56Å; V10-K61 WeakPolarHBondContact O-CA 3.48Å; V10-V62 PolarHBondContact N-O 3.33Å; V10-V62 PolarHBondContact O-N 3.24Å; V10-Y64 HydrophobicContact CG2-CD1 3.73Å; V10-Y64 HydrophobicContact CG2-CE1 3.68Å; V10-E71 HydrophobicContact CG2-CB 4.24Å; V10-E71 HydrophobicContact CG2-CG 3.72Å; V10-E71 WeakPolarHBondContact CG2-OE2 3.28Å; V10-V74 HydrophobicContact CG1-CG1 4.38Å; V10-D94 HydrophobicContact CG2-CB 4.43Å; V10-F99 HydrophobicContact CG1-CE1 3.91Å; V10-F99 HydrophobicContact CG1-CZ 4.01Å; V10-F99 HydrophobicContact CG2-CE1 4.33Å; V10-F99 HydrophobicContact CG2-CZ 4.3Å
11	E	94.2	Very high	74.6	Confident	14 Å²	14	71.2 Å²	71.2	7%	0.065	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	145.7	170.1	-65.5	-165	-160.8	0	0	111.3	F5 V9 W13 Y59 K61 T92 C93	F5-E11 HydrophobicContact CE1-CG 4.15Å; F5-E11 WeakPolarHBondContact CE1-OE1 3.15Å; V9-E11 HydrophobicContact CG1-CG 3.88Å; E11-W13 HydrophobicContact CB-CH2 3.46Å; E11-W13 VanDerWaalsContact CB-CH2 3.46Å; E11-W13 HydrophobicContact CB-CZ2 4.06Å; E11-W13 HydrophobicContact CB-CZ3 3.87Å; E11-W13 HydrophobicContact CG-CH2 4.44Å; E11-W13 WeakPolarHBondContact OE2-CH2 3.36Å; E11-W13 WeakPolarHBondContact OE2-CZ2 3.3Å; E11-Y59 HydrophobicContact CB-CE2 4.32Å; E11-Y59 HydrophobicContact CG-CE2 4.49Å; E11-Y59 WeakPolarHBondContact OE2-CE2 3.47Å; E11-Y59 PolarHBondContact OE2-OH 3Å; E11-K61 HydrophobicContact CG-CB 4.27Å; E11-K61 HydrophobicContact CG-CD 4.45Å; E11-K61 HydrophobicContact CG-CG 4Å; E11-T92 CarbonylContact O-C 3.57Å; E11-T92 WeakPolarHBondContact O-CA 3.36Å; E11-C93 PolarHBondContact N-O 3.46Å; E11-C93 PolarHBondContact O-N 3.4Å
12	Y	95.6	Very high	77.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	146.3	177.5	44.6	-95.5	0	0	0	113.2	V10 F14 F46 C47 L48 Y59 G60 V62 V74 L78 K91	V10-Y12 HydrophobicContact CG1-CD1 4.22Å; Y12-F14 HydrophobicContact CD2-CD2 4.26Å; Y12-F14 AromaticContact CD2-CE2 3.62Å; Y12-F14 HydrophobicContact CD2-CE2 3.62Å; Y12-F14 HydrophobicContact CE2-CE2 4.18Å; Y12-F46 HydrophobicContact CD2-CE2 4.46Å; Y12-F46 HydrophobicContact CD2-CZ 4.37Å; Y12-F46 HydrophobicContact CE1-CD2 4.43Å; Y12-F46 HydrophobicContact CE1-CE2 4.12Å; Y12-F46 HydrophobicContact CE2-CD2 4.38Å; Y12-F46 HydrophobicContact CE2-CE1 4.19Å; Y12-F46 AromaticContact CE2-CE2 3.59Å; Y12-F46 HydrophobicContact CE2-CE2 3.59Å; Y12-F46 AromaticContact CE2-CZ 3.48Å; Y12-F46 HydrophobicContact CE2-CZ 3.48Å; Y12-F46 VanDerWaalsContact CE2-CZ 3.48Å; Y12-F46 AromaticContact CZ-CD2 3.79Å; Y12-F46 AromaticContact CZ-CE2 3.4Å; Y12-F46 VanDerWaalsContact CZ-CE2 3.4Å; Y12-F46 AromaticContact CZ-CZ 3.76Å; Y12-F46 VanDerWaalsContact OH-CD2 3.22Å; Y12-F46 WeakPolarHBondContact OH-CD2 3.21Å; Y12-F46 VanDerWaalsContact OH-CE2 3.3Å; Y12-F46 WeakPolarHBondContact OH-CE2 3.45Å; Y12-C47 VanDerWaalsContact CE2-O 3.3Å; Y12-C47 WeakPolarHBondContact CE2-O 3.39Å; Y12-C47 PolarHBondContact OH-N 2.67Å; Y12-C47 VanDerWaalsContact OH-N 3.17Å; Y12-C47 PolarHBondContact OH-O 3.09Å; Y12-L48 HydrophobicContact CD2-CD1 4.19Å; Y12-L48 HydrophobicContact CE2-CD1 3.87Å; Y12-Y59 WeakPolarHBondContact O-CA 3.37Å; Y12-Y59 WeakPolarHBondContact O-CD2 3.31Å; Y12-G60 PolarHBondContact N-O 3.49Å; Y12-G60 PolarHBondContact O-N 3.01Å; Y12-V62 HydrophobicContact CE1-CG2 3.89Å; Y12-V62 VanDerWaalsContact OH-CG2 3.28Å; Y12-V62 WeakPolarHBondContact OH-CG2 3.41Å; Y12-V74 HydrophobicContact CD1-CG1 3.9Å; Y12-V74 HydrophobicContact CE1-CG1 3.68Å; Y12-L78 HydrophobicContact CD1-CD1 4.28Å; Y12-L78 HydrophobicContact CD1-CD2 4.47Å; Y12-L78 HydrophobicContact CD2-CD2 4Å; Y12-L78 HydrophobicContact CE2-CD2 4.4Å; Y12-L78 HydrophobicContact CG-CD1 4.16Å; Y12-L78 HydrophobicContact CG-CD2 3.99Å; Y12-K91 CarbonylContact C-O 3.5Å; Y12-K91 WeakPolarHBondContact CA-O 3.44Å
13	W	94.9	Very high	80.2	Confident	43 Å²	43	55.5 Å²	55.5	16%	0.163	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.7	-179.5	-57.8	-100.6	0	0	0	110.4	E11 Y15 H57 F58 Y59 V90 K91 C93	E11-W13 HydrophobicContact CB-CH2 3.46Å; E11-W13 VanDerWaalsContact CB-CH2 3.46Å; E11-W13 HydrophobicContact CB-CZ2 4.06Å; E11-W13 HydrophobicContact CB-CZ3 3.87Å; E11-W13 HydrophobicContact CG-CH2 4.44Å; E11-W13 WeakPolarHBondContact OE2-CH2 3.36Å; E11-W13 WeakPolarHBondContact OE2-CZ2 3.3Å; W13-Y15 HydrophobicContact CB-CD2 4.22Å; W13-Y15 HydrophobicContact CB-CE1 4.37Å; W13-Y15 HydrophobicContact CB-CE2 3.43Å; W13-Y15 VanDerWaalsContact CB-CE2 3.43Å; W13-Y15 WeakPolarHBondContact CB-OH 3.47Å; W13-Y15 HydrophobicContact CG-CE2 4.26Å; W13-Y15 AromaticContact CG-CZ 4Å; W13-H57 AromaticContact CD1-CD2 3.75Å; W13-H57 AromaticContact CD1-NE2 3.82Å; W13-F58 CarbonylContact C-O 3.34Å; W13-F58 VanDerWaalsContact CA-O 3.31Å; W13-F58 WeakPolarHBondContact CA-O 3.17Å; W13-Y59 AromaticContact CD1-CD2 3.49Å; W13-Y59 VanDerWaalsContact CD1-CD2 3.49Å; W13-Y59 HydrophobicContact CD2-CD2 4.17Å; W13-Y59 HydrophobicContact CD2-CE2 4.4Å; W13-Y59 AromaticContact CE2-CD2 3.65Å; W13-Y59 AromaticContact CE2-CE2 3.59Å; W13-Y59 HydrophobicContact CG-CD2 4.07Å; W13-Y59 HydrophobicContact CZ2-CD2 4.25Å; W13-Y59 AromaticContact CZ2-CE2 3.71Å; W13-Y59 HydrophobicContact CZ2-CE2 3.71Å; W13-Y59 AromaticContact NE1-CD2 3.18Å; W13-Y59 AromaticContact NE1-CE2 3.49Å; W13-V90 CarbonylContact O-C 3.53Å; W13-V90 VanDerWaalsContact O-CA 3.23Å; W13-V90 WeakPolarHBondContact O-CA 3.25Å; W13-K91 HydrophobicContact CB-CB 4.46Å; W13-K91 HydrophobicContact CE3-CB 4.15Å; W13-K91 HydrophobicContact CE3-CD 4.35Å; W13-K91 HydrophobicContact CE3-CG 4.11Å; W13-K91 PolarHBondContact N-O 2.93Å; W13-K91 PolarHBondContact O-N 3.29Å; W13-C93 HydrophobicContact CH2-CB 3.95Å; W13-C93 HydrophobicContact CZ3-CB 3.67Å
14	F	95.4	Very high	82.7	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	104.1	176.5	-69.4	-115.7	0	0	0	108.8	Y12 F46 L48 H57 F58 L78 I81 V88 V90	Y12-F14 HydrophobicContact CD2-CD2 4.26Å; Y12-F14 AromaticContact CD2-CE2 3.62Å; Y12-F14 HydrophobicContact CD2-CE2 3.62Å; Y12-F14 HydrophobicContact CE2-CE2 4.18Å; F14-F46 HydrophobicContact CE2-CZ 4.44Å; F14-F46 HydrophobicContact CZ-CZ 4.33Å; F14-L48 HydrophobicContact CD2-CD1 3.73Å; F14-L48 HydrophobicContact CE2-CD1 3.68Å; F14-H57 VanDerWaalsContact O-CA 3.25Å; F14-H57 WeakPolarHBondContact O-CA 3.3Å; F14-H57 VanDerWaalsContact O-CB 3.23Å; F14-H57 WeakPolarHBondContact O-CB 3.28Å; F14-F58 HydrophobicContact CB-CB 3.88Å; F14-F58 HydrophobicContact CB-CD2 4.29Å; F14-F58 HydrophobicContact CB-CG 4.41Å; F14-F58 HydrophobicContact CD2-CB 4.36Å; F14-F58 HydrophobicContact CG-CB 4.27Å; F14-F58 PolarHBondContact N-O 3.21Å; F14-F58 PolarHBondContact O-N 2.91Å; F14-L78 HydrophobicContact CE1-CD2 4.41Å; F14-L78 HydrophobicContact CE2-CD2 3.53Å; F14-L78 HydrophobicContact CZ-CD2 3.29Å; F14-I81 HydrophobicContact CD1-CG2 4.29Å; F14-I81 HydrophobicContact CE1-CB 4.04Å; F14-I81 HydrophobicContact CE1-CD1 4.04Å; F14-I81 HydrophobicContact CE1-CG2 3.54Å; F14-I81 HydrophobicContact CZ-CD1 3.87Å; F14-I81 HydrophobicContact CZ-CG2 4.44Å; F14-V88 HydrophobicContact CB-CG1 4.22Å; F14-V88 HydrophobicContact CD1-CG1 3.45Å; F14-V88 VanDerWaalsContact CD1-CG1 3.45Å; F14-V88 HydrophobicContact CE1-CG1 4.19Å; F14-V88 HydrophobicContact CG-CG1 4.25Å; F14-V90 HydrophobicContact CD1-CG2 3.67Å; F14-V90 HydrophobicContact CD2-CG1 4.37Å; F14-V90 HydrophobicContact CD2-CG2 4.45Å; F14-V90 HydrophobicContact CE1-CG2 3.62Å; F14-V90 HydrophobicContact CE2-CG1 4.24Å; F14-V90 HydrophobicContact CE2-CG2 4.47Å; F14-V90 HydrophobicContact CG-CG2 4.07Å; F14-V90 HydrophobicContact CZ-CG1 4.44Å; F14-V90 HydrophobicContact CZ-CG2 4.09Å
15	Y	94.3	Very high	85.2	Confident	20 Å²	20	49.6 Å²	49.6	8%	0.078	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.7	174.9	-59.8	-70.9	0	0	0	110.6	W13 H57 V88 V89 K91 L151 L155	W13-Y15 HydrophobicContact CB-CD2 4.22Å; W13-Y15 HydrophobicContact CB-CE1 4.37Å; W13-Y15 HydrophobicContact CB-CE2 3.43Å; W13-Y15 VanDerWaalsContact CB-CE2 3.43Å; W13-Y15 WeakPolarHBondContact CB-OH 3.47Å; W13-Y15 HydrophobicContact CG-CE2 4.26Å; W13-Y15 AromaticContact CG-CZ 4Å; Y15-H57 HydrophobicContact CD1-CB 3.79Å; Y15-H57 HydrophobicContact CE1-CB 3.91Å; Y15-V88 WeakPolarHBondContact O-CA 3.19Å; Y15-V89 PolarHBondContact N-O 3.29Å; Y15-V89 PolarHBondContact O-N 3.49Å; Y15-K91 HydrophobicContact CE2-CB 4Å; Y15-L151 HydrophobicContact CD2-CD1 4.49Å; Y15-L151 HydrophobicContact CE1-CD2 3.76Å; Y15-L151 HydrophobicContact CE2-CD1 4.05Å; Y15-L151 HydrophobicContact CE2-CD2 3.91Å; Y15-L151 VanDerWaalsContact CZ-CD2 3.41Å; Y15-L151 WeakPolarHBondContact OH-CD2 3.36Å; Y15-L155 HydrophobicContact CD1-CD1 4.12Å; Y15-L155 HydrophobicContact CD2-CD1 4.33Å; Y15-L155 HydrophobicContact CD2-CD2 4.14Å; Y15-L155 HydrophobicContact CG-CD1 3.82Å; Y15-L155 HydrophobicContact CG-CD2 4.17Å
16	F	93.2	Very high	87.1	Confident	34 Å²	34	46 Å²	46	15%	0.149	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.2	-178.5	-48.5	-63.1	0	0	0	110.9	S18 C22 P23 R56 F58 V88	F16-S18 VanDerWaalsContact C-N 3.33Å; F16-C22 WeakPolarHBondContact CB-SG 3.47Å; F16-C22 HydrophobicContact CD1-CB 4.34Å; F16-C22 HydrophobicContact CG-CB 4.26Å; F16-C22 WeakPolarHBondContact CG-SG 3.01Å; F16-P23 HydrophobicContact CE1-CG 4Å; F16-R56 WeakPolarHBondContact CD2-O 3.39Å; F16-R56 HydrophobicContact CE2-CG 4.4Å; F16-F58 HydrophobicContact CE1-CD2 4.22Å; F16-F58 HydrophobicContact CE1-CE2 4.02Å; F16-F58 HydrophobicContact CE1-CZ 4.37Å; F16-F58 HydrophobicContact CE2-CD1 4.34Å; F16-F58 HydrophobicContact CE2-CE1 4.19Å; F16-F58 HydrophobicContact CE2-CZ 4.36Å; F16-F58 AromaticContact CZ-CD1 3.89Å; F16-F58 HydrophobicContact CZ-CD1 3.89Å; F16-F58 AromaticContact CZ-CD2 3.68Å; F16-F58 HydrophobicContact CZ-CD2 3.68Å; F16-F58 AromaticContact CZ-CE1 3.75Å; F16-F58 HydrophobicContact CZ-CE1 3.75Å; F16-F58 AromaticContact CZ-CE2 3.55Å; F16-F58 HydrophobicContact CZ-CE2 3.55Å; F16-F58 AromaticContact CZ-CG 3.85Å; F16-F58 HydrophobicContact CZ-CG 3.85Å; F16-F58 AromaticContact CZ-CZ 3.58Å; F16-F58 HydrophobicContact CZ-CZ 3.58Å; F16-V88 HydrophobicContact CD1-CG2 4.04Å; F16-V88 HydrophobicContact CE1-CG2 4.09Å
17	L	88.5	Confident	88.5	Confident	17 Å²	17	45.4 Å²	45.4	9%	0.089	23%	0.226	C	C	.	.	S	Bend	trans	-75.5	-22	178.7	-64	-175.8	0	0	0	113.3	N87 V89 F124 R159	L17-N87 PolarHBondContact N-O 3.46Å; L17-V89 HydrophobicContact CD1-CG2 3.88Å; L17-V89 HydrophobicContact CD2-CG2 3.66Å; L17-V89 HydrophobicContact CG-CG2 3.73Å; L17-F124 HydrophobicContact CD1-CD2 4.4Å; L17-F124 HydrophobicContact CD1-CE2 3.47Å; L17-F124 VanDerWaalsContact CD1-CE2 3.47Å; L17-F124 HydrophobicContact CD1-CZ 3.75Å; L17-F124 HydrophobicContact CG-CE2 4.49Å; L17-R159 HydrophobicContact CB-CG 4.4Å; L17-R159 HydrophobicContact CD1-CB 4.41Å; L17-R159 HydrophobicContact CD2-CB 4.02Å; L17-R159 PolarHBondContact O-NE 3.35Å; L17-R159 PolarHBondContact O-NH1 3.16Å; L17-R159 PolarHBondContact O-NH2 3.21Å
18	S	84.7	Confident	89.4	Confident	26 Å²	26	38.3 Å²	38.3	18%	0.182	19%	0.193	C	C	.	.			trans	-146	133.1	-179.9	-179.4	0	0	0	0	109.9	F16 Q20 C22	F16-S18 VanDerWaalsContact C-N 3.33Å; S18-Q20 VanDerWaalsContact C-N 3.26Å; S18-Q20 PolarHBondContact O-N 2.91Å; S18-Q20 PolarHBondContact OG-N 2.76Å; S18-C22 PolarHBondContact O-SG 2.97Å
19	E	77.9	Confident	89.6	Confident	178 Å²	178	36 Å²	36	83%	0.832	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-69.2	-23.1	177.4	-68.2	-172.5	166.4	0	0	113.5	D21	E19-D21 VanDerWaalsContact C-N 3.35Å; E19-D21 PolarHBondContact O-N 3.07Å
20	Q	77.3	Confident	89.7	Confident	177 Å²	177	36 Å²	36	83%	0.827	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-74.7	-25.4	-172.7	-67	179.7	-3.1	0	0	113.2	S18	S18-Q20 VanDerWaalsContact C-N 3.26Å; S18-Q20 PolarHBondContact O-N 2.91Å; S18-Q20 PolarHBondContact OG-N 2.76Å
21	D	79.3	Confident	89.7	Confident	108 Å²	108	36.5 Å²	36.5	58%	0.578	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-125.1	28.5	-173.1	-69	-37.3	0	0	0	111.8	E19 N87	E19-D21 VanDerWaalsContact C-N 3.35Å; E19-D21 PolarHBondContact O-N 3.07Å; D21-N87 WeakPolarHBondContact CB-ND2 3.25Å; D21-N87 PolarHBondContact OD2-ND2 3.37Å
22	C	83.6	Confident	89.7	Confident	28 Å²	28	35.8 Å²	35.8	19%	0.189	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-69.1	130.3	176.2	-68.9	0	0	0	0	110.6	F16 S18	F16-C22 WeakPolarHBondContact CB-SG 3.47Å; F16-C22 HydrophobicContact CD1-CB 4.34Å; F16-C22 HydrophobicContact CG-CB 4.26Å; F16-C22 WeakPolarHBondContact CG-SG 3.01Å; S18-C22 PolarHBondContact O-SG 2.97Å
23	P	90.9	Very high	89.5	Confident	7 Å²	7	36.4 Å²	36.4	5%	0.045	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-62.7	147.1	167.9	28	-33.2	0	0	0	110	F16 V28 F58 Y85 V88	F16-P23 HydrophobicContact CE1-CG 4Å; P23-V28 HydrophobicContact CB-CG2 3.92Å; P23-V28 HydrophobicContact CG-CG2 4.12Å; P23-F58 HydrophobicContact CG-CE2 4.46Å; P23-F58 WeakPolarHBondContact O-CZ 3.25Å; P23-Y85 HydrophobicContact CB-CD1 3.65Å; P23-Y85 HydrophobicContact CB-CD2 4.12Å; P23-Y85 HydrophobicContact CB-CE1 3.76Å; P23-Y85 HydrophobicContact CB-CE2 4.24Å; P23-Y85 HydrophobicContact CB-CG 3.83Å; P23-Y85 HydrophobicContact CG-CD1 4.21Å; P23-Y85 HydrophobicContact CG-CD2 4.25Å; P23-Y85 HydrophobicContact CG-CG 3.94Å; P23-V88 HydrophobicContact CG-CG2 3.68Å
24	T	90.3	Very high	89.3	Confident	45 Å²	45	37.5 Å²	37.5	28%	0.276	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-74.1	147.9	167.2	61.4	0	0	0	0	109	S26 N27 V28	T24-S26 PolarHBondContact O-N 3.45Å; T24-N27 WeakPolarHBondContact O-CB 3.12Å; T24-N27 PolarHBondContact O-N 2.85Å; T24-N27 WeakPolarHBondContact OG1-CB 3.45Å; T24-N27 VanDerWaalsContact OG1-CG 3.27Å; T24-N27 PolarHBondContact OG1-N 2.95Å; T24-N27 PolarHBondContact OG1-ND2 2.94Å; T24-V28 PolarHBondContact O-N 2.95Å
25	L	91.4	Very high	89.2	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-52.3	-46.5	174.7	176	61.1	0	0	0	110.3	N27 V28 L29 L48 E50 F58 L315	L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.23Å; L25-V28 WeakPolarHBondContact O-CB 3.34Å; L25-V28 PolarHBondContact O-N 3.16Å; L25-L29 HydrophobicContact CD1-CD1 4.28Å; L25-L29 HydrophobicContact CD1-CD2 4.15Å; L25-L29 HydrophobicContact CD1-CG 4.02Å; L25-L29 HydrophobicContact CG-CD1 3.97Å; L25-L29 HydrophobicContact CG-CG 4.11Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.33Å; L25-L29 PolarHBondContact O-N 3.43Å; L25-L48 HydrophobicContact CD1-CB 4Å; L25-L48 HydrophobicContact CD1-CD2 3.59Å; L25-L48 HydrophobicContact CD1-CG 3.71Å; L25-E50 HydrophobicContact CD2-CB 4.22Å; L25-F58 HydrophobicContact CB-CE1 4.02Å; L25-F58 HydrophobicContact CB-CE2 4.35Å; L25-F58 HydrophobicContact CB-CZ 3.88Å; L25-F58 HydrophobicContact CD1-CD1 4.44Å; L25-F58 HydrophobicContact CD1-CD2 4.33Å; L25-F58 HydrophobicContact CD1-CG 4.3Å; L25-L315 HydrophobicContact CB-CD2 4.15Å; L25-L315 HydrophobicContact CD2-CD1 4.34Å; L25-L315 HydrophobicContact CD2-CD2 4.24Å; L25-L315 HydrophobicContact CG-CD2 4.33Å
26	S	90.1	Very high	89.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-44.6	-50.7	172.1	-179	0	0	0	0	115	T24 V28 L29 A30 R318 F319 D322	T24-S26 PolarHBondContact O-N 3.45Å; S26-V28 VanDerWaalsContact C-N 3.33Å; S26-V28 PolarHBondContact O-N 2.89Å; S26-L29 PolarHBondContact O-N 3Å; S26-A30 WeakPolarHBondContact O-CB 3.35Å; S26-A30 PolarHBondContact O-N 2.78Å; S26-R318 WeakPolarHBondContact OG-CB 3.47Å; S26-R318 PolarHBondContact OG-O 3.08Å; S26-F319 WeakPolarHBondContact OG-CA 3.25Å; S26-F319 PolarHBondContact OG-N 3.17Å; S26-D322 WeakPolarHBondContact CB-OD2 3.32Å; S26-D322 PolarHBondContact OG-OD2 3.4Å
27	N	91.7	Very high	88.7	Confident	49 Å²	49	41.7 Å²	41.7	26%	0.262	22%	0.22	S	C	.	.	H	α-helix	trans	-64.8	-37.8	-179.1	-86.4	-24.8	0	0	0	112.3	T24 L25 M31 Y85 D322	T24-N27 WeakPolarHBondContact O-CB 3.12Å; T24-N27 PolarHBondContact O-N 2.85Å; T24-N27 WeakPolarHBondContact OG1-CB 3.45Å; T24-N27 VanDerWaalsContact OG1-CG 3.27Å; T24-N27 PolarHBondContact OG1-N 2.95Å; T24-N27 PolarHBondContact OG1-ND2 2.94Å; L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.23Å; N27-M31 PolarHBondContact O-N 3.43Å; N27-Y85 PolarHBondContact O-OH 2.81Å; N27-D322 PolarHBondContact OD1-OD1 3.45Å; N27-D322 PolarHBondContact OD1-OD2 3.35Å
28	V	93.5	Very high	88.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-47.5	175.9	-179.2	0	0	0	0	110	P23 T24 L25 S26 A30 M31 V32 L48 F58 I81 Y85	P23-V28 HydrophobicContact CB-CG2 3.92Å; P23-V28 HydrophobicContact CG-CG2 4.12Å; T24-V28 PolarHBondContact O-N 2.95Å; L25-V28 WeakPolarHBondContact O-CB 3.34Å; L25-V28 PolarHBondContact O-N 3.16Å; S26-V28 VanDerWaalsContact C-N 3.33Å; S26-V28 PolarHBondContact O-N 2.89Å; V28-A30 VanDerWaalsContact C-N 3.34Å; V28-A30 PolarHBondContact O-N 3.16Å; V28-M31 WeakPolarHBondContact O-CB 3.49Å; V28-M31 PolarHBondContact O-N 3.35Å; V28-M31 VanDerWaalsContact O-N 3.1Å; V28-V32 HydrophobicContact CG1-CG2 4.49Å; V28-V32 WeakPolarHBondContact O-CG2 3.48Å; V28-V32 PolarHBondContact O-N 3.42Å; V28-L48 HydrophobicContact CB-CD2 4.24Å; V28-L48 HydrophobicContact CG1-CD2 3.64Å; V28-F58 HydrophobicContact CG2-CD2 4.48Å; V28-F58 HydrophobicContact CG2-CE2 4.06Å; V28-I81 HydrophobicContact CG1-CD1 3.83Å; V28-I81 HydrophobicContact CG1-CG1 4.15Å; V28-I81 HydrophobicContact CG1-CG2 3.83Å; V28-I81 HydrophobicContact CG2-CG2 4.3Å; V28-Y85 HydrophobicContact CG2-CD2 4.4Å; V28-Y85 HydrophobicContact CG2-CE2 3.99Å
29	L	92	Very high	89.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-41.9	178.8	-65.1	-171.9	0	0	0	112.8	L25 S26 M31 V32 H33 L48 F319 F350 V353 T354	L25-L29 HydrophobicContact CD1-CD1 4.28Å; L25-L29 HydrophobicContact CD1-CD2 4.15Å; L25-L29 HydrophobicContact CD1-CG 4.02Å; L25-L29 HydrophobicContact CG-CD1 3.97Å; L25-L29 HydrophobicContact CG-CG 4.11Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.33Å; L25-L29 PolarHBondContact O-N 3.43Å; S26-L29 PolarHBondContact O-N 3Å; L29-M31 VanDerWaalsContact C-N 3.29Å; L29-M31 PolarHBondContact O-N 3Å; L29-V32 PolarHBondContact O-N 2.94Å; L29-H33 WeakPolarHBondContact O-CB 2.9Å; L29-H33 PolarHBondContact O-N 2.95Å; L29-L48 HydrophobicContact CD2-CB 3.91Å; L29-F319 HydrophobicContact CB-CD2 3.86Å; L29-F319 HydrophobicContact CB-CE2 3.8Å; L29-F350 HydrophobicContact CD1-CD2 4.16Å; L29-F350 HydrophobicContact CD1-CE2 4.01Å; L29-V353 HydrophobicContact CD2-CB 4.35Å; L29-V353 HydrophobicContact CD2-CG1 3.24Å; L29-V353 HydrophobicContact CG-CG1 4.44Å; L29-T354 HydrophobicContact CD1-CG2 3.64Å
30	A	91.2	Very high	89.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-33.6	177.2	0	0	0	0	0	112	S26 V28 S34 F319 D322 L323	S26-A30 WeakPolarHBondContact O-CB 3.35Å; S26-A30 PolarHBondContact O-N 2.78Å; V28-A30 VanDerWaalsContact C-N 3.34Å; V28-A30 PolarHBondContact O-N 3.16Å; A30-S34 PolarHBondContact O-N 3.29Å; A30-F319 HydrophobicContact CB-CD2 4.27Å; A30-F319 HydrophobicContact CB-CE2 4.24Å; A30-D322 HydrophobicContact CB-CB 3.92Å; A30-L323 HydrophobicContact CB-CG 4.44Å
31	M	93.9	Very high	90.6	Very high	12 Å²	12	27.9 Å²	27.9	6%	0.059	15%	0.153	C	C	.	.	H	α-helix	trans	-67.5	-47.8	173.1	180	174.1	173.7	0	0	111.4	N27 V28 L29 H33 S34 L35 Q80 I81 T84 Y85	N27-M31 PolarHBondContact O-N 3.43Å; V28-M31 WeakPolarHBondContact O-CB 3.49Å; V28-M31 PolarHBondContact O-N 3.35Å; V28-M31 VanDerWaalsContact O-N 3.1Å; L29-M31 VanDerWaalsContact C-N 3.29Å; L29-M31 PolarHBondContact O-N 3Å; M31-H33 VanDerWaalsContact C-N 3.34Å; M31-H33 PolarHBondContact O-N 3.24Å; M31-S34 WeakPolarHBondContact O-CB 3.48Å; M31-S34 PolarHBondContact O-N 3.37Å; M31-L35 HydrophobicContact CE-CD1 3.74Å; M31-L35 HydrophobicContact CG-CD1 4.11Å; M31-L35 WeakPolarHBondContact O-CG 3.42Å; M31-L35 PolarHBondContact O-N 2.77Å; M31-L35 VanDerWaalsContact O-N 3.11Å; M31-Q80 VanDerWaalsContact CE-C 3.46Å; M31-Q80 HydrophobicContact CE-CB 3.57Å; M31-Q80 WeakPolarHBondContact CE-O 3.47Å; M31-I81 HydrophobicContact SD-CG1 4.25Å; M31-T84 VanDerWaalsContact CE-OG1 3.25Å; M31-T84 WeakPolarHBondContact CE-OG1 3.21Å; M31-T84 HydrophobicContact SD-CG2 4.02Å; M31-Y85 HydrophobicContact SD-CE2 4.23Å
32	V	93.9	Very high	91.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.4	-49.3	176.9	173.5	0	0	0	0	110.2	V28 L29 S34 L35 S36 F46 L77 I81 F349	V28-V32 HydrophobicContact CG1-CG2 4.49Å; V28-V32 WeakPolarHBondContact O-CG2 3.48Å; V28-V32 PolarHBondContact O-N 3.42Å; L29-V32 PolarHBondContact O-N 2.94Å; V32-S34 VanDerWaalsContact C-N 3.26Å; V32-S34 PolarHBondContact O-N 3.11Å; V32-L35 PolarHBondContact O-N 2.91Å; V32-S36 WeakPolarHBondContact O-CB 3.27Å; V32-S36 PolarHBondContact O-N 2.86Å; V32-S36 PolarHBondContact O-OG 3.14Å; V32-F46 HydrophobicContact CB-CD1 4.35Å; V32-F46 HydrophobicContact CG1-CB 4Å; V32-F46 HydrophobicContact CG1-CD1 3.7Å; V32-F46 HydrophobicContact CG1-CE1 4.39Å; V32-F46 HydrophobicContact CG1-CG 3.91Å; V32-F46 HydrophobicContact CG2-CD1 3.93Å; V32-F46 HydrophobicContact CG2-CE1 3.77Å; V32-F46 HydrophobicContact CG2-CZ 4.31Å; V32-L77 HydrophobicContact CG1-CD1 4.17Å; V32-I81 HydrophobicContact CG2-CD1 3.73Å; V32-I81 HydrophobicContact CG2-CG1 4.43Å; V32-F349 HydrophobicContact CG1-CZ 4.1Å
33	H	90.3	Very high	91.5	Very high	12 Å²	12	24.1 Å²	24.1	6%	0.056	13%	0.13	C	C	.	.	H	α-helix	trans	-53.6	-44.1	177.3	-176	-59.2	0	0	0	112	L29 M31 L35 E37 L323 Y328 F349	L29-H33 WeakPolarHBondContact O-CB 2.9Å; L29-H33 PolarHBondContact O-N 2.95Å; M31-H33 VanDerWaalsContact C-N 3.34Å; M31-H33 PolarHBondContact O-N 3.24Å; H33-L35 VanDerWaalsContact C-N 3.29Å; H33-L35 PolarHBondContact O-N 2.99Å; H33-E37 PolarHBondContact O-N 3.14Å; H33-E37 VanDerWaalsContact O-N 3.07Å; H33-L323 HydrophobicContact CB-CD2 4.49Å; H33-Y328 AromaticContact CE1-CD2 3.77Å; H33-Y328 AromaticContact CE1-CE2 3.11Å; H33-Y328 WeakPolarHBondContact CE1-CE2 3.47Å; H33-Y328 AromaticContact CE1-CZ 3.51Å; H33-Y328 AromaticContact ND1-CE2 3.86Å; H33-Y328 AromaticContact NE2-CE2 3.88Å; H33-Y328 AromaticContact NE2-CZ 3.8Å; H33-F349 HydrophobicContact CB-CD1 4.14Å; H33-F349 HydrophobicContact CB-CE1 3.66Å; H33-F349 HydrophobicContact CB-CE2 4.24Å; H33-F349 HydrophobicContact CB-CZ 3.71Å; H33-F349 AromaticContact CD2-CD1 3.55Å; H33-F349 AromaticContact CD2-CD2 3.82Å; H33-F349 AromaticContact CD2-CE1 3.99Å; H33-F349 AromaticContact CD2-CG 3.45Å; H33-F349 VanDerWaalsContact CD2-CG 3.45Å; H33-F349 WeakPolarHBondContact CD2-CG 3.37Å
34	S	91.6	Very high	91.4	Very high	66 Å²	66	25.4 Å²	25.4	46%	0.462	14%	0.135	S	C	.	.	H	α-helix	trans	-66.3	-32.5	-179.9	-176.1	0	0	0	0	112.8	A30 M31 V32	A30-S34 PolarHBondContact O-N 3.29Å; M31-S34 WeakPolarHBondContact O-CB 3.48Å; M31-S34 PolarHBondContact O-N 3.37Å; V32-S34 VanDerWaalsContact C-N 3.26Å; V32-S34 PolarHBondContact O-N 3.11Å
35	L	92.4	Very high	91.4	Very high	49 Å²	49	24.2 Å²	24.2	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-84.4	-27.9	-179.4	-68.3	173.8	0	0	0	112.3	M31 V32 H33 L77 Q80	M31-L35 HydrophobicContact CE-CD1 3.74Å; M31-L35 HydrophobicContact CG-CD1 4.11Å; M31-L35 WeakPolarHBondContact O-CG 3.42Å; M31-L35 PolarHBondContact O-N 2.77Å; M31-L35 VanDerWaalsContact O-N 3.11Å; V32-L35 PolarHBondContact O-N 2.91Å; H33-L35 VanDerWaalsContact C-N 3.29Å; H33-L35 PolarHBondContact O-N 2.99Å; L35-L77 HydrophobicContact CB-CD2 3.56Å; L35-L77 HydrophobicContact CD1-CD2 3.91Å; L35-L77 HydrophobicContact CG-CD2 4.4Å; L35-Q80 HydrophobicContact CD1-CB 3.92Å; L35-Q80 HydrophobicContact CD1-CG 4.25Å
36	S	92.3	Very high	91.4	Very high	9 Å²	9	24 Å²	24	6%	0.063	13%	0.128	C	C	.	.	H	α-helix	trans	-104.2	5.1	-176.3	67	0	0	0	0	114.9	V32 N38 Y39	V32-S36 WeakPolarHBondContact O-CB 3.27Å; V32-S36 PolarHBondContact O-N 2.86Å; V32-S36 PolarHBondContact O-OG 3.14Å; S36-N38 PolarHBondContact O-N 3.27Å; S36-Y39 PolarHBondContact O-N 3.01Å
37	E	86.3	Confident	91.4	Very high	86 Å²	86	24.2 Å²	24.2	40%	0.402	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-34.4	-175.9	-173.9	-179.8	179	0	0	113.6	H33	H33-E37 PolarHBondContact O-N 3.14Å; H33-E37 VanDerWaalsContact O-N 3.07Å
38	N	87.8	Confident	91.5	Very high	79 Å²	79	21.9 Å²	21.9	42%	0.422	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	12.1	-178.5	-60.1	-68.3	0	0	0	113.8	S36 W190	S36-N38 PolarHBondContact O-N 3.27Å; N38-W190 HydrophobicContact CB-CH2 3.94Å; N38-W190 HydrophobicContact CB-CZ2 3.63Å; N38-W190 VanDerWaalsContact O-CZ2 3.31Å; N38-W190 WeakPolarHBondContact O-CZ2 3.47Å; N38-W190 PolarHBondContact O-NE1 3.17Å
39	Y	93.3	Very high	91.3	Very high	19 Å²	19	23.5 Å²	23.5	8%	0.075	13%	0.125	C	C	.	.			trans	-89.8	132.7	176.9	-168.8	-93.5	0	0	0	109.7	S36 W41 K69 D70 F73 V186	S36-Y39 PolarHBondContact O-N 3.01Å; Y39-W41 AromaticContact CD1-CD1 3.77Å; Y39-W41 AromaticContact CD1-CD2 3.6Å; Y39-W41 HydrophobicContact CD1-CD2 3.6Å; Y39-W41 AromaticContact CD1-CE2 3.59Å; Y39-W41 HydrophobicContact CD1-CE3 4.16Å; Y39-W41 AromaticContact CD1-CG 3.76Å; Y39-W41 HydrophobicContact CD1-CG 3.76Å; Y39-W41 HydrophobicContact CD1-CZ2 4.16Å; Y39-W41 AromaticContact CD1-NE1 3.68Å; Y39-W41 HydrophobicContact CE1-CB 4.43Å; Y39-W41 AromaticContact CE1-CD2 3.62Å; Y39-W41 HydrophobicContact CE1-CD2 3.62Å; Y39-W41 AromaticContact CE1-CE3 3.73Å; Y39-W41 HydrophobicContact CE1-CE3 3.73Å; Y39-W41 AromaticContact CE1-CG 3.97Å; Y39-W41 HydrophobicContact CE1-CG 3.97Å; Y39-W41 HydrophobicContact CE1-CZ2 4.48Å; Y39-W41 HydrophobicContact CE1-CZ3 4.18Å; Y39-K69 PolarHBondContact OH-O 3.38Å; Y39-D70 WeakPolarHBondContact CE1-OD1 3.37Å; Y39-D70 WeakPolarHBondContact OH-CA 3.33Å; Y39-D70 PolarHBondContact OH-N 3.22Å; Y39-D70 PolarHBondContact OH-OD1 3.18Å; Y39-F73 AromaticContact CD1-CD1 3.73Å; Y39-F73 HydrophobicContact CD1-CD1 3.73Å; Y39-F73 AromaticContact CD1-CE1 3.89Å; Y39-F73 HydrophobicContact CD1-CE1 3.89Å; Y39-F73 AromaticContact CD2-CD1 3.6Å; Y39-F73 HydrophobicContact CD2-CD1 3.6Å; Y39-F73 HydrophobicContact CD2-CD2 4.05Å; Y39-F73 AromaticContact CD2-CE1 3.67Å; Y39-F73 HydrophobicContact CD2-CE1 3.67Å; Y39-F73 HydrophobicContact CD2-CE2 4.11Å; Y39-F73 AromaticContact CD2-CG 3.81Å; Y39-F73 HydrophobicContact CD2-CG 3.81Å; Y39-F73 AromaticContact CD2-CZ 3.92Å; Y39-F73 HydrophobicContact CD2-CZ 3.92Å; Y39-F73 AromaticContact CE1-CD1 3.85Å; Y39-F73 HydrophobicContact CE1-CD1 3.85Å; Y39-F73 HydrophobicContact CE1-CE1 4.47Å; Y39-F73 HydrophobicContact CE1-CG 4.4Å; Y39-F73 HydrophobicContact CE2-CB 3.9Å; Y39-F73 AromaticContact CE2-CD1 3.76Å; Y39-F73 HydrophobicContact CE2-CD1 3.76Å; Y39-F73 HydrophobicContact CE2-CD2 4.1Å; Y39-F73 HydrophobicContact CE2-CE1 4.3Å; Y39-F73 AromaticContact CE2-CG 3.65Å; Y39-F73 HydrophobicContact CE2-CG 3.65Å; Y39-F73 AromaticContact CG-CD1 3.61Å; Y39-F73 HydrophobicContact CG-CD1 3.61Å; Y39-F73 AromaticContact CG-CE1 3.45Å; Y39-F73 HydrophobicContact CG-CE1 3.45Å; Y39-F73 VanDerWaalsContact CG-CE1 3.45Å; Y39-F73 HydrophobicContact CG-CG 4.29Å; Y39-F73 HydrophobicContact CG-CZ 4.02Å; Y39-F73 AromaticContact CZ-CD1 3.89Å; Y39-F73 AromaticContact CZ-CG 3.98Å; Y39-V186 HydrophobicContact CD2-CB 4.28Å; Y39-V186 HydrophobicContact CD2-CG1 3.53Å; Y39-V186 HydrophobicContact CD2-CG2 3.68Å; Y39-V186 HydrophobicContact CE2-CG1 4.15Å; Y39-V186 HydrophobicContact CE2-CG2 4.04Å; Y39-V186 HydrophobicContact CG-CG1 4.47Å
40	I	93.8	Very high	91.3	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	14%	0.141	C	C	.	.			trans	-103	106.3	173.9	-61.1	173	0	0	0	107	E209 I212 A213 R246 T248 L251	I40-E209 HydrophobicContact CD1-CB 4.45Å; I40-I212 HydrophobicContact CG2-CG2 4.05Å; I40-A213 HydrophobicContact CG2-CB 4.36Å; I40-R246 HydrophobicContact CD1-CB 4.47Å; I40-R246 HydrophobicContact CD1-CG 4.05Å; I40-T248 HydrophobicContact CB-CG2 4.09Å; I40-T248 HydrophobicContact CG2-CG2 4.41Å; I40-T248 WeakPolarHBondContact O-CG2 3.33Å; I40-L251 HydrophobicContact CG2-CD1 4.04Å
41	W	93.8	Very high	91.2	Very high	5 Å²	5	30.5 Å²	30.5	2%	0.019	16%	0.156	C	C	.	.			trans	-69.3	141.8	177	-61.8	86.5	0	0	0	110.6	Y39 C45 F46 V62 D70 F73 V74 L77 Q210 A213	Y39-W41 AromaticContact CD1-CD1 3.77Å; Y39-W41 AromaticContact CD1-CD2 3.6Å; Y39-W41 HydrophobicContact CD1-CD2 3.6Å; Y39-W41 AromaticContact CD1-CE2 3.59Å; Y39-W41 HydrophobicContact CD1-CE3 4.16Å; Y39-W41 AromaticContact CD1-CG 3.76Å; Y39-W41 HydrophobicContact CD1-CG 3.76Å; Y39-W41 HydrophobicContact CD1-CZ2 4.16Å; Y39-W41 AromaticContact CD1-NE1 3.68Å; Y39-W41 HydrophobicContact CE1-CB 4.43Å; Y39-W41 AromaticContact CE1-CD2 3.62Å; Y39-W41 HydrophobicContact CE1-CD2 3.62Å; Y39-W41 AromaticContact CE1-CE3 3.73Å; Y39-W41 HydrophobicContact CE1-CE3 3.73Å; Y39-W41 AromaticContact CE1-CG 3.97Å; Y39-W41 HydrophobicContact CE1-CG 3.97Å; Y39-W41 HydrophobicContact CE1-CZ2 4.48Å; Y39-W41 HydrophobicContact CE1-CZ3 4.18Å; W41-C45 HydrophobicContact CD2-CB 4.4Å; W41-C45 HydrophobicContact CG-CB 4.11Å; W41-F46 HydrophobicContact CH2-CB 4.06Å; W41-F46 HydrophobicContact CZ2-CB 3.89Å; W41-V62 HydrophobicContact CZ3-CG1 4.43Å; W41-D70 HydrophobicContact CE3-CB 4.14Å; W41-D70 HydrophobicContact CZ3-CB 4.25Å; W41-F73 AromaticContact CH2-CD1 3.64Å; W41-F73 HydrophobicContact CH2-CD1 3.64Å; W41-F73 HydrophobicContact CH2-CE1 4.27Å; W41-F73 AromaticContact CZ2-CD1 3.72Å; W41-F73 HydrophobicContact CZ2-CD1 3.72Å; W41-F73 AromaticContact CZ2-CE1 3.9Å; W41-F73 HydrophobicContact CZ2-CE1 3.9Å; W41-F73 HydrophobicContact CZ3-CD1 4.34Å; W41-V74 HydrophobicContact CH2-CG2 3.81Å; W41-V74 HydrophobicContact CZ3-CG2 3.72Å; W41-L77 HydrophobicContact CH2-CD1 4.04Å; W41-L77 HydrophobicContact CZ2-CD1 4.04Å; W41-Q210 PolarHBondContact O-NE2 2.98Å; W41-A213 WeakPolarHBondContact O-CB 3.46Å
42	Y	93.3	Very high	90.7	Very high	21 Å²	21	35.3 Å²	35.3	8%	0.082	18%	0.182	C	C	.	.	S	Bend	trans	-69.5	-50.8	176.2	172	-106.5	0	0	0	111.8	Y64 C67 D70 R217 M250 L251 M254	Y42-Y64 VanDerWaalsContact CD1-O 3.28Å; Y42-Y64 WeakPolarHBondContact CD1-O 3.35Å; Y42-C67 HydrophobicContact CD1-CB 4.06Å; Y42-C67 HydrophobicContact CG-CB 3.75Å; Y42-D70 WeakPolarHBondContact CB-OD2 3.24Å; Y42-D70 PolarHBondContact N-OD2 2.97Å; Y42-R217 HydrophobicContact CD2-CG 4.5Å; Y42-R217 HydrophobicContact CE2-CG 3.84Å; Y42-R217 WeakPolarHBondContact O-CD 3.41Å; Y42-R217 PolarHBondContact O-NH1 3.1Å; Y42-M250 HydrophobicContact CD1-CE 4.31Å; Y42-M250 HydrophobicContact CD2-CE 3.02Å; Y42-M250 HydrophobicContact CE2-CE 3.36Å; Y42-M250 HydrophobicContact CG-CE 3.54Å; Y42-L251 HydrophobicContact CD2-CD2 3.73Å; Y42-L251 HydrophobicContact CD2-CG 4.48Å; Y42-L251 HydrophobicContact CE2-CD2 4.01Å; Y42-M254 HydrophobicContact CE2-CE 4.35Å; Y42-M254 HydrophobicContact CE2-SD 3.92Å
43	D	88.7	Confident	89.8	Confident	37 Å²	37	41 Å²	41	20%	0.198	22%	0.217	C	C	.	.	S	Bend	trans	-120.6	-77.7	-179.7	-171.3	31	0	0	0	111.4	H63 R217	D43-H63 WeakPolarHBondContact OD2-CB 3.35Å; D43-R217 IonicContact OD1-CZ 3.82Å; D43-R217 IonicContact OD1-NE 3.42Å; D43-R217 PolarHBondContact OD1-NE 2.82Å; D43-R217 VanDerWaalsContact OD1-NE 3.14Å; D43-R217 IonicContact OD1-NH1 2.69Å; D43-R217 IonicContact OD1-NH2 3.87Å; D43-R217 PolarHBondContact OD1-NH2 3.07Å
44	E	88	Confident	89.1	Confident	33 Å²	33	46.1 Å²	46.1	15%	0.154	25%	0.251	C	S	.	.			trans	-108	140.9	-179.3	-61.2	-156.4	117.1	0	0	114	V62 H63 K359	E44-V62 HydrophobicContact CB-CG1 4.35Å; E44-V62 WeakPolarHBondContact O-CG1 3.2Å; E44-H63 HydrophobicContact CG-CB 4.02Å; E44-H63 PolarHBondContact N-O 3.09Å; E44-H63 IonicContact OE2-CD2 3.75Å; E44-H63 PolarHBondContact OE2-CD2 3.48Å; E44-H63 IonicContact OE2-CG 2.64Å; E44-H63 PolarHBondContact OE2-N 3.21Å; E44-K359 IonicContact OE1-NZ 2.62Å; E44-K359 PolarHBondContact OE1-NZ 2.62Å
45	C	89.7	Confident	88.7	Confident	21 Å²	21	46 Å²	46	14%	0.142	25%	0.248	C	C	.	.			trans	-73.5	154.8	169	-52.5	0	0	0	0	111	W41 C47	W41-C45 HydrophobicContact CD2-CB 4.4Å; W41-C45 HydrophobicContact CG-CB 4.11Å; C45-C47 PolarHBondContact O-N 3Å
46	F	92.3	Very high	88.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	25%	0.254	C	S	.	.			trans	-43.7	131.2	169	-171.5	-85.8	0	0	0	112	Y12 F14 V32 W41 L48 V74 L77 L78 I81 V353	Y12-F46 HydrophobicContact CD2-CE2 4.46Å; Y12-F46 HydrophobicContact CD2-CZ 4.37Å; Y12-F46 HydrophobicContact CE1-CD2 4.43Å; Y12-F46 HydrophobicContact CE1-CE2 4.12Å; Y12-F46 HydrophobicContact CE2-CD2 4.38Å; Y12-F46 HydrophobicContact CE2-CE1 4.19Å; Y12-F46 AromaticContact CE2-CE2 3.59Å; Y12-F46 HydrophobicContact CE2-CE2 3.59Å; Y12-F46 AromaticContact CE2-CZ 3.48Å; Y12-F46 HydrophobicContact CE2-CZ 3.48Å; Y12-F46 VanDerWaalsContact CE2-CZ 3.48Å; Y12-F46 AromaticContact CZ-CD2 3.79Å; Y12-F46 AromaticContact CZ-CE2 3.4Å; Y12-F46 VanDerWaalsContact CZ-CE2 3.4Å; Y12-F46 AromaticContact CZ-CZ 3.76Å; Y12-F46 VanDerWaalsContact OH-CD2 3.22Å; Y12-F46 WeakPolarHBondContact OH-CD2 3.21Å; Y12-F46 VanDerWaalsContact OH-CE2 3.3Å; Y12-F46 WeakPolarHBondContact OH-CE2 3.45Å; F14-F46 HydrophobicContact CE2-CZ 4.44Å; F14-F46 HydrophobicContact CZ-CZ 4.33Å; V32-F46 HydrophobicContact CB-CD1 4.35Å; V32-F46 HydrophobicContact CG1-CB 4Å; V32-F46 HydrophobicContact CG1-CD1 3.7Å; V32-F46 HydrophobicContact CG1-CE1 4.39Å; V32-F46 HydrophobicContact CG1-CG 3.91Å; V32-F46 HydrophobicContact CG2-CD1 3.93Å; V32-F46 HydrophobicContact CG2-CE1 3.77Å; V32-F46 HydrophobicContact CG2-CZ 4.31Å; W41-F46 HydrophobicContact CH2-CB 4.06Å; W41-F46 HydrophobicContact CZ2-CB 3.89Å; F46-L48 HydrophobicContact CE1-CB 3.95Å; F46-L48 HydrophobicContact CE1-CD2 4.41Å; F46-V74 HydrophobicContact CD2-CG1 4.46Å; F46-V74 HydrophobicContact CE2-CG1 4.45Å; F46-L77 HydrophobicContact CB-CD1 4.24Å; F46-L77 HydrophobicContact CD2-CD1 3.92Å; F46-L77 HydrophobicContact CG-CD1 4.23Å; F46-L78 HydrophobicContact CE2-CD2 3.79Å; F46-L78 HydrophobicContact CZ-CD2 4.08Å; F46-I81 HydrophobicContact CZ-CD1 4.23Å; F46-V353 HydrophobicContact CD1-CG1 4.37Å; F46-V353 VanDerWaalsContact O-CG1 3.29Å; F46-V353 WeakPolarHBondContact O-CG1 3.43Å; F46-V353 WeakPolarHBondContact O-CG2 3.41Å
47	C	90.8	Very high	88.6	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.034	25%	0.253	C	S	.	.			trans	-127.2	148.6	-179.2	93.7	0	0	0	0	110.2	Y12 C45 G60 K61 V353 N356	Y12-C47 VanDerWaalsContact CE2-O 3.3Å; Y12-C47 WeakPolarHBondContact CE2-O 3.39Å; Y12-C47 PolarHBondContact OH-N 2.67Å; Y12-C47 VanDerWaalsContact OH-N 3.17Å; Y12-C47 PolarHBondContact OH-O 3.09Å; C45-C47 PolarHBondContact O-N 3Å; C47-G60 WeakPolarHBondContact O-CA 3.28Å; C47-K61 PolarHBondContact SG-N 2.63Å; C47-K61 PolarHBondContact SG-O 3.35Å; C47-V353 CarbonylContact C-O 3.55Å; C47-V353 WeakPolarHBondContact CA-O 3.17Å; C47-N356 PolarHBondContact SG-OD1 3.38Å
48	L	92.1	Very high	89	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.			trans	-154.9	124.8	177.8	-161.2	69.9	0	0	0	110.8	Y12 F14 L25 V28 L29 F46 F58 V353	Y12-L48 HydrophobicContact CD2-CD1 4.19Å; Y12-L48 HydrophobicContact CE2-CD1 3.87Å; F14-L48 HydrophobicContact CD2-CD1 3.73Å; F14-L48 HydrophobicContact CE2-CD1 3.68Å; L25-L48 HydrophobicContact CD1-CB 4Å; L25-L48 HydrophobicContact CD1-CD2 3.59Å; L25-L48 HydrophobicContact CD1-CG 3.71Å; V28-L48 HydrophobicContact CB-CD2 4.24Å; V28-L48 HydrophobicContact CG1-CD2 3.64Å; L29-L48 HydrophobicContact CD2-CB 3.91Å; F46-L48 HydrophobicContact CE1-CB 3.95Å; F46-L48 HydrophobicContact CE1-CD2 4.41Å; L48-F58 HydrophobicContact CD1-CB 3.7Å; L48-F58 HydrophobicContact CD2-CB 3.97Å; L48-F58 HydrophobicContact CD2-CD2 3.93Å; L48-F58 HydrophobicContact CD2-CG 4.25Å; L48-F58 HydrophobicContact CG-CB 3.75Å; L48-F58 HydrophobicContact CG-CG 4.42Å; L48-V353 PolarHBondContact N-O 2.85Å
49	I	91.1	Very high	89.3	Confident	34 Å²	34	41.7 Å²	41.7	17%	0.174	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.5	176.4	60	167.8	0	0	0	110.6	K51 F58 Y59 T354 N356	I49-K51 HydrophobicContact CD1-CG 4.48Å; I49-F58 CarbonylContact O-C 3.48Å; I49-F58 VanDerWaalsContact O-CA 3.27Å; I49-F58 WeakPolarHBondContact O-CA 3.39Å; I49-Y59 HydrophobicContact CD1-CD1 4.15Å; I49-Y59 HydrophobicContact CG1-CD1 4.15Å; I49-Y59 VanDerWaalsContact CG1-O 3.27Å; I49-Y59 WeakPolarHBondContact CG1-O 3.21Å; I49-Y59 PolarHBondContact N-O 2.79Å; I49-Y59 PolarHBondContact O-N 2.93Å; I49-T354 VanDerWaalsContact CG2-O 3.24Å; I49-T354 WeakPolarHBondContact CG2-O 3.15Å; I49-N356 HydrophobicContact CD1-CB 4.06Å; I49-N356 HydrophobicContact CG2-CB 4.41Å
50	E	90.6	Very high	89.3	Confident	70 Å²	70	40.8 Å²	40.8	33%	0.327	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.6	175.8	-176.1	164.5	-155.8	0	0	110.1	L25 R56 F58	L25-E50 HydrophobicContact CD2-CB 4.22Å; E50-R56 IonicContact OE1-CZ 3.92Å; E50-R56 IonicContact OE1-NE 3.94Å; E50-R56 PolarHBondContact OE1-NE 2.9Å; E50-R56 IonicContact OE1-NH2 3.24Å; E50-R56 PolarHBondContact OE1-NH2 3.37Å; E50-F58 HydrophobicContact CB-CD1 3.92Å; E50-F58 HydrophobicContact CB-CE1 4.05Å; E50-F58 HydrophobicContact CG-CD1 3.95Å; E50-F58 HydrophobicContact CG-CE1 3.8Å
51	K	89.3	Confident	89.2	Confident	76 Å²	76	41.9 Å²	41.9	33%	0.33	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.2	177.1	-71.6	-173.8	176	174.9	0	109.6	I49 R56 H57 Y59	I49-K51 HydrophobicContact CD1-CG 4.48Å; K51-R56 CarbonylContact O-C 3.52Å; K51-R56 WeakPolarHBondContact O-CA 3.42Å; K51-H57 PolarHBondContact N-O 3.27Å; K51-H57 PolarHBondContact O-N 2.86Å; K51-H57 VanDerWaalsContact O-O 3.05Å; K51-Y59 HydrophobicContact CD-CD1 4.3Å; K51-Y59 HydrophobicContact CD-CG 4.32Å
52	D	82.6	Confident	89.1	Confident	113 Å²	113	41.6 Å²	41.6	60%	0.604	22%	0.218	S	C	*	.			trans	-102.5	-7.7	-176.5	-68.5	-44.7	0	0	0	114.5	V55	D52-V55 CarbonylContact O-C 3.45Å
53	V	76.6	Confident	89	Confident	121 Å²	121	42.3 Å²	42.3	73%	0.733	22%	0.221	S	C	*	.	S	Bend	trans	-126	132.7	-172	-174.9	0	0	0	0	110.6	H57	V53-H57 PolarHBondContact O-CE1 3.05Å
54	P	75.3	Confident	89.1	Confident	119 Å²	119	41.3 Å²	41.3	77%	0.773	22%	0.215	S	C	*	.	S	Bend	cis	-76.9	-19.4	-0.2	30.5	-34.6	0	0	0	114.5
55	V	83.5	Confident	89	Confident	63 Å²	63	40.4 Å²	40.4	38%	0.382	22%	0.215	S	C	.	.	S	Bend	trans	-133.6	153.1	174.9	-116.6	0	0	0	0	107.4	D52 H57	D52-V55 CarbonylContact O-C 3.45Å; V55-H57 PolarHBondContact O-N 3.28Å; V55-H57 PolarHBondContact O-ND1 3.5Å
56	R	89.5	Confident	88.6	Confident	102 Å²	102	43.5 Å²	43.5	39%	0.385	24%	0.237	S	C	.	.			trans	-61	120.4	173.8	-174.3	179.8	172.6	-139.5	-5.3	110.2	F16 E50 K51	F16-R56 WeakPolarHBondContact CD2-O 3.39Å; F16-R56 HydrophobicContact CE2-CG 4.4Å; E50-R56 IonicContact OE1-CZ 3.92Å; E50-R56 IonicContact OE1-NE 3.94Å; E50-R56 PolarHBondContact OE1-NE 2.9Å; E50-R56 IonicContact OE1-NH2 3.24Å; E50-R56 PolarHBondContact OE1-NH2 3.37Å; K51-R56 CarbonylContact O-C 3.52Å; K51-R56 WeakPolarHBondContact O-CA 3.42Å
57	H	92.3	Very high	88.4	Confident	9 Å²	9	43.7 Å²	43.7	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161.8	179.6	64.2	-78.1	0	0	0	109.9	W13 F14 Y15 K51 V53 V55	W13-H57 AromaticContact CD1-CD2 3.75Å; W13-H57 AromaticContact CD1-NE2 3.82Å; F14-H57 VanDerWaalsContact O-CA 3.25Å; F14-H57 WeakPolarHBondContact O-CA 3.3Å; F14-H57 VanDerWaalsContact O-CB 3.23Å; F14-H57 WeakPolarHBondContact O-CB 3.28Å; Y15-H57 HydrophobicContact CD1-CB 3.79Å; Y15-H57 HydrophobicContact CE1-CB 3.91Å; K51-H57 PolarHBondContact N-O 3.27Å; K51-H57 PolarHBondContact O-N 2.86Å; K51-H57 VanDerWaalsContact O-O 3.05Å; V53-H57 PolarHBondContact O-CE1 3.05Å; V55-H57 PolarHBondContact O-N 3.28Å; V55-H57 PolarHBondContact O-ND1 3.5Å
58	F	94.7	Very high	88.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	146.5	162.5	-48.5	-34.5	0	0	0	110	W13 F14 F16 P23 L25 V28 L48 I49 E50	W13-F58 CarbonylContact C-O 3.34Å; W13-F58 VanDerWaalsContact CA-O 3.31Å; W13-F58 WeakPolarHBondContact CA-O 3.17Å; F14-F58 HydrophobicContact CB-CB 3.88Å; F14-F58 HydrophobicContact CB-CD2 4.29Å; F14-F58 HydrophobicContact CB-CG 4.41Å; F14-F58 HydrophobicContact CD2-CB 4.36Å; F14-F58 HydrophobicContact CG-CB 4.27Å; F14-F58 PolarHBondContact N-O 3.21Å; F14-F58 PolarHBondContact O-N 2.91Å; F16-F58 HydrophobicContact CE1-CD2 4.22Å; F16-F58 HydrophobicContact CE1-CE2 4.02Å; F16-F58 HydrophobicContact CE1-CZ 4.37Å; F16-F58 HydrophobicContact CE2-CD1 4.34Å; F16-F58 HydrophobicContact CE2-CE1 4.19Å; F16-F58 HydrophobicContact CE2-CZ 4.36Å; F16-F58 AromaticContact CZ-CD1 3.89Å; F16-F58 HydrophobicContact CZ-CD1 3.89Å; F16-F58 AromaticContact CZ-CD2 3.68Å; F16-F58 HydrophobicContact CZ-CD2 3.68Å; F16-F58 AromaticContact CZ-CE1 3.75Å; F16-F58 HydrophobicContact CZ-CE1 3.75Å; F16-F58 AromaticContact CZ-CE2 3.55Å; F16-F58 HydrophobicContact CZ-CE2 3.55Å; F16-F58 AromaticContact CZ-CG 3.85Å; F16-F58 HydrophobicContact CZ-CG 3.85Å; F16-F58 AromaticContact CZ-CZ 3.58Å; F16-F58 HydrophobicContact CZ-CZ 3.58Å; P23-F58 HydrophobicContact CG-CE2 4.46Å; P23-F58 WeakPolarHBondContact O-CZ 3.25Å; L25-F58 HydrophobicContact CB-CE1 4.02Å; L25-F58 HydrophobicContact CB-CE2 4.35Å; L25-F58 HydrophobicContact CB-CZ 3.88Å; L25-F58 HydrophobicContact CD1-CD1 4.44Å; L25-F58 HydrophobicContact CD1-CD2 4.33Å; L25-F58 HydrophobicContact CD1-CG 4.3Å; V28-F58 HydrophobicContact CG2-CD2 4.48Å; V28-F58 HydrophobicContact CG2-CE2 4.06Å; L48-F58 HydrophobicContact CD1-CB 3.7Å; L48-F58 HydrophobicContact CD2-CB 3.97Å; L48-F58 HydrophobicContact CD2-CD2 3.93Å; L48-F58 HydrophobicContact CD2-CG 4.25Å; L48-F58 HydrophobicContact CG-CB 3.75Å; L48-F58 HydrophobicContact CG-CG 4.42Å; I49-F58 CarbonylContact O-C 3.48Å; I49-F58 VanDerWaalsContact O-CA 3.27Å; I49-F58 WeakPolarHBondContact O-CA 3.39Å; E50-F58 HydrophobicContact CB-CD1 3.92Å; E50-F58 HydrophobicContact CB-CE1 4.05Å; E50-F58 HydrophobicContact CG-CD1 3.95Å; E50-F58 HydrophobicContact CG-CE1 3.8Å
59	Y	94.2	Very high	88.2	Confident	22 Å²	22	52.8 Å²	52.8	9%	0.086	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.7	179.1	170.7	-108.9	0	0	0	109	E11 Y12 W13 I49 K51 N356	E11-Y59 HydrophobicContact CB-CE2 4.32Å; E11-Y59 HydrophobicContact CG-CE2 4.49Å; E11-Y59 WeakPolarHBondContact OE2-CE2 3.47Å; E11-Y59 PolarHBondContact OE2-OH 3Å; Y12-Y59 WeakPolarHBondContact O-CA 3.37Å; Y12-Y59 WeakPolarHBondContact O-CD2 3.31Å; W13-Y59 AromaticContact CD1-CD2 3.49Å; W13-Y59 VanDerWaalsContact CD1-CD2 3.49Å; W13-Y59 HydrophobicContact CD2-CD2 4.17Å; W13-Y59 HydrophobicContact CD2-CE2 4.4Å; W13-Y59 AromaticContact CE2-CD2 3.65Å; W13-Y59 AromaticContact CE2-CE2 3.59Å; W13-Y59 HydrophobicContact CG-CD2 4.07Å; W13-Y59 HydrophobicContact CZ2-CD2 4.25Å; W13-Y59 AromaticContact CZ2-CE2 3.71Å; W13-Y59 HydrophobicContact CZ2-CE2 3.71Å; W13-Y59 AromaticContact NE1-CD2 3.18Å; W13-Y59 AromaticContact NE1-CE2 3.49Å; I49-Y59 HydrophobicContact CD1-CD1 4.15Å; I49-Y59 HydrophobicContact CG1-CD1 4.15Å; I49-Y59 VanDerWaalsContact CG1-O 3.27Å; I49-Y59 WeakPolarHBondContact CG1-O 3.21Å; I49-Y59 PolarHBondContact N-O 2.79Å; I49-Y59 PolarHBondContact O-N 2.93Å; K51-Y59 HydrophobicContact CD-CD1 4.3Å; K51-Y59 HydrophobicContact CD-CG 4.32Å; Y59-N356 WeakPolarHBondContact CD1-ND2 3.28Å; Y59-N356 WeakPolarHBondContact CE1-ND2 3.37Å
60	G	93.3	Very high	88.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	162.1	171.2	0	0	0	0	0	110.9	Y12 C47	Y12-G60 PolarHBondContact N-O 3.49Å; Y12-G60 PolarHBondContact O-N 3.01Å; C47-G60 WeakPolarHBondContact O-CA 3.28Å
61	K	92.3	Very high	88.3	Confident	26 Å²	26	48.7 Å²	48.7	11%	0.113	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	137.4	-178.7	177.2	-173.7	166.5	-164.5	0	107.6	V9 V10 E11 C47 H63	V9-K61 HydrophobicContact CG1-CD 3.9Å; V9-K61 HydrophobicContact CG1-CG 3.47Å; V9-K61 VanDerWaalsContact CG1-CG 3.47Å; V10-K61 CarbonylContact O-C 3.56Å; V10-K61 WeakPolarHBondContact O-CA 3.48Å; E11-K61 HydrophobicContact CG-CB 4.27Å; E11-K61 HydrophobicContact CG-CD 4.45Å; E11-K61 HydrophobicContact CG-CG 4Å; C47-K61 PolarHBondContact SG-N 2.63Å; C47-K61 PolarHBondContact SG-O 3.35Å; K61-H63 WeakPolarHBondContact CE-NE2 3.44Å; K61-H63 PolarHBondContact NZ-NE2 3.23Å
62	V	91.9	Very high	88.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.5	176.7	175.6	0	0	0	0	108	V9 V10 Y12 W41 E44 V74	V9-V62 WeakPolarHBondContact CA-O 3.48Å; V10-V62 PolarHBondContact N-O 3.33Å; V10-V62 PolarHBondContact O-N 3.24Å; Y12-V62 HydrophobicContact CE1-CG2 3.89Å; Y12-V62 VanDerWaalsContact OH-CG2 3.28Å; Y12-V62 WeakPolarHBondContact OH-CG2 3.41Å; W41-V62 HydrophobicContact CZ3-CG1 4.43Å; E44-V62 HydrophobicContact CB-CG1 4.35Å; E44-V62 WeakPolarHBondContact O-CG1 3.2Å; V62-V74 HydrophobicContact CB-CG2 4.29Å; V62-V74 HydrophobicContact CG1-CG2 4.26Å; V62-V74 HydrophobicContact CG2-CG2 4.13Å
63	H	90.3	Very high	89.1	Confident	35 Å²	35	40.8 Å²	40.8	16%	0.162	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.1	161.4	-75.6	-94.2	0	0	0	108.7	T6 D8 V9 D43 E44 K61	T6-H63 PolarHBondContact OG1-CE1 2.88Å; D8-H63 CarbonylContact O-C 3.58Å; D8-H63 WeakPolarHBondContact O-CA 3.47Å; D8-H63 IonicContact OD1-ND1 3Å; D8-H63 IonicContact OD2-ND1 2.72Å; V9-H63 WeakPolarHBondContact CG2-CE1 3.43Å; V9-H63 WeakPolarHBondContact CG2-ND1 3.48Å; D43-H63 WeakPolarHBondContact OD2-CB 3.35Å; E44-H63 HydrophobicContact CG-CB 4.02Å; E44-H63 PolarHBondContact N-O 3.09Å; E44-H63 IonicContact OE2-CD2 3.75Å; E44-H63 PolarHBondContact OE2-CD2 3.48Å; E44-H63 IonicContact OE2-CG 2.64Å; E44-H63 PolarHBondContact OE2-N 3.21Å; K61-H63 WeakPolarHBondContact CE-NE2 3.44Å; K61-H63 PolarHBondContact NZ-NE2 3.23Å
64	Y	90.3	Very high	90	Very high	17 Å²	17	35.1 Å²	35.1	7%	0.067	19%	0.188	C	C	.	.			trans	-94.8	-11.2	177.5	62.3	-100.6	0	0	0	112.2	E7 D8 V10 Y42 S66 C67 E71	E7-Y64 PolarHBondContact O-OH 2.82Å; D8-Y64 HydrophobicContact CB-CE2 4.32Å; D8-Y64 VanDerWaalsContact O-CD1 3.25Å; D8-Y64 WeakPolarHBondContact O-CD1 3.34Å; D8-Y64 PolarHBondContact O-N 2.75Å; V10-Y64 HydrophobicContact CG2-CD1 3.73Å; V10-Y64 HydrophobicContact CG2-CE1 3.68Å; Y42-Y64 VanDerWaalsContact CD1-O 3.28Å; Y42-Y64 WeakPolarHBondContact CD1-O 3.35Å; Y64-S66 PolarHBondContact O-N 2.79Å; Y64-C67 PolarHBondContact O-N 3.18Å; Y64-C67 VanDerWaalsContact O-N 3.08Å; Y64-E71 HydrophobicContact CD1-CB 4.3Å; Y64-E71 HydrophobicContact CG-CB 4.36Å
65	G	85.8	Confident	91	Very high	14 Å²	14	29.4 Å²	29.4	14%	0.144	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-121.6	178.3	0	0	0	0	0	111.6	D8	D8-G65 WeakPolarHBondContact CB-O 3.4Å; D8-G65 WeakPolarHBondContact OD2-CA 3Å
66	S	81.8	Confident	91.6	Very high	86 Å²	86	26.8 Å²	26.8	60%	0.601	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.1	12.9	179.8	-46.7	0	0	0	0	113.1	Y64	Y64-S66 PolarHBondContact O-N 2.79Å
67	C	88.7	Confident	91.9	Very high	5 Å²	5	22 Å²	22	3%	0.034	12%	0.117	C	C	.	.			trans	-108.6	90.6	-174.9	-168.2	0	0	0	0	111.7	Y42 Y64 K69 D70 M250	Y42-C67 HydrophobicContact CD1-CB 4.06Å; Y42-C67 HydrophobicContact CG-CB 3.75Å; Y64-C67 PolarHBondContact O-N 3.18Å; Y64-C67 VanDerWaalsContact O-N 3.08Å; C67-K69 PolarHBondContact O-N 3.29Å; C67-D70 HydrophobicContact CB-CB 4.27Å; C67-D70 WeakPolarHBondContact O-CB 3.46Å; C67-D70 PolarHBondContact O-N 3.44Å; C67-D70 PolarHBondContact SG-OD1 3.43Å; C67-D70 VanDerWaalsContact SG-OD1 3.33Å; C67-M250 HydrophobicContact CB-CE 3.63Å; C67-M250 HydrophobicContact CB-SD 4.18Å
68	D	86.8	Confident	92.1	Very high	110 Å²	110	21.5 Å²	21.5	59%	0.588	12%	0.115	S	C	*	.	H	α-helix	trans	-59.2	-24.4	176.7	-52.1	-17.7	0	0	0	112.4	D70 E71 E72	D68-D70 VanDerWaalsContact C-N 3.29Å; D68-D70 PolarHBondContact O-N 3Å; D68-E71 WeakPolarHBondContact O-CB 3.29Å; D68-E71 PolarHBondContact O-N 3.38Å; D68-E72 PolarHBondContact O-N 2.94Å
69	K	91	Very high	92.2	Very high	86 Å²	86	22 Å²	22	37%	0.374	12%	0.117	S	C	.	.	H	α-helix	trans	-65.9	-30.5	175	-62.4	-172.4	-176.3	-176.5	0	112.8	Y39 C67 E72 F73 D189	Y39-K69 PolarHBondContact OH-O 3.38Å; C67-K69 PolarHBondContact O-N 3.29Å; K69-E72 PolarHBondContact O-N 2.87Å; K69-F73 VanDerWaalsContact O-CB 3.31Å; K69-F73 WeakPolarHBondContact O-CB 3.47Å; K69-F73 PolarHBondContact O-N 2.94Å; K69-D189 IonicContact NZ-OD1 2.68Å; K69-D189 PolarHBondContact NZ-OD1 3Å
70	D	93	Very high	92.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.1	-41.1	174.6	-78.3	19.2	0	0	0	109.9	Y39 W41 Y42 C67 D68 F73 V74	Y39-D70 WeakPolarHBondContact CE1-OD1 3.37Å; Y39-D70 WeakPolarHBondContact OH-CA 3.33Å; Y39-D70 PolarHBondContact OH-N 3.22Å; Y39-D70 PolarHBondContact OH-OD1 3.18Å; W41-D70 HydrophobicContact CE3-CB 4.14Å; W41-D70 HydrophobicContact CZ3-CB 4.25Å; Y42-D70 WeakPolarHBondContact CB-OD2 3.24Å; Y42-D70 PolarHBondContact N-OD2 2.97Å; C67-D70 HydrophobicContact CB-CB 4.27Å; C67-D70 WeakPolarHBondContact O-CB 3.46Å; C67-D70 PolarHBondContact O-N 3.44Å; C67-D70 PolarHBondContact SG-OD1 3.43Å; C67-D70 VanDerWaalsContact SG-OD1 3.33Å; D68-D70 VanDerWaalsContact C-N 3.29Å; D68-D70 PolarHBondContact O-N 3Å; D70-F73 PolarHBondContact O-N 3.21Å; D70-V74 VanDerWaalsContact O-CG2 3.32Å; D70-V74 WeakPolarHBondContact O-CG2 3.46Å; D70-V74 PolarHBondContact O-N 3.19Å
71	E	92	Very high	92.4	Very high	19 Å²	19	23.7 Å²	23.7	9%	0.089	13%	0.126	C	C	.	.	H	α-helix	trans	-59.6	-51.1	172.1	175.1	179.6	113	0	0	111.3	V10 Y64 D68 F73 V74 V75 F99	V10-E71 HydrophobicContact CG2-CB 4.24Å; V10-E71 HydrophobicContact CG2-CG 3.72Å; V10-E71 WeakPolarHBondContact CG2-OE2 3.28Å; Y64-E71 HydrophobicContact CD1-CB 4.3Å; Y64-E71 HydrophobicContact CG-CB 4.36Å; D68-E71 WeakPolarHBondContact O-CB 3.29Å; D68-E71 PolarHBondContact O-N 3.38Å; E71-F73 VanDerWaalsContact C-N 3.27Å; E71-F73 PolarHBondContact O-N 3.47Å; E71-V74 WeakPolarHBondContact O-CB 3.08Å; E71-V74 PolarHBondContact O-N 3.31Å; E71-V75 PolarHBondContact O-N 3.46Å; E71-F99 HydrophobicContact CG-CD2 4.19Å; E71-F99 HydrophobicContact CG-CE2 3.63Å; E71-F99 HydrophobicContact CG-CZ 4.15Å; E71-F99 WeakPolarHBondContact OE1-CD2 3.31Å; E71-F99 WeakPolarHBondContact OE1-CE2 3.48Å
72	E	93.3	Very high	92.6	Very high	22 Å²	22	22.5 Å²	22.5	10%	0.103	12%	0.12	C	C	.	.	H	α-helix	trans	-55.1	-44.8	176.7	-72.3	-175.4	-177.3	0	0	111.8	D68 K69 V75 F76 W103 Q178 L179 Y182 K185	D68-E72 PolarHBondContact O-N 2.94Å; K69-E72 PolarHBondContact O-N 2.87Å; E72-V75 PolarHBondContact O-N 3Å; E72-F76 PolarHBondContact O-N 3.35Å; E72-W103 HydrophobicContact CG-CH2 4.46Å; E72-W103 HydrophobicContact CG-CZ2 4.31Å; E72-Q178 PolarHBondContact OE1-NE2 2.93Å; E72-L179 WeakPolarHBondContact O-CD2 3.34Å; E72-Y182 HydrophobicContact CB-CE2 4.1Å; E72-Y182 WeakPolarHBondContact OE2-CE2 3.39Å; E72-Y182 PolarHBondContact OE2-OH 3.33Å; E72-K185 IonicContact OE2-NZ 3.73Å; E72-K185 PolarHBondContact OE2-NZ 3.03Å
73	F	95.1	Very high	92.7	Very high	1 Å²	1	28.8 Å²	28.8	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-68.8	-35.9	-178.2	-168.9	-116.4	0	0	0	112	Y39 W41 K69 D70 E71 F76 L77 Y182 V186	Y39-F73 AromaticContact CD1-CD1 3.73Å; Y39-F73 HydrophobicContact CD1-CD1 3.73Å; Y39-F73 AromaticContact CD1-CE1 3.89Å; Y39-F73 HydrophobicContact CD1-CE1 3.89Å; Y39-F73 AromaticContact CD2-CD1 3.6Å; Y39-F73 HydrophobicContact CD2-CD1 3.6Å; Y39-F73 HydrophobicContact CD2-CD2 4.05Å; Y39-F73 AromaticContact CD2-CE1 3.67Å; Y39-F73 HydrophobicContact CD2-CE1 3.67Å; Y39-F73 HydrophobicContact CD2-CE2 4.11Å; Y39-F73 AromaticContact CD2-CG 3.81Å; Y39-F73 HydrophobicContact CD2-CG 3.81Å; Y39-F73 AromaticContact CD2-CZ 3.92Å; Y39-F73 HydrophobicContact CD2-CZ 3.92Å; Y39-F73 AromaticContact CE1-CD1 3.85Å; Y39-F73 HydrophobicContact CE1-CD1 3.85Å; Y39-F73 HydrophobicContact CE1-CE1 4.47Å; Y39-F73 HydrophobicContact CE1-CG 4.4Å; Y39-F73 HydrophobicContact CE2-CB 3.9Å; Y39-F73 AromaticContact CE2-CD1 3.76Å; Y39-F73 HydrophobicContact CE2-CD1 3.76Å; Y39-F73 HydrophobicContact CE2-CD2 4.1Å; Y39-F73 HydrophobicContact CE2-CE1 4.3Å; Y39-F73 AromaticContact CE2-CG 3.65Å; Y39-F73 HydrophobicContact CE2-CG 3.65Å; Y39-F73 AromaticContact CG-CD1 3.61Å; Y39-F73 HydrophobicContact CG-CD1 3.61Å; Y39-F73 AromaticContact CG-CE1 3.45Å; Y39-F73 HydrophobicContact CG-CE1 3.45Å; Y39-F73 VanDerWaalsContact CG-CE1 3.45Å; Y39-F73 HydrophobicContact CG-CG 4.29Å; Y39-F73 HydrophobicContact CG-CZ 4.02Å; Y39-F73 AromaticContact CZ-CD1 3.89Å; Y39-F73 AromaticContact CZ-CG 3.98Å; W41-F73 AromaticContact CH2-CD1 3.64Å; W41-F73 HydrophobicContact CH2-CD1 3.64Å; W41-F73 HydrophobicContact CH2-CE1 4.27Å; W41-F73 AromaticContact CZ2-CD1 3.72Å; W41-F73 HydrophobicContact CZ2-CD1 3.72Å; W41-F73 AromaticContact CZ2-CE1 3.9Å; W41-F73 HydrophobicContact CZ2-CE1 3.9Å; W41-F73 HydrophobicContact CZ3-CD1 4.34Å; K69-F73 VanDerWaalsContact O-CB 3.31Å; K69-F73 WeakPolarHBondContact O-CB 3.47Å; K69-F73 PolarHBondContact O-N 2.94Å; D70-F73 PolarHBondContact O-N 3.21Å; E71-F73 VanDerWaalsContact C-N 3.27Å; E71-F73 PolarHBondContact O-N 3.47Å; F73-F76 AromaticContact CD2-CD1 3.89Å; F73-F76 HydrophobicContact CD2-CD1 3.89Å; F73-F76 AromaticContact CE2-CD1 3.69Å; F73-F76 HydrophobicContact CE2-CD1 3.69Å; F73-F76 AromaticContact CE2-CE1 3.99Å; F73-F76 HydrophobicContact CE2-CE1 3.99Å; F73-F76 WeakPolarHBondContact O-CB 3.39Å; F73-F76 PolarHBondContact O-N 3.43Å; F73-L77 HydrophobicContact CD1-CD1 4.08Å; F73-L77 HydrophobicContact CD1-CG 4.45Å; F73-L77 HydrophobicContact CE1-CD1 3.91Å; F73-L77 HydrophobicContact CE1-CD2 4.37Å; F73-L77 HydrophobicContact CE1-CG 4.22Å; F73-L77 HydrophobicContact CZ-CD2 4.23Å; F73-L77 HydrophobicContact CZ-CG 4.42Å; F73-L77 VanDerWaalsContact O-CG 3.31Å; F73-L77 WeakPolarHBondContact O-CG 3.2Å; F73-L77 PolarHBondContact O-N 3.29Å; F73-Y182 HydrophobicContact CB-CE1 4.43Å; F73-Y182 AromaticContact CD2-CD1 3.69Å; F73-Y182 HydrophobicContact CD2-CD1 3.69Å; F73-Y182 AromaticContact CD2-CE1 3.78Å; F73-Y182 HydrophobicContact CD2-CE1 3.78Å; F73-Y182 HydrophobicContact CE2-CD1 4.2Å; F73-V186 HydrophobicContact CD2-CG2 4.11Å; F73-V186 HydrophobicContact CE2-CG2 3.92Å
74	V	95.6	Very high	93	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-52.1	169.4	169.6	0	0	0	0	109.6	V10 Y12 W41 F46 V62 D70 E71 F76 L77 L78	V10-V74 HydrophobicContact CG1-CG1 4.38Å; Y12-V74 HydrophobicContact CD1-CG1 3.9Å; Y12-V74 HydrophobicContact CE1-CG1 3.68Å; W41-V74 HydrophobicContact CH2-CG2 3.81Å; W41-V74 HydrophobicContact CZ3-CG2 3.72Å; F46-V74 HydrophobicContact CD2-CG1 4.46Å; F46-V74 HydrophobicContact CE2-CG1 4.45Å; V62-V74 HydrophobicContact CB-CG2 4.29Å; V62-V74 HydrophobicContact CG1-CG2 4.26Å; V62-V74 HydrophobicContact CG2-CG2 4.13Å; D70-V74 VanDerWaalsContact O-CG2 3.32Å; D70-V74 WeakPolarHBondContact O-CG2 3.46Å; D70-V74 PolarHBondContact O-N 3.19Å; E71-V74 WeakPolarHBondContact O-CB 3.08Å; E71-V74 PolarHBondContact O-N 3.31Å; V74-F76 VanDerWaalsContact C-N 3.3Å; V74-F76 PolarHBondContact O-N 3.14Å; V74-L77 WeakPolarHBondContact O-CA 3.32Å; V74-L77 WeakPolarHBondContact O-CB 3.28Å; V74-L77 PolarHBondContact O-N 3.06Å; V74-L78 HydrophobicContact CG1-CD1 4.05Å; V74-L78 HydrophobicContact CG1-CG 4.19Å; V74-L78 VanDerWaalsContact O-CG 3.3Å; V74-L78 WeakPolarHBondContact O-CG 3.27Å; V74-L78 PolarHBondContact O-N 3.23Å
75	V	95.5	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-40.1	-179.8	-179.4	0	0	0	0	111.8	E71 E72 L77 L78 M79 F99 L100 W103 I123 L179	E71-V75 PolarHBondContact O-N 3.46Å; E72-V75 PolarHBondContact O-N 3Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 2.94Å; V75-L78 PolarHBondContact O-N 3.42Å; V75-M79 WeakPolarHBondContact O-CB 3.43Å; V75-M79 PolarHBondContact O-N 3.32Å; V75-F99 HydrophobicContact CG2-CE2 3.59Å; V75-F99 HydrophobicContact CG2-CZ 3.54Å; V75-L100 HydrophobicContact CB-CD2 4.47Å; V75-L100 HydrophobicContact CG1-CD2 3.72Å; V75-L100 HydrophobicContact CG2-CD2 3.85Å; V75-W103 HydrophobicContact CB-CH2 3.76Å; V75-W103 HydrophobicContact CB-CZ3 4.17Å; V75-W103 HydrophobicContact CG1-CH2 3.99Å; V75-W103 HydrophobicContact CG1-CZ3 3.88Å; V75-W103 HydrophobicContact CG2-CH2 3.61Å; V75-W103 HydrophobicContact CG2-CZ2 4.36Å; V75-W103 HydrophobicContact CG2-CZ3 4.29Å; V75-I123 HydrophobicContact CG1-CD1 4.37Å; V75-L179 HydrophobicContact CB-CD2 4.23Å; V75-L179 HydrophobicContact CG1-CD1 3.84Å; V75-L179 HydrophobicContact CG1-CD2 4.25Å
76	F	95.8	Very high	93.4	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-56.1	-47.5	172.2	164.8	-99.3	0	0	0	111.8	E72 F73 V74 L78 M79 Q80 L179 Y182 P183	E72-F76 PolarHBondContact O-N 3.35Å; F73-F76 AromaticContact CD2-CD1 3.89Å; F73-F76 HydrophobicContact CD2-CD1 3.89Å; F73-F76 AromaticContact CE2-CD1 3.69Å; F73-F76 HydrophobicContact CE2-CD1 3.69Å; F73-F76 AromaticContact CE2-CE1 3.99Å; F73-F76 HydrophobicContact CE2-CE1 3.99Å; F73-F76 WeakPolarHBondContact O-CB 3.39Å; F73-F76 PolarHBondContact O-N 3.43Å; V74-F76 VanDerWaalsContact C-N 3.3Å; V74-F76 PolarHBondContact O-N 3.14Å; F76-L78 PolarHBondContact O-N 2.91Å; F76-M79 WeakPolarHBondContact O-CB 3.38Å; F76-M79 PolarHBondContact O-N 3.07Å; F76-Q80 HydrophobicContact CD2-CG 4.2Å; F76-Q80 HydrophobicContact CE1-CG 4.18Å; F76-Q80 HydrophobicContact CE2-CG 3.71Å; F76-Q80 HydrophobicContact CZ-CG 3.68Å; F76-Q80 WeakPolarHBondContact O-CG 3.32Å; F76-Q80 PolarHBondContact O-N 3.08Å; F76-L179 HydrophobicContact CB-CD2 4.34Å; F76-Y182 HydrophobicContact CB-CD2 4.44Å; F76-Y182 HydrophobicContact CB-CG 4.32Å; F76-Y182 HydrophobicContact CD2-CG 4.26Å; F76-Y182 WeakPolarHBondContact CE2-O 3.22Å; F76-Y182 HydrophobicContact CG-CG 4.16Å; F76-P183 HydrophobicContact CE1-CB 4.08Å; F76-P183 HydrophobicContact CZ-CB 3.96Å; F76-P183 HydrophobicContact CZ-CG 4.19Å
77	L	96.4	Very high	93.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-45.9	176.8	-67.2	171.1	0	0	0	111.1	V32 L35 W41 F46 F73 V74 V75 M79 Q80 I81	V32-L77 HydrophobicContact CG1-CD1 4.17Å; L35-L77 HydrophobicContact CB-CD2 3.56Å; L35-L77 HydrophobicContact CD1-CD2 3.91Å; L35-L77 HydrophobicContact CG-CD2 4.4Å; W41-L77 HydrophobicContact CH2-CD1 4.04Å; W41-L77 HydrophobicContact CZ2-CD1 4.04Å; F46-L77 HydrophobicContact CB-CD1 4.24Å; F46-L77 HydrophobicContact CD2-CD1 3.92Å; F46-L77 HydrophobicContact CG-CD1 4.23Å; F73-L77 HydrophobicContact CD1-CD1 4.08Å; F73-L77 HydrophobicContact CD1-CG 4.45Å; F73-L77 HydrophobicContact CE1-CD1 3.91Å; F73-L77 HydrophobicContact CE1-CD2 4.37Å; F73-L77 HydrophobicContact CE1-CG 4.22Å; F73-L77 HydrophobicContact CZ-CD2 4.23Å; F73-L77 HydrophobicContact CZ-CG 4.42Å; F73-L77 VanDerWaalsContact O-CG 3.31Å; F73-L77 WeakPolarHBondContact O-CG 3.2Å; F73-L77 PolarHBondContact O-N 3.29Å; V74-L77 WeakPolarHBondContact O-CA 3.32Å; V74-L77 WeakPolarHBondContact O-CB 3.28Å; V74-L77 PolarHBondContact O-N 3.06Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 2.94Å; L77-M79 VanDerWaalsContact C-N 3.31Å; L77-M79 PolarHBondContact O-N 3.43Å; L77-Q80 PolarHBondContact O-N 3.21Å; L77-I81 WeakPolarHBondContact O-CD1 3.37Å; L77-I81 WeakPolarHBondContact O-CG1 3.33Å; L77-I81 PolarHBondContact O-N 3.48Å
78	L	97	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-42	177.6	-60.6	-178.9	0	0	0	111.6	Y12 F14 F46 V74 V75 F76 I81 S82 V90 T92 I123	Y12-L78 HydrophobicContact CD1-CD1 4.28Å; Y12-L78 HydrophobicContact CD1-CD2 4.47Å; Y12-L78 HydrophobicContact CD2-CD2 4Å; Y12-L78 HydrophobicContact CE2-CD2 4.4Å; Y12-L78 HydrophobicContact CG-CD1 4.16Å; Y12-L78 HydrophobicContact CG-CD2 3.99Å; F14-L78 HydrophobicContact CE1-CD2 4.41Å; F14-L78 HydrophobicContact CE2-CD2 3.53Å; F14-L78 HydrophobicContact CZ-CD2 3.29Å; F46-L78 HydrophobicContact CE2-CD2 3.79Å; F46-L78 HydrophobicContact CZ-CD2 4.08Å; V74-L78 HydrophobicContact CG1-CD1 4.05Å; V74-L78 HydrophobicContact CG1-CG 4.19Å; V74-L78 VanDerWaalsContact O-CG 3.3Å; V74-L78 WeakPolarHBondContact O-CG 3.27Å; V74-L78 PolarHBondContact O-N 3.23Å; V75-L78 PolarHBondContact O-N 3.42Å; F76-L78 PolarHBondContact O-N 2.91Å; L78-I81 PolarHBondContact O-N 3.02Å; L78-S82 WeakPolarHBondContact O-CB 3.44Å; L78-S82 PolarHBondContact O-N 2.78Å; L78-S82 PolarHBondContact O-OG 3.28Å; L78-V90 HydrophobicContact CB-CG1 4.39Å; L78-V90 HydrophobicContact CD1-CG1 4.06Å; L78-V90 HydrophobicContact CD2-CG1 4.12Å; L78-V90 HydrophobicContact CG-CG1 4.41Å; L78-T92 HydrophobicContact CD1-CG2 3.29Å; L78-I123 HydrophobicContact CB-CD1 3.96Å; L78-I123 HydrophobicContact CD1-CD1 4.27Å
79	M	95.7	Very high	94.6	Very high	11 Å²	11	26.4 Å²	26.4	5%	0.054	13%	0.131	C	C	.	.	H	α-helix	trans	-60.8	-49.4	175	-82.2	-62.1	157.6	0	0	112.2	V75 F76 L77 I81 S82 K83 I123 V128 L179	V75-M79 WeakPolarHBondContact O-CB 3.43Å; V75-M79 PolarHBondContact O-N 3.32Å; F76-M79 WeakPolarHBondContact O-CB 3.38Å; F76-M79 PolarHBondContact O-N 3.07Å; L77-M79 VanDerWaalsContact C-N 3.31Å; L77-M79 PolarHBondContact O-N 3.43Å; M79-I81 VanDerWaalsContact C-N 3.34Å; M79-I81 PolarHBondContact O-N 2.73Å; M79-S82 PolarHBondContact O-N 2.68Å; M79-S82 PolarHBondContact O-OG 3.22Å; M79-K83 WeakPolarHBondContact O-CB 3.47Å; M79-K83 PolarHBondContact O-N 3.35Å; M79-I123 HydrophobicContact CE-CB 3.69Å; M79-I123 HydrophobicContact CE-CD1 3.67Å; M79-I123 HydrophobicContact CE-CG1 3.33Å; M79-I123 HydrophobicContact CE-CG2 3.28Å; M79-I123 HydrophobicContact CG-CG2 4.44Å; M79-I123 HydrophobicContact SD-CG2 3.51Å; M79-I123 VanDerWaalsContact SD-CG2 3.51Å; M79-V128 HydrophobicContact CE-CG2 3.57Å; M79-L179 HydrophobicContact CG-CD1 4.07Å
80	Q	95.7	Very high	94.8	Very high	57 Å²	57	22.3 Å²	22.3	27%	0.266	11%	0.113	S	C	.	.	H	α-helix	trans	-63.8	-40.3	179.7	-65.2	-56.3	-28.3	0	0	112	M31 L35 F76 L77 K83 T84	M31-Q80 VanDerWaalsContact CE-C 3.46Å; M31-Q80 HydrophobicContact CE-CB 3.57Å; M31-Q80 WeakPolarHBondContact CE-O 3.47Å; L35-Q80 HydrophobicContact CD1-CB 3.92Å; L35-Q80 HydrophobicContact CD1-CG 4.25Å; F76-Q80 HydrophobicContact CD2-CG 4.2Å; F76-Q80 HydrophobicContact CE1-CG 4.18Å; F76-Q80 HydrophobicContact CE2-CG 3.71Å; F76-Q80 HydrophobicContact CZ-CG 3.68Å; F76-Q80 WeakPolarHBondContact O-CG 3.32Å; F76-Q80 PolarHBondContact O-N 3.08Å; L77-Q80 PolarHBondContact O-N 3.21Å; Q80-K83 PolarHBondContact O-N 3.47Å; Q80-T84 WeakPolarHBondContact O-CB 3.4Å; Q80-T84 PolarHBondContact O-N 3Å; Q80-T84 PolarHBondContact O-OG1 3.42Å
81	I	96.1	Very high	94.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-49	177.5	-61.6	158.1	0	0	0	109.9	F14 V28 M31 V32 F46 L77 L78 M79 K83 T84 Y85	F14-I81 HydrophobicContact CD1-CG2 4.29Å; F14-I81 HydrophobicContact CE1-CB 4.04Å; F14-I81 HydrophobicContact CE1-CD1 4.04Å; F14-I81 HydrophobicContact CE1-CG2 3.54Å; F14-I81 HydrophobicContact CZ-CD1 3.87Å; F14-I81 HydrophobicContact CZ-CG2 4.44Å; V28-I81 HydrophobicContact CG1-CD1 3.83Å; V28-I81 HydrophobicContact CG1-CG1 4.15Å; V28-I81 HydrophobicContact CG1-CG2 3.83Å; V28-I81 HydrophobicContact CG2-CG2 4.3Å; M31-I81 HydrophobicContact SD-CG1 4.25Å; V32-I81 HydrophobicContact CG2-CD1 3.73Å; V32-I81 HydrophobicContact CG2-CG1 4.43Å; F46-I81 HydrophobicContact CZ-CD1 4.23Å; L77-I81 WeakPolarHBondContact O-CD1 3.37Å; L77-I81 WeakPolarHBondContact O-CG1 3.33Å; L77-I81 PolarHBondContact O-N 3.48Å; L78-I81 PolarHBondContact O-N 3.02Å; M79-I81 VanDerWaalsContact C-N 3.34Å; M79-I81 PolarHBondContact O-N 2.73Å; I81-K83 VanDerWaalsContact C-N 3.27Å; I81-K83 PolarHBondContact O-N 2.82Å; I81-T84 PolarHBondContact O-N 3.16Å; I81-T84 VanDerWaalsContact O-N 3.11Å; I81-Y85 HydrophobicContact CG2-CD2 3.71Å; I81-Y85 HydrophobicContact CG2-CE2 4.07Å; I81-Y85 VanDerWaalsContact O-CD2 3.31Å; I81-Y85 WeakPolarHBondContact O-CD2 3.38Å; I81-Y85 PolarHBondContact O-N 3.42Å
82	S	95.8	Very high	95.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-32.7	179.6	75.6	0	0	0	0	112.9	L78 M79 Y85 I123 G126	L78-S82 WeakPolarHBondContact O-CB 3.44Å; L78-S82 PolarHBondContact O-N 2.78Å; L78-S82 PolarHBondContact O-OG 3.28Å; M79-S82 PolarHBondContact O-N 2.68Å; M79-S82 PolarHBondContact O-OG 3.22Å; S82-Y85 CarbonylContact O-C 3.51Å; S82-I123 VanDerWaalsContact OG-CG2 3.31Å; S82-I123 WeakPolarHBondContact OG-CG2 3.48Å; S82-G126 WeakPolarHBondContact OG-CA 3.33Å; S82-G126 PolarHBondContact OG-N 3.44Å
83	K	95.3	Very high	95	Very high	132 Å²	132	22.9 Å²	22.9	57%	0.574	12%	0.117	S	C	*	.	H	α-helix	trans	-68.3	-37.1	174	-170.9	176.3	-178.8	176	0	112.3	M79 Q80 I81	M79-K83 WeakPolarHBondContact O-CB 3.47Å; M79-K83 PolarHBondContact O-N 3.35Å; Q80-K83 PolarHBondContact O-N 3.47Å; I81-K83 VanDerWaalsContact C-N 3.27Å; I81-K83 PolarHBondContact O-N 2.82Å
84	T	95.3	Very high	94.8	Very high	67 Å²	67	23 Å²	23	41%	0.411	12%	0.118	S	C	.	.	H	α-helix	trans	-76.5	-32	-179.8	-58.1	0	0	0	0	112	M31 Q80 I81 P86	M31-T84 VanDerWaalsContact CE-OG1 3.25Å; M31-T84 WeakPolarHBondContact CE-OG1 3.21Å; M31-T84 HydrophobicContact SD-CG2 4.02Å; Q80-T84 WeakPolarHBondContact O-CB 3.4Å; Q80-T84 PolarHBondContact O-N 3Å; Q80-T84 PolarHBondContact O-OG1 3.42Å; I81-T84 PolarHBondContact O-N 3.16Å; I81-T84 VanDerWaalsContact O-N 3.11Å; T84-P86 WeakPolarHBondContact O-CD 3.4Å
85	Y	94.3	Very high	94.2	Very high	36 Å²	36	28.2 Å²	28.2	14%	0.141	14%	0.139	C	C	.	.			trans	-119.7	88.2	179.4	-53.6	-70.3	0	0	0	110.3	P23 N27 V28 M31 I81 S82 N87 V88	P23-Y85 HydrophobicContact CB-CD1 3.65Å; P23-Y85 HydrophobicContact CB-CD2 4.12Å; P23-Y85 HydrophobicContact CB-CE1 3.76Å; P23-Y85 HydrophobicContact CB-CE2 4.24Å; P23-Y85 HydrophobicContact CB-CG 3.83Å; P23-Y85 HydrophobicContact CG-CD1 4.21Å; P23-Y85 HydrophobicContact CG-CD2 4.25Å; P23-Y85 HydrophobicContact CG-CG 3.94Å; N27-Y85 PolarHBondContact O-OH 2.81Å; V28-Y85 HydrophobicContact CG2-CD2 4.4Å; V28-Y85 HydrophobicContact CG2-CE2 3.99Å; M31-Y85 HydrophobicContact SD-CE2 4.23Å; I81-Y85 HydrophobicContact CG2-CD2 3.71Å; I81-Y85 HydrophobicContact CG2-CE2 4.07Å; I81-Y85 VanDerWaalsContact O-CD2 3.31Å; I81-Y85 WeakPolarHBondContact O-CD2 3.38Å; I81-Y85 PolarHBondContact O-N 3.42Å; S82-Y85 CarbonylContact O-C 3.51Å; Y85-N87 PolarHBondContact O-N 2.84Å; Y85-V88 VanDerWaalsContact O-CB 3.31Å; Y85-V88 WeakPolarHBondContact O-CB 3.34Å; Y85-V88 PolarHBondContact O-N 2.81Å
86	P	90.8	Very high	93.7	Very high	69 Å²	69	32.6 Å²	32.6	45%	0.448	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-11.8	-172.5	-23.9	33.7	0	0	0	115.6	T84 F124	T84-P86 WeakPolarHBondContact O-CD 3.4Å; P86-F124 WeakPolarHBondContact O-CE2 3.34Å; P86-F124 WeakPolarHBondContact O-CZ 3.48Å
87	N	91.3	Very high	93.3	Very high	46 Å²	46	33.3 Å²	33.3	25%	0.246	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.2	176.3	-69.9	-47.6	0	0	0	113.5	L17 D21 Y85	L17-N87 PolarHBondContact N-O 3.46Å; D21-N87 WeakPolarHBondContact CB-ND2 3.25Å; D21-N87 PolarHBondContact OD2-ND2 3.37Å; Y85-N87 PolarHBondContact O-N 2.84Å
88	V	95	Very high	92.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.9	178.4	173.5	0	0	0	0	109.6	F14 Y15 F16 P23 Y85 V90 F124	F14-V88 HydrophobicContact CB-CG1 4.22Å; F14-V88 HydrophobicContact CD1-CG1 3.45Å; F14-V88 VanDerWaalsContact CD1-CG1 3.45Å; F14-V88 HydrophobicContact CE1-CG1 4.19Å; F14-V88 HydrophobicContact CG-CG1 4.25Å; Y15-V88 WeakPolarHBondContact O-CA 3.19Å; F16-V88 HydrophobicContact CD1-CG2 4.04Å; F16-V88 HydrophobicContact CE1-CG2 4.09Å; P23-V88 HydrophobicContact CG-CG2 3.68Å; Y85-V88 VanDerWaalsContact O-CB 3.31Å; Y85-V88 WeakPolarHBondContact O-CB 3.34Å; Y85-V88 PolarHBondContact O-N 2.81Å; V88-V90 HydrophobicContact CG1-CG2 3.68Å; V88-F124 WeakPolarHBondContact O-CD2 3.05Å
89	V	95.8	Very high	92.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.7	166.7	179.1	0	0	0	0	107.4	Y15 L17 F122 F124 L155 I158	Y15-V89 PolarHBondContact N-O 3.29Å; Y15-V89 PolarHBondContact O-N 3.49Å; L17-V89 HydrophobicContact CD1-CG2 3.88Å; L17-V89 HydrophobicContact CD2-CG2 3.66Å; L17-V89 HydrophobicContact CG-CG2 3.73Å; V89-F122 HydrophobicContact CG1-CB 3.76Å; V89-F122 HydrophobicContact CG1-CD1 3.61Å; V89-F122 HydrophobicContact CG1-CE1 4.47Å; V89-F122 HydrophobicContact CG1-CG 3.87Å; V89-F124 HydrophobicContact CB-CD2 4.42Å; V89-F124 HydrophobicContact CG2-CD2 3.46Å; V89-F124 VanDerWaalsContact CG2-CD2 3.46Å; V89-F124 HydrophobicContact CG2-CE2 3.9Å; V89-F124 HydrophobicContact CG2-CG 4.26Å; V89-L155 HydrophobicContact CB-CD2 4.08Å; V89-L155 HydrophobicContact CG1-CD2 3.87Å; V89-I158 HydrophobicContact CG1-CD1 3.96Å; V89-I158 HydrophobicContact CG2-CG2 3.88Å
90	V	96.9	Very high	92.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.3	178.3	-174.1	0	0	0	0	109.6	W13 F14 L78 V88 T92 F122 I123	W13-V90 CarbonylContact O-C 3.53Å; W13-V90 VanDerWaalsContact O-CA 3.23Å; W13-V90 WeakPolarHBondContact O-CA 3.25Å; F14-V90 HydrophobicContact CD1-CG2 3.67Å; F14-V90 HydrophobicContact CD2-CG1 4.37Å; F14-V90 HydrophobicContact CD2-CG2 4.45Å; F14-V90 HydrophobicContact CE1-CG2 3.62Å; F14-V90 HydrophobicContact CE2-CG1 4.24Å; F14-V90 HydrophobicContact CE2-CG2 4.47Å; F14-V90 HydrophobicContact CG-CG2 4.07Å; F14-V90 HydrophobicContact CZ-CG1 4.44Å; F14-V90 HydrophobicContact CZ-CG2 4.09Å; L78-V90 HydrophobicContact CB-CG1 4.39Å; L78-V90 HydrophobicContact CD1-CG1 4.06Å; L78-V90 HydrophobicContact CD2-CG1 4.12Å; L78-V90 HydrophobicContact CG-CG1 4.41Å; V88-V90 HydrophobicContact CG1-CG2 3.68Å; V90-T92 HydrophobicContact CG1-CG2 4.34Å; V90-F122 CarbonylContact O-C 3.5Å; V90-F122 WeakPolarHBondContact O-CA 3.03Å; V90-I123 HydrophobicContact CB-CB 4.03Å; V90-I123 HydrophobicContact CB-CG2 4.43Å; V90-I123 PolarHBondContact N-O 2.92Å; V90-I123 PolarHBondContact O-N 3.12Å
91	K	95.2	Very high	92.4	Very high	30 Å²	30	32 Å²	32	13%	0.13	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	140	165.5	-176.9	176.4	179.8	-178.2	0	108	Y12 W13 Y15 N119 F122	Y12-K91 CarbonylContact C-O 3.5Å; Y12-K91 WeakPolarHBondContact CA-O 3.44Å; W13-K91 HydrophobicContact CB-CB 4.46Å; W13-K91 HydrophobicContact CE3-CB 4.15Å; W13-K91 HydrophobicContact CE3-CD 4.35Å; W13-K91 HydrophobicContact CE3-CG 4.11Å; W13-K91 PolarHBondContact N-O 2.93Å; W13-K91 PolarHBondContact O-N 3.29Å; Y15-K91 HydrophobicContact CE2-CB 4Å; K91-N119 PolarHBondContact NZ-OD1 3.2Å; K91-F122 HydrophobicContact CB-CD1 3.96Å; K91-F122 HydrophobicContact CB-CE1 4Å; K91-F122 HydrophobicContact CD-CE1 4.28Å; K91-F122 HydrophobicContact CG-CD1 4.46Å; K91-F122 HydrophobicContact CG-CE1 4.27Å
92	T	94.8	Very high	92.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.8	175.3	50	0	0	0	0	109	E11 L78 V90 L100 I123	E11-T92 CarbonylContact O-C 3.57Å; E11-T92 WeakPolarHBondContact O-CA 3.36Å; L78-T92 HydrophobicContact CD1-CG2 3.29Å; V90-T92 HydrophobicContact CG1-CG2 4.34Å; T92-L100 WeakPolarHBondContact OG1-CD1 3.42Å; T92-I123 HydrophobicContact CG2-CD1 3.89Å
93	C	91.7	Very high	92	Very high	22 Å²	22	38.9 Å²	38.9	15%	0.149	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.8	173.7	-168.6	0	0	0	0	109.4	E11 W13 G97	E11-C93 PolarHBondContact N-O 3.46Å; E11-C93 PolarHBondContact O-N 3.4Å; W13-C93 HydrophobicContact CH2-CB 3.95Å; W13-C93 HydrophobicContact CZ3-CB 3.67Å; C93-G97 WeakPolarHBondContact CA-O 3.48Å; C93-G97 PolarHBondContact SG-O 3.03Å
94	D	90.4	Very high	91.8	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.027	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-127.4	-164.6	170.4	73.7	-41.1	0	0	0	109.4	V9 V10 D96 G97 F99	V9-D94 WeakPolarHBondContact O-CA 3.31Å; V9-D94 WeakPolarHBondContact O-CB 3.48Å; V10-D94 HydrophobicContact CG2-CB 4.43Å; D94-D96 PolarHBondContact OD1-N 3.5Å; D94-D96 PolarHBondContact OD2-N 3.47Å; D94-G97 PolarHBondContact N-O 3.36Å; D94-G97 PolarHBondContact O-N 2.84Å; D94-G97 VanDerWaalsContact OD1-C 3.29Å; D94-G97 PolarHBondContact OD1-N 2.96Å; D94-G97 VanDerWaalsContact OD1-O 3.13Å; D94-F99 HydrophobicContact CB-CB 4.4Å; D94-F99 HydrophobicContact CB-CD1 3.79Å; D94-F99 HydrophobicContact CB-CE1 4.45Å; D94-F99 HydrophobicContact CB-CG 4.32Å; D94-F99 VanDerWaalsContact CG-CB 3.47Å; D94-F99 WeakPolarHBondContact OD1-CB 3.5Å; D94-F99 PolarHBondContact OD1-N 3.14Å
95	Y	83.8	Confident	91.6	Very high	110 Å²	110	32.4 Å²	32.4	43%	0.431	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-31.7	178.6	83.5	-79.3	0	0	0	112.8	E7 G97	E7-Y95 HydrophobicContact CB-CG 4.39Å; E7-Y95 HydrophobicContact CG-CD2 4.42Å; E7-Y95 WeakPolarHBondContact O-CD1 3.43Å; E7-Y95 WeakPolarHBondContact O-CE1 3.4Å; Y95-G97 PolarHBondContact O-N 2.89Å
96	D	85.1	Confident	91.3	Very high	91 Å²	91	37.6 Å²	37.6	49%	0.487	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.1	173.8	-74.2	-42.8	0	0	0	112.6	D94 I102	D94-D96 PolarHBondContact OD1-N 3.5Å; D94-D96 PolarHBondContact OD2-N 3.47Å; D96-I102 HydrophobicContact CB-CD1 4.09Å
97	G	86.1	Confident	91.4	Very high	23 Å²	23	35.7 Å²	35.7	24%	0.237	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	101.8	-93.7	177.6	0	0	0	0	0	111.8	C93 D94 Y95	C93-G97 WeakPolarHBondContact CA-O 3.48Å; C93-G97 PolarHBondContact SG-O 3.03Å; D94-G97 PolarHBondContact N-O 3.36Å; D94-G97 PolarHBondContact O-N 2.84Å; D94-G97 VanDerWaalsContact OD1-C 3.29Å; D94-G97 PolarHBondContact OD1-N 2.96Å; D94-G97 VanDerWaalsContact OD1-O 3.13Å; Y95-G97 PolarHBondContact O-N 2.89Å
98	E	89.4	Confident	91.5	Very high	22 Å²	22	35.9 Å²	35.9	10%	0.103	19%	0.192	C	C	.	.			trans	-105.2	65.5	-176.9	-58.3	-78.2	-178.3	0	0	110	L100 L101 A117 V121	E98-L100 PolarHBondContact O-N 2.86Å; E98-L101 HydrophobicContact CB-CD1 3.96Å; E98-L101 HydrophobicContact CB-CG 4.18Å; E98-L101 WeakPolarHBondContact O-CB 3.41Å; E98-L101 PolarHBondContact O-N 3.07Å; E98-A117 HydrophobicContact CG-CB 4.33Å; E98-V121 HydrophobicContact CB-CG2 4.3Å; E98-V121 HydrophobicContact CG-CG2 4.31Å
99	F	91.2	Very high	91.4	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-54.2	-26.5	-173.4	70.2	-80	0	0	0	116.1	V10 E71 V75 D94 L101 I102 W103	V10-F99 HydrophobicContact CG1-CE1 3.91Å; V10-F99 HydrophobicContact CG1-CZ 4.01Å; V10-F99 HydrophobicContact CG2-CE1 4.33Å; V10-F99 HydrophobicContact CG2-CZ 4.3Å; E71-F99 HydrophobicContact CG-CD2 4.19Å; E71-F99 HydrophobicContact CG-CE2 3.63Å; E71-F99 HydrophobicContact CG-CZ 4.15Å; E71-F99 WeakPolarHBondContact OE1-CD2 3.31Å; E71-F99 WeakPolarHBondContact OE1-CE2 3.48Å; V75-F99 HydrophobicContact CG2-CE2 3.59Å; V75-F99 HydrophobicContact CG2-CZ 3.54Å; D94-F99 HydrophobicContact CB-CB 4.4Å; D94-F99 HydrophobicContact CB-CD1 3.79Å; D94-F99 HydrophobicContact CB-CE1 4.45Å; D94-F99 HydrophobicContact CB-CG 4.32Å; D94-F99 VanDerWaalsContact CG-CB 3.47Å; D94-F99 WeakPolarHBondContact OD1-CB 3.5Å; D94-F99 PolarHBondContact OD1-N 3.14Å; F99-L101 PolarHBondContact O-N 3.05Å; F99-I102 HydrophobicContact CB-CD1 4.12Å; F99-I102 WeakPolarHBondContact O-CB 3.45Å; F99-I102 PolarHBondContact O-N 2.88Å; F99-W103 HydrophobicContact CD2-CZ2 4.08Å; F99-W103 HydrophobicContact CE2-CH2 4.23Å; F99-W103 AromaticContact CE2-CZ2 3.82Å; F99-W103 HydrophobicContact CE2-CZ2 3.82Å
100	L	93.4	Very high	91.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-56.5	-25.5	174.7	-65.2	-178.8	0	0	0	112.6	V75 T92 E98 I102 W103 I123 V128 I175	V75-L100 HydrophobicContact CB-CD2 4.47Å; V75-L100 HydrophobicContact CG1-CD2 3.72Å; V75-L100 HydrophobicContact CG2-CD2 3.85Å; T92-L100 WeakPolarHBondContact OG1-CD1 3.42Å; E98-L100 PolarHBondContact O-N 2.86Å; L100-I102 VanDerWaalsContact C-N 3.33Å; L100-W103 HydrophobicContact CD2-CE3 4.14Å; L100-W103 HydrophobicContact CD2-CH2 4.18Å; L100-W103 HydrophobicContact CD2-CZ3 3.88Å; L100-I123 HydrophobicContact CD1-CD1 4.05Å; L100-I123 HydrophobicContact CD1-CG1 3.94Å; L100-V128 HydrophobicContact CD1-CG2 4.5Å; L100-I175 HydrophobicContact CB-CD1 4.42Å; L100-I175 WeakPolarHBondContact O-CD1 3.47Å
101	L	93	Very high	90.9	Very high	18 Å²	18	48.3 Å²	48.3	9%	0.094	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-73.8	-24.6	175.7	-61.1	-178.1	0	0	0	112.8	E98 F99 W103 A104 A105 L108 L112 A117 V121	E98-L101 HydrophobicContact CB-CD1 3.96Å; E98-L101 HydrophobicContact CB-CG 4.18Å; E98-L101 WeakPolarHBondContact O-CB 3.41Å; E98-L101 PolarHBondContact O-N 3.07Å; F99-L101 PolarHBondContact O-N 3.05Å; L101-W103 VanDerWaalsContact C-N 3.32Å; L101-A104 CarbonylContact O-C 3.55Å; L101-A104 PolarHBondContact O-N 2.81Å; L101-A105 WeakPolarHBondContact O-CA 3.44Å; L101-A105 PolarHBondContact O-N 3.48Å; L101-L108 HydrophobicContact CB-CD1 4.06Å; L101-L108 HydrophobicContact CB-CD2 4.26Å; L101-L108 HydrophobicContact CD2-CD2 3.75Å; L101-L112 HydrophobicContact CD1-CD2 3.68Å; L101-L112 HydrophobicContact CD1-CG 4.42Å; L101-L112 HydrophobicContact CD2-CD2 3.92Å; L101-L112 HydrophobicContact CG-CD2 4.42Å; L101-A117 HydrophobicContact CD1-CB 3.85Å; L101-V121 HydrophobicContact CD1-CG2 3.81Å; L101-V121 HydrophobicContact CD2-CG1 4.35Å; L101-V121 HydrophobicContact CD2-CG2 3.78Å; L101-V121 HydrophobicContact CG-CG2 3.91Å
102	I	90.9	Very high	90.7	Very high	95 Å²	95	48 Å²	48	49%	0.487	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-43.1	176.5	-58.7	173.7	0	0	0	109.3	D96 F99 L100 A104 A105	D96-I102 HydrophobicContact CB-CD1 4.09Å; F99-I102 HydrophobicContact CB-CD1 4.12Å; F99-I102 WeakPolarHBondContact O-CB 3.45Å; F99-I102 PolarHBondContact O-N 2.88Å; L100-I102 VanDerWaalsContact C-N 3.33Å; I102-A104 PolarHBondContact O-N 2.93Å; I102-A104 VanDerWaalsContact O-N 3.16Å; I102-A105 WeakPolarHBondContact O-CB 3.45Å; I102-A105 PolarHBondContact O-N 2.83Å; I102-A105 VanDerWaalsContact O-N 3.15Å
103	W	91.3	Very high	90.5	Very high	50 Å²	50	50.7 Å²	50.7	19%	0.189	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.2	178.5	-56.3	-6.4	0	0	0	113.3	E72 V75 F99 L100 L101 I175 Q178 L179	E72-W103 HydrophobicContact CG-CH2 4.46Å; E72-W103 HydrophobicContact CG-CZ2 4.31Å; V75-W103 HydrophobicContact CB-CH2 3.76Å; V75-W103 HydrophobicContact CB-CZ3 4.17Å; V75-W103 HydrophobicContact CG1-CH2 3.99Å; V75-W103 HydrophobicContact CG1-CZ3 3.88Å; V75-W103 HydrophobicContact CG2-CH2 3.61Å; V75-W103 HydrophobicContact CG2-CZ2 4.36Å; V75-W103 HydrophobicContact CG2-CZ3 4.29Å; F99-W103 HydrophobicContact CD2-CZ2 4.08Å; F99-W103 HydrophobicContact CE2-CH2 4.23Å; F99-W103 AromaticContact CE2-CZ2 3.82Å; F99-W103 HydrophobicContact CE2-CZ2 3.82Å; L100-W103 HydrophobicContact CD2-CE3 4.14Å; L100-W103 HydrophobicContact CD2-CH2 4.18Å; L100-W103 HydrophobicContact CD2-CZ3 3.88Å; L101-W103 VanDerWaalsContact C-N 3.32Å; W103-I175 HydrophobicContact CB-CG1 4.35Å; W103-I175 HydrophobicContact CE3-CG2 4.03Å; W103-I175 HydrophobicContact CZ3-CG2 4.32Å; W103-Q178 HydrophobicContact CD2-CB 4.45Å; W103-Q178 HydrophobicContact CD2-CG 4.03Å; W103-Q178 HydrophobicContact CE3-CB 4.07Å; W103-Q178 HydrophobicContact CE3-CG 4.01Å; W103-Q178 HydrophobicContact CG-CG 4.41Å; W103-Q178 HydrophobicContact CZ3-CG 4.37Å; W103-L179 HydrophobicContact CH2-CD2 4.1Å; W103-L179 HydrophobicContact CZ3-CD1 4.38Å; W103-L179 HydrophobicContact CZ3-CD2 3.85Å; W103-L179 HydrophobicContact CZ3-CG 4.06Å
104	A	92.8	Very high	90.3	Very high	2 Å²	2	54.7 Å²	54.7	2%	0.017	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	17.6	179.1	0	0	0	0	0	113.1	L101 I102 E106 A107 L108 V171 A174 I175	L101-A104 CarbonylContact O-C 3.55Å; L101-A104 PolarHBondContact O-N 2.81Å; I102-A104 PolarHBondContact O-N 2.93Å; I102-A104 VanDerWaalsContact O-N 3.16Å; A104-E106 PolarHBondContact O-N 3.5Å; A104-A107 CarbonylContact O-C 3.55Å; A104-A107 WeakPolarHBondContact O-CA 3.5Å; A104-A107 PolarHBondContact O-N 3.33Å; A104-L108 HydrophobicContact CB-CD2 4.14Å; A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.25Å; A104-L108 VanDerWaalsContact O-N 3.14Å; A104-V171 HydrophobicContact CB-CB 4.33Å; A104-V171 HydrophobicContact CB-CG1 3.79Å; A104-A174 HydrophobicContact CB-CB 4.03Å; A104-I175 HydrophobicContact CB-CD1 4.28Å; A104-I175 HydrophobicContact CB-CG1 4.13Å
105	A	91.4	Very high	90	Very high	61 Å²	61	61.1 Å²	61.1	50%	0.504	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-49.8	-41.1	-168.6	0	0	0	0	0	113.4	L101 I102 L108	L101-A105 WeakPolarHBondContact O-CA 3.44Å; L101-A105 PolarHBondContact O-N 3.48Å; I102-A105 WeakPolarHBondContact O-CB 3.45Å; I102-A105 PolarHBondContact O-N 2.83Å; I102-A105 VanDerWaalsContact O-N 3.15Å; A105-L108 PolarHBondContact O-N 2.99Å
106	E	87.6	Confident	90.3	Very high	144 Å²	144	58.2 Å²	58.2	67%	0.673	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-73.6	-26.2	-179.3	-59.3	-175.4	166.8	0	0	113.8	A104 F418	A104-E106 PolarHBondContact O-N 3.5Å; E106-F418 WeakPolarHBondContact OE1-CE1 3.28Å
107	A	92.6	Very high	90.6	Very high	30 Å²	30	54 Å²	54	25%	0.248	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-94.6	-1.3	-179.6	0	0	0	0	0	112.7	A104 D170 V171	A104-A107 CarbonylContact O-C 3.55Å; A104-A107 WeakPolarHBondContact O-CA 3.5Å; A104-A107 PolarHBondContact O-N 3.33Å; A107-D170 HydrophobicContact CB-CB 3.82Å; A107-V171 HydrophobicContact CB-CG2 4.06Å; A107-V171 WeakPolarHBondContact O-CG2 3.24Å
108	L	93.3	Very high	90.7	Very high	50 Å²	50	57.7 Å²	57.7	26%	0.262	30%	0.299	S	S	.	.	S	Bend	trans	-67.8	140.2	-176.1	-65.4	-176.9	0	0	0	111.9	L101 A104 A105 Y110 L112 V171	L101-L108 HydrophobicContact CB-CD1 4.06Å; L101-L108 HydrophobicContact CB-CD2 4.26Å; L101-L108 HydrophobicContact CD2-CD2 3.75Å; A104-L108 HydrophobicContact CB-CD2 4.14Å; A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.25Å; A104-L108 VanDerWaalsContact O-N 3.14Å; A105-L108 PolarHBondContact O-N 2.99Å; L108-Y110 PolarHBondContact O-N 3.5Å; L108-L112 HydrophobicContact CD1-CD2 4.33Å; L108-L112 HydrophobicContact CD2-CD2 4.03Å; L108-V171 HydrophobicContact CD2-CG2 4.34Å
109	P	91.8	Very high	90.8	Very high	27 Å²	27	58 Å²	58	18%	0.175	30%	0.301	C	S	.	.			trans	-60.5	131.2	170	-22.3	33.2	0	0	0	111.2	W111 L112 L130 P168	P109-W111 VanDerWaalsContact CB-CD1 3.43Å; P109-W111 HydrophobicContact CB-CG 4.28Å; P109-W111 PolarHBondContact O-N 2.91Å; P109-L112 WeakPolarHBondContact O-CB 3.34Å; P109-L112 PolarHBondContact O-N 3.32Å; P109-L130 HydrophobicContact CG-CD2 4.07Å; P109-P168 HydrophobicContact CG-CG 4.22Å
110	Y	91	Very high	91	Very high	207 Å²	207	59.1 Å²	59.1	81%	0.812	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-15.2	179.5	67.5	-88.2	0	0	0	116.7	L108	L108-Y110 PolarHBondContact O-N 3.5Å
111	W	91.8	Very high	91	Very high	27 Å²	27	59.1 Å²	59.1	10%	0.102	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-19.2	178.1	66.3	-98	0	0	0	113.7	P109 N116 R133	P109-W111 VanDerWaalsContact CB-CD1 3.43Å; P109-W111 HydrophobicContact CB-CG 4.28Å; P109-W111 PolarHBondContact O-N 2.91Å; W111-N116 PolarHBondContact O-ND2 3.39Å; W111-R133 VanDerWaalsContact CD2-CD 3.43Å; W111-R133 HydrophobicContact CD2-CG 3.69Å; W111-R133 VanDerWaalsContact CE3-CD 3.47Å; W111-R133 HydrophobicContact CE3-CG 3.55Å; W111-R133 HydrophobicContact CG-CG 4.39Å; W111-R133 VanDerWaalsContact CG-NE 3.28Å; W111-R133 HydrophobicContact CH2-CG 4.05Å; W111-R133 HydrophobicContact CZ2-CG 4.13Å; W111-R133 HydrophobicContact CZ3-CG 3.75Å
112	L	91.8	Very high	91.2	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.12	30%	0.301	C	S	.	.			trans	-73.8	127	-177.1	-164.4	69.6	0	0	0	107.8	L101 L108 P109 N116 A117 L130	L101-L112 HydrophobicContact CD1-CD2 3.68Å; L101-L112 HydrophobicContact CD1-CG 4.42Å; L101-L112 HydrophobicContact CD2-CD2 3.92Å; L101-L112 HydrophobicContact CG-CD2 4.42Å; L108-L112 HydrophobicContact CD1-CD2 4.33Å; L108-L112 HydrophobicContact CD2-CD2 4.03Å; P109-L112 WeakPolarHBondContact O-CB 3.34Å; P109-L112 PolarHBondContact O-N 3.32Å; L112-N116 WeakPolarHBondContact CD1-OD1 3.38Å; L112-A117 HydrophobicContact CD1-CB 4.21Å; L112-A117 HydrophobicContact CG-CB 4.5Å; L112-L130 HydrophobicContact CD1-CD1 3.93Å; L112-L130 HydrophobicContact CD2-CD1 4.05Å; L112-L130 HydrophobicContact CD2-CD2 4.16Å
113	T	89.9	Confident	91.5	Very high	57 Å²	57	53.8 Å²	53.8	35%	0.35	28%	0.278	S	S	.	.			trans	-131.4	156.7	175.5	70.9	0	0	0	0	108	E115 N116 A117	T113-E115 WeakPolarHBondContact CB-OE2 2.96Å; T113-E115 PolarHBondContact O-N 3.37Å; T113-E115 VanDerWaalsContact O-N 3.14Å; T113-E115 PolarHBondContact OG1-OE2 3.11Å; T113-N116 VanDerWaalsContact N-CG 3.34Å; T113-N116 PolarHBondContact N-ND2 2.9Å; T113-N116 VanDerWaalsContact N-ND2 3.17Å; T113-N116 PolarHBondContact N-OD1 3.33Å; T113-N116 VanDerWaalsContact N-OD1 3.11Å; T113-N116 PolarHBondContact O-N 3.1Å; T113-N116 PolarHBondContact O-OD1 3.31Å; T113-N116 PolarHBondContact OG1-ND2 2.85Å; T113-A117 PolarHBondContact O-N 3.49Å
114	P	86.6	Confident	91.8	Very high	106 Å²	106	52.8 Å²	52.8	69%	0.688	28%	0.275	S	S	*	.	H	α-helix	trans	-51.4	-40.5	-179.2	-28	35.9	0	0	0	112.9	N116 A117	P114-N116 VanDerWaalsContact C-N 3.3Å; P114-N116 PolarHBondContact O-N 2.91Å; P114-A117 PolarHBondContact O-N 3.47Å
115	E	86.1	Confident	91.8	Very high	140 Å²	140	56.8 Å²	56.8	65%	0.654	30%	0.296	S	S	*	.	H	α-helix	trans	-70.2	-27.6	-178	-47.2	77.3	-168.9	0	0	112.8	T113	T113-E115 WeakPolarHBondContact CB-OE2 2.96Å; T113-E115 PolarHBondContact O-N 3.37Å; T113-E115 VanDerWaalsContact O-N 3.14Å; T113-E115 PolarHBondContact OG1-OE2 3.11Å
116	N	89.6	Confident	92	Very high	49 Å²	49	54.7 Å²	54.7	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-99.8	-10.2	-177.1	80.6	43.1	0	0	0	113.8	W111 L112 T113 P114 I118 R120	W111-N116 PolarHBondContact O-ND2 3.39Å; L112-N116 WeakPolarHBondContact CD1-OD1 3.38Å; T113-N116 VanDerWaalsContact N-CG 3.34Å; T113-N116 PolarHBondContact N-ND2 2.9Å; T113-N116 VanDerWaalsContact N-ND2 3.17Å; T113-N116 PolarHBondContact N-OD1 3.33Å; T113-N116 VanDerWaalsContact N-OD1 3.11Å; T113-N116 PolarHBondContact O-N 3.1Å; T113-N116 PolarHBondContact O-OD1 3.31Å; T113-N116 PolarHBondContact OG1-ND2 2.85Å; P114-N116 VanDerWaalsContact C-N 3.3Å; P114-N116 PolarHBondContact O-N 2.91Å; N116-I118 VanDerWaalsContact C-N 3.3Å; N116-R120 WeakPolarHBondContact O-CD 3.29Å; N116-R120 PolarHBondContact O-NE 2.95Å
117	A	90.9	Very high	92.3	Very high	2 Å²	2	49.1 Å²	49.1	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-71.8	-23	176.5	0	0	0	0	0	113	E98 L101 L112 T113 P114 N119 R120	E98-A117 HydrophobicContact CG-CB 4.33Å; L101-A117 HydrophobicContact CD1-CB 3.85Å; L112-A117 HydrophobicContact CD1-CB 4.21Å; L112-A117 HydrophobicContact CG-CB 4.5Å; T113-A117 PolarHBondContact O-N 3.49Å; P114-A117 PolarHBondContact O-N 3.47Å; A117-N119 PolarHBondContact O-N 3.4Å; A117-R120 VanDerWaalsContact O-CB 3.29Å; A117-R120 WeakPolarHBondContact O-CB 3.43Å; A117-R120 PolarHBondContact O-N 2.86Å
118	I	89.1	Confident	92.5	Very high	101 Å²	101	47.8 Å²	47.8	52%	0.518	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	124.7	-179.4	-58.2	173.4	0	0	0	111	N116 R120	N116-I118 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 2.94Å
119	N	91.1	Very high	92.6	Very high	28 Å²	28	45.4 Å²	45.4	15%	0.15	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	25.4	-177.8	-56.8	-41.3	0	0	0	114.1	K91 A117 F122 L148 A154	K91-N119 PolarHBondContact NZ-OD1 3.2Å; A117-N119 PolarHBondContact O-N 3.4Å; N119-F122 VanDerWaalsContact O-CE2 3.24Å; N119-F122 WeakPolarHBondContact O-CE2 3.32Å; N119-L148 HydrophobicContact CB-CD2 4.28Å; N119-L148 WeakPolarHBondContact O-CD2 3.49Å; N119-A154 HydrophobicContact CB-CB 4.37Å; N119-A154 WeakPolarHBondContact O-CB 3.36Å
120	R	94.2	Very high	92.8	Very high	25 Å²	25	44.5 Å²	44.5	9%	0.094	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-23.7	172.9	-63.4	-168.8	175.2	-105.2	-16.6	114	N116 A117 I118 L130 I131 P132 L148	N116-R120 WeakPolarHBondContact O-CD 3.29Å; N116-R120 PolarHBondContact O-NE 2.95Å; A117-R120 VanDerWaalsContact O-CB 3.29Å; A117-R120 WeakPolarHBondContact O-CB 3.43Å; A117-R120 PolarHBondContact O-N 2.86Å; I118-R120 PolarHBondContact O-N 2.94Å; R120-L130 HydrophobicContact CB-CD1 4.17Å; R120-L130 WeakPolarHBondContact O-CA 3.3Å; R120-I131 HydrophobicContact CB-CB 4.27Å; R120-I131 HydrophobicContact CG-CB 4.45Å; R120-I131 PolarHBondContact NH1-O 2.96Å; R120-I131 PolarHBondContact O-N 2.96Å; R120-P132 PolarHBondContact NH1-O 3.35Å; R120-L148 HydrophobicContact CG-CD2 4.14Å
121	V	95	Very high	93	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.3	-174.3	-169	0	0	0	0	109.1	E98 L101 V128 C129 L130	E98-V121 HydrophobicContact CB-CG2 4.3Å; E98-V121 HydrophobicContact CG-CG2 4.31Å; L101-V121 HydrophobicContact CD1-CG2 3.81Å; L101-V121 HydrophobicContact CD2-CG1 4.35Å; L101-V121 HydrophobicContact CD2-CG2 3.78Å; L101-V121 HydrophobicContact CG-CG2 3.91Å; V121-V128 HydrophobicContact CG1-CG1 4.1Å; V121-C129 WeakPolarHBondContact CA-O 3.49Å; V121-L130 HydrophobicContact CG2-CD1 3.96Å
122	F	96.6	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	161	177.8	-61.6	-90.2	0	0	0	110.1	V89 V90 K91 N119 V128 C129 I131 L151 A154 L155 I158	V89-F122 HydrophobicContact CG1-CB 3.76Å; V89-F122 HydrophobicContact CG1-CD1 3.61Å; V89-F122 HydrophobicContact CG1-CE1 4.47Å; V89-F122 HydrophobicContact CG1-CG 3.87Å; V90-F122 CarbonylContact O-C 3.5Å; V90-F122 WeakPolarHBondContact O-CA 3.03Å; K91-F122 HydrophobicContact CB-CD1 3.96Å; K91-F122 HydrophobicContact CB-CE1 4Å; K91-F122 HydrophobicContact CD-CE1 4.28Å; K91-F122 HydrophobicContact CG-CD1 4.46Å; K91-F122 HydrophobicContact CG-CE1 4.27Å; N119-F122 VanDerWaalsContact O-CE2 3.24Å; N119-F122 WeakPolarHBondContact O-CE2 3.32Å; F122-V128 CarbonylContact O-C 3.36Å; F122-V128 WeakPolarHBondContact O-CA 3.17Å; F122-C129 HydrophobicContact CB-CB 4.4Å; F122-C129 PolarHBondContact N-O 3.33Å; F122-C129 PolarHBondContact O-N 3.11Å; F122-I131 HydrophobicContact CD2-CD1 4.3Å; F122-I131 HydrophobicContact CE2-CD1 3.86Å; F122-L151 HydrophobicContact CE1-CD1 3.84Å; F122-L151 HydrophobicContact CZ-CD1 3.96Å; F122-A154 HydrophobicContact CE2-CB 3.8Å; F122-A154 HydrophobicContact CZ-CB 3.71Å; F122-L155 HydrophobicContact CE1-CD2 4.35Å; F122-I158 HydrophobicContact CB-CD1 3.97Å; F122-I158 HydrophobicContact CD1-CD1 4.38Å; F122-I158 HydrophobicContact CD2-CD1 3.43Å; F122-I158 VanDerWaalsContact CD2-CD1 3.43Å; F122-I158 HydrophobicContact CE2-CD1 3.94Å; F122-I158 HydrophobicContact CG-CD1 3.66Å
123	I	97.2	Very high	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.3	168.1	-60.6	175.5	0	0	0	107.2	V75 L78 M79 S82 V90 T92 L100	V75-I123 HydrophobicContact CG1-CD1 4.37Å; L78-I123 HydrophobicContact CB-CD1 3.96Å; L78-I123 HydrophobicContact CD1-CD1 4.27Å; M79-I123 HydrophobicContact CE-CB 3.69Å; M79-I123 HydrophobicContact CE-CD1 3.67Å; M79-I123 HydrophobicContact CE-CG1 3.33Å; M79-I123 HydrophobicContact CE-CG2 3.28Å; M79-I123 HydrophobicContact CG-CG2 4.44Å; M79-I123 HydrophobicContact SD-CG2 3.51Å; M79-I123 VanDerWaalsContact SD-CG2 3.51Å; S82-I123 VanDerWaalsContact OG-CG2 3.31Å; S82-I123 WeakPolarHBondContact OG-CG2 3.48Å; V90-I123 HydrophobicContact CB-CB 4.03Å; V90-I123 HydrophobicContact CB-CG2 4.43Å; V90-I123 PolarHBondContact N-O 2.92Å; V90-I123 PolarHBondContact O-N 3.12Å; T92-I123 HydrophobicContact CG2-CD1 3.89Å; L100-I123 HydrophobicContact CD1-CD1 4.05Å; L100-I123 HydrophobicContact CD1-CG1 3.94Å
124	F	96.4	Very high	93.1	Very high	29 Å²	29	37.6 Å²	37.6	13%	0.127	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	130.5	-179.8	-179.1	-115.8	0	0	0	110.9	L17 P86 V88 V89 G126 S127 I158 P162	L17-F124 HydrophobicContact CD1-CD2 4.4Å; L17-F124 HydrophobicContact CD1-CE2 3.47Å; L17-F124 VanDerWaalsContact CD1-CE2 3.47Å; L17-F124 HydrophobicContact CD1-CZ 3.75Å; L17-F124 HydrophobicContact CG-CE2 4.49Å; P86-F124 WeakPolarHBondContact O-CE2 3.34Å; P86-F124 WeakPolarHBondContact O-CZ 3.48Å; V88-F124 WeakPolarHBondContact O-CD2 3.05Å; V89-F124 HydrophobicContact CB-CD2 4.42Å; V89-F124 HydrophobicContact CG2-CD2 3.46Å; V89-F124 VanDerWaalsContact CG2-CD2 3.46Å; V89-F124 HydrophobicContact CG2-CE2 3.9Å; V89-F124 HydrophobicContact CG2-CG 4.26Å; F124-G126 PolarHBondContact O-N 3.45Å; F124-S127 PolarHBondContact N-O 2.92Å; F124-S127 PolarHBondContact O-N 2.98Å; F124-I158 HydrophobicContact CD1-CG2 4.06Å; F124-I158 HydrophobicContact CD2-CG2 4.31Å; F124-I158 HydrophobicContact CE1-CG2 4.34Å; F124-I158 HydrophobicContact CG-CG2 4.05Å; F124-P162 HydrophobicContact CD1-CB 4.48Å; F124-P162 HydrophobicContact CE1-CB 3.81Å
125	N	94.2	Very high	93.3	Very high	87 Å²	87	40.6 Å²	40.6	47%	0.465	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	39.6	179	-166.9	43.1	0	0	0	113.7	S127	N125-S127 VanDerWaalsContact C-N 3.33Å; N125-S127 PolarHBondContact O-N 3.39Å
126	G	94.3	Very high	93.4	Very high	17 Å²	17	37.6 Å²	37.6	18%	0.175	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	22.7	-179.6	0	0	0	0	0	114.6	S82 F124	S82-G126 WeakPolarHBondContact OG-CA 3.33Å; S82-G126 PolarHBondContact OG-N 3.44Å; F124-G126 PolarHBondContact O-N 3.45Å
127	S	95.4	Very high	93.4	Very high	26 Å²	26	35.6 Å²	35.6	18%	0.182	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.5	175.2	-68.1	0	0	0	0	111.2	F124 N125	F124-S127 PolarHBondContact N-O 2.92Å; F124-S127 PolarHBondContact O-N 2.98Å; N125-S127 VanDerWaalsContact C-N 3.33Å; N125-S127 PolarHBondContact O-N 3.39Å
128	V	96	Very high	93.1	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.2	174.2	-178.7	0	0	0	0	110.4	M79 L100 V121 F122 A167 I175	M79-V128 HydrophobicContact CE-CG2 3.57Å; L100-V128 HydrophobicContact CD1-CG2 4.5Å; V121-V128 HydrophobicContact CG1-CG1 4.1Å; F122-V128 CarbonylContact O-C 3.36Å; F122-V128 WeakPolarHBondContact O-CA 3.17Å; V128-A167 HydrophobicContact CG1-CB 4.44Å; V128-A167 VanDerWaalsContact O-CB 3.27Å; V128-A167 WeakPolarHBondContact O-CB 3.5Å; V128-A167 PolarHBondContact O-N 3.17Å; V128-A167 VanDerWaalsContact O-N 3.09Å; V128-I175 HydrophobicContact CB-CD1 4.08Å; V128-I175 HydrophobicContact CG1-CD1 4.06Å; V128-I175 HydrophobicContact CG2-CB 4.46Å; V128-I175 HydrophobicContact CG2-CD1 3.7Å; V128-I175 HydrophobicContact CG2-CG2 3.91Å
129	C	96.2	Very high	93	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136	173.2	-72.9	0	0	0	0	109.3	V121 F122 C165	V121-C129 WeakPolarHBondContact CA-O 3.49Å; F122-C129 HydrophobicContact CB-CB 4.4Å; F122-C129 PolarHBondContact N-O 3.33Å; F122-C129 PolarHBondContact O-N 3.11Å; C129-C165 CarbonylContact C-O 3.39Å; C129-C165 WeakPolarHBondContact CA-O 3.26Å; C129-C165 HydrophobicContact CB-CB 4.46Å; C129-C165 WeakPolarHBondContact CB-O 3.18Å
130	L	95.8	Very high	92.9	Very high	8 Å²	8	54.2 Å²	54.2	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	105.8	173.7	178.7	64.9	0	0	0	108.4	P109 L112 R120 V121 P132 C165 A167	P109-L130 HydrophobicContact CG-CD2 4.07Å; L112-L130 HydrophobicContact CD1-CD1 3.93Å; L112-L130 HydrophobicContact CD2-CD1 4.05Å; L112-L130 HydrophobicContact CD2-CD2 4.16Å; R120-L130 HydrophobicContact CB-CD1 4.17Å; R120-L130 WeakPolarHBondContact O-CA 3.3Å; V121-L130 HydrophobicContact CG2-CD1 3.96Å; L130-P132 WeakPolarHBondContact O-CD 3.39Å; L130-P132 VanDerWaalsContact O-N 3.15Å; L130-C165 CarbonylContact C-O 3.58Å; L130-C165 PolarHBondContact N-O 3.14Å; L130-A167 HydrophobicContact CB-CB 3.78Å
131	I	95.6	Very high	92.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.245	C	C	.	.			trans	-64.4	113.9	-176.3	-62.1	-179.2	0	0	0	110.1	R120 F122 W144 L148 A154 L157 I158	R120-I131 HydrophobicContact CB-CB 4.27Å; R120-I131 HydrophobicContact CG-CB 4.45Å; R120-I131 PolarHBondContact NH1-O 2.96Å; R120-I131 PolarHBondContact O-N 2.96Å; F122-I131 HydrophobicContact CD2-CD1 4.3Å; F122-I131 HydrophobicContact CE2-CD1 3.86Å; I131-W144 HydrophobicContact CG2-CH2 4.46Å; I131-W144 HydrophobicContact CG2-CZ2 3.6Å; I131-L148 HydrophobicContact CD1-CD2 4.08Å; I131-L148 HydrophobicContact CG2-CD2 4.43Å; I131-A154 HydrophobicContact CD1-CB 3.64Å; I131-L157 HydrophobicContact CG2-CD1 3.89Å; I131-I158 HydrophobicContact CD1-CD1 4.3Å; I131-I158 HydrophobicContact CD1-CG1 4.25Å; I131-I158 HydrophobicContact CG1-CG1 4.44Å
132	P	93.8	Very high	92.1	Very high	18 Å²	18	58.1 Å²	58.1	12%	0.117	28%	0.277	C	S	.	.			trans	-70.7	166.7	-175.6	28.9	-37.1	0	0	0	112.7	R120 L130 D136 V137 W144 L164	R120-P132 PolarHBondContact NH1-O 3.35Å; L130-P132 WeakPolarHBondContact O-CD 3.39Å; L130-P132 VanDerWaalsContact O-N 3.15Å; P132-D136 HydrophobicContact CB-CB 4.37Å; P132-V137 HydrophobicContact CB-CG1 4.08Å; P132-V137 HydrophobicContact CG-CG1 3.46Å; P132-V137 VanDerWaalsContact CG-CG1 3.46Å; P132-W144 HydrophobicContact CG-CH2 4.01Å; P132-W144 HydrophobicContact CG-CZ2 3.65Å; P132-W144 PolarHBondContact O-NE1 2.86Å; P132-L164 VanDerWaalsContact CD-O 3.27Å; P132-L164 WeakPolarHBondContact CD-O 3.3Å; P132-L164 WeakPolarHBondContact CG-O 3.49Å
133	R	91.6	Very high	91.6	Very high	62 Å²	62	61.8 Å²	61.8	23%	0.234	30%	0.297	C	S	.	.			trans	-75.7	152.5	172.8	-55.7	175.9	-62.8	-177.1	-4.8	109.6	W111 K135 D136	W111-R133 VanDerWaalsContact CD2-CD 3.43Å; W111-R133 HydrophobicContact CD2-CG 3.69Å; W111-R133 VanDerWaalsContact CE3-CD 3.47Å; W111-R133 HydrophobicContact CE3-CG 3.55Å; W111-R133 HydrophobicContact CG-CG 4.39Å; W111-R133 VanDerWaalsContact CG-NE 3.28Å; W111-R133 HydrophobicContact CH2-CG 4.05Å; W111-R133 HydrophobicContact CZ2-CG 4.13Å; W111-R133 HydrophobicContact CZ3-CG 3.75Å; R133-K135 PolarHBondContact O-N 2.94Å; R133-D136 WeakPolarHBondContact CB-OD2 3.36Å; R133-D136 IonicContact CZ-OD2 3.89Å; R133-D136 PolarHBondContact N-OD2 2.87Å; R133-D136 IonicContact NE-OD2 2.85Å; R133-D136 PolarHBondContact NE-OD2 3Å; R133-D136 IonicContact NH2-OD1 3.08Å; R133-D136 IonicContact NH2-OD2 3.99Å; R133-D136 PolarHBondContact O-N 2.91Å
134	R	90.3	Very high	91.3	Very high	88 Å²	88	62 Å²	62	33%	0.332	30%	0.298	S	S	.	.	H	α-helix	trans	-48.7	-35.8	173.9	-177	177.3	174.6	98	9.1	113.4	D136 R138 S142 W144	R134-D136 PolarHBondContact O-N 3.34Å; R134-R138 WeakPolarHBondContact O-CA 3.49Å; R134-R138 WeakPolarHBondContact O-CB 3.5Å; R134-R138 PolarHBondContact O-N 3.24Å; R134-S142 VanDerWaalsContact CZ-O 3.25Å; R134-S142 PolarHBondContact NH1-O 3.3Å; R134-S142 PolarHBondContact NH2-O 2.87Å; R134-W144 HydrophobicContact CB-CG 4.5Å; R134-W144 WeakPolarHBondContact CD-O 3.35Å; R134-W144 HydrophobicContact CG-CB 4.23Å; R134-W144 PolarHBondContact NH1-O 3.43Å
135	K	88.8	Confident	90.9	Very high	169 Å²	169	62.2 Å²	62.2	74%	0.735	30%	0.302	S	S	*	.	H	α-helix	trans	-61.5	-34.4	-179	-69.7	-177.1	179.1	178.9	0	112.4	R133	R133-K135 PolarHBondContact O-N 2.94Å
136	D	88.4	Confident	90.5	Very high	78 Å²	78	66.9 Å²	66.9	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-81.5	-31.6	-172.1	-52.5	-42.6	0	0	0	111	P132 R133 R134	P132-D136 HydrophobicContact CB-CB 4.37Å; R133-D136 WeakPolarHBondContact CB-OD2 3.36Å; R133-D136 IonicContact CZ-OD2 3.89Å; R133-D136 PolarHBondContact N-OD2 2.87Å; R133-D136 IonicContact NE-OD2 2.85Å; R133-D136 PolarHBondContact NE-OD2 3Å; R133-D136 IonicContact NH2-OD1 3.08Å; R133-D136 IonicContact NH2-OD2 3.99Å; R133-D136 PolarHBondContact O-N 2.91Å; R134-D136 PolarHBondContact O-N 3.34Å
137	V	90.5	Very high	90	Very high	7 Å²	7	73.2 Å²	73.2	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-108	-2	-178.3	-62.4	0	0	0	0	114.9	P132 K139 Q140 V141 W144 L164	P132-V137 HydrophobicContact CB-CG1 4.08Å; P132-V137 HydrophobicContact CG-CG1 3.46Å; P132-V137 VanDerWaalsContact CG-CG1 3.46Å; V137-K139 PolarHBondContact O-N 3Å; V137-Q140 PolarHBondContact O-N 2.96Å; V137-V141 PolarHBondContact O-N 3.39Å; V137-W144 HydrophobicContact CG2-CB 4.1Å; V137-W144 HydrophobicContact CG2-CD2 3.41Å; V137-W144 VanDerWaalsContact CG2-CD2 3.41Å; V137-W144 HydrophobicContact CG2-CE3 3.71Å; V137-W144 HydrophobicContact CG2-CG 3.59Å; V137-W144 HydrophobicContact CG2-CZ2 4.32Å; V137-W144 HydrophobicContact CG2-CZ3 4.28Å; V137-L164 HydrophobicContact CG1-CB 4.46Å; V137-L164 HydrophobicContact CG1-CD1 4.46Å
138	R	84.7	Confident	89.6	Confident	187 Å²	187	73.3 Å²	73.3	71%	0.706	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	-34.3	-178.4	146.1	-178.8	-178.2	-176	1.6	114.3	R134 Q140	R134-R138 WeakPolarHBondContact O-CA 3.49Å; R134-R138 WeakPolarHBondContact O-CB 3.5Å; R134-R138 PolarHBondContact O-N 3.24Å; R138-Q140 VanDerWaalsContact C-N 3.34Å
139	K	86.8	Confident	89	Confident	206 Å²	206	79.9 Å²	79.9	90%	0.896	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-25.9	-177	-66.1	-177.5	-177.9	176.3	0	112.4	V137	V137-K139 PolarHBondContact O-N 3Å
140	Q	88.2	Confident	88.7	Confident	128 Å²	128	82 Å²	82	60%	0.598	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-39	-177.3	-62.1	140.4	-6.1	0	0	110.9	V137 R138 L164	V137-Q140 PolarHBondContact O-N 2.96Å; R138-Q140 VanDerWaalsContact C-N 3.34Å; Q140-L164 HydrophobicContact CB-CD1 4.42Å
141	V	89	Confident	88.5	Confident	11 Å²	11	83.4 Å²	83.4	7%	0.067	39%	0.392	C	S	.	.			trans	-136.3	117.8	-170.5	-178.6	0	0	0	0	110.6	V137 D143 W144 Y161 L164	V137-V141 PolarHBondContact O-N 3.39Å; V141-D143 WeakPolarHBondContact CG1-OD1 3.48Å; V141-W144 HydrophobicContact CB-CE3 4.38Å; V141-W144 HydrophobicContact CG1-CB 4.47Å; V141-W144 HydrophobicContact CG1-CE3 4.17Å; V141-Y161 HydrophobicContact CG1-CD2 4.39Å; V141-Y161 HydrophobicContact CG1-CE1 4.16Å; V141-Y161 HydrophobicContact CG1-CE2 3.67Å; V141-Y161 HydrophobicContact CG2-CD1 4.06Å; V141-Y161 HydrophobicContact CG2-CE1 3.88Å; V141-Y161 HydrophobicContact CG2-CG 4.46Å; V141-L164 HydrophobicContact CG2-CD1 3.49Å; V141-L164 VanDerWaalsContact CG2-CD1 3.49Å
142	S	83.8	Confident	88.3	Confident	96 Å²	96	87.7 Å²	87.7	67%	0.671	41%	0.412	S	S	*	.	S	Bend	trans	-83.6	-24.6	-175.3	47.5	0	0	0	0	114.4	R134	R134-S142 VanDerWaalsContact CZ-O 3.25Å; R134-S142 PolarHBondContact NH1-O 3.3Å; R134-S142 PolarHBondContact NH2-O 2.87Å
143	D	86.4	Confident	88.2	Confident	78 Å²	78	90.1 Å²	90.1	42%	0.417	42%	0.421	S	S	.	.	S	Bend	trans	-92.8	6.8	-175.2	67.2	-42.1	0	0	0	113.7	V141 R160 Y161	V141-D143 WeakPolarHBondContact CG1-OD1 3.48Å; D143-R160 IonicContact OD2-CZ 2.59Å; D143-R160 IonicContact OD2-NH1 2.67Å; D143-R160 PolarHBondContact OD2-NH1 3.05Å; D143-R160 IonicContact OD2-NH2 3.72Å; D143-Y161 PolarHBondContact OD1-OH 2.97Å; D143-Y161 VanDerWaalsContact OD1-OH 3.07Å; D143-Y161 PolarHBondContact OD2-OH 3.3Å
144	W	90.9	Very high	88.3	Confident	4 Å²	4	87.1 Å²	87.1	2%	0.015	41%	0.41	C	S	.	.			trans	-62.3	127.8	-179.6	-161.8	-82.9	0	0	0	112.9	I131 P132 R134 V137 V141 L157 Y161 L164	I131-W144 HydrophobicContact CG2-CH2 4.46Å; I131-W144 HydrophobicContact CG2-CZ2 3.6Å; P132-W144 HydrophobicContact CG-CH2 4.01Å; P132-W144 HydrophobicContact CG-CZ2 3.65Å; P132-W144 PolarHBondContact O-NE1 2.86Å; R134-W144 HydrophobicContact CB-CG 4.5Å; R134-W144 WeakPolarHBondContact CD-O 3.35Å; R134-W144 HydrophobicContact CG-CB 4.23Å; R134-W144 PolarHBondContact NH1-O 3.43Å; V137-W144 HydrophobicContact CG2-CB 4.1Å; V137-W144 HydrophobicContact CG2-CD2 3.41Å; V137-W144 VanDerWaalsContact CG2-CD2 3.41Å; V137-W144 HydrophobicContact CG2-CE3 3.71Å; V137-W144 HydrophobicContact CG2-CG 3.59Å; V137-W144 HydrophobicContact CG2-CZ2 4.32Å; V137-W144 HydrophobicContact CG2-CZ3 4.28Å; V141-W144 HydrophobicContact CB-CE3 4.38Å; V141-W144 HydrophobicContact CG1-CB 4.47Å; V141-W144 HydrophobicContact CG1-CE3 4.17Å; W144-L157 HydrophobicContact CD2-CD2 4.04Å; W144-L157 HydrophobicContact CE3-CD2 3.82Å; W144-L157 HydrophobicContact CH2-CD1 4.47Å; W144-L157 HydrophobicContact CH2-CD2 4.28Å; W144-L157 HydrophobicContact CZ2-CD1 4.05Å; W144-L157 HydrophobicContact CZ2-CD2 4.48Å; W144-L157 HydrophobicContact CZ3-CD2 3.95Å; W144-Y161 HydrophobicContact CE3-CD2 4.15Å; W144-Y161 AromaticContact CZ3-CD2 3.79Å; W144-Y161 HydrophobicContact CZ3-CD2 3.79Å; W144-Y161 HydrophobicContact CZ3-CG 4.24Å; W144-L164 HydrophobicContact CH2-CB 4.34Å; W144-L164 HydrophobicContact CZ3-CB 4.3Å; W144-L164 HydrophobicContact CZ3-CD1 4.28Å
145	P	88.8	Confident	88.5	Confident	33 Å²	33	83.5 Å²	83.5	21%	0.214	40%	0.397	C	S	.	.			trans	-63	146.1	-173.1	25.1	-33.6	0	0	0	112.9	L148 L157	P145-L148 HydrophobicContact CG-CD1 4.01Å; P145-L157 HydrophobicContact CG-CD1 3.85Å
146	K	84.5	Confident	88.6	Confident	185 Å²	185	78.5 Å²	78.5	80%	0.804	38%	0.379	S	S	*	.	S	Bend	trans	-68.3	-40.7	179.2	-73.9	-175.9	-178.1	175.7	0	112
147	K	84.8	Confident	88.9	Confident	150 Å²	150	74.9 Å²	74.9	65%	0.652	36%	0.359	S	S	*	.	S	Bend	trans	-132.6	145.2	173.2	-75.6	-172.8	176.8	-171.5	0	107.1	H149	K147-H149 PolarHBondContact O-CD2 2.82Å
148	L	87.7	Confident	89.1	Confident	29 Å²	29	74.5 Å²	74.5	15%	0.152	36%	0.357	C	S	.	.			trans	-91.9	116.1	177.6	-155.5	74.5	0	0	0	107	N119 R120 I131 P145 E153 A154 L157	N119-L148 HydrophobicContact CB-CD2 4.28Å; N119-L148 WeakPolarHBondContact O-CD2 3.49Å; R120-L148 HydrophobicContact CG-CD2 4.14Å; I131-L148 HydrophobicContact CD1-CD2 4.08Å; I131-L148 HydrophobicContact CG2-CD2 4.43Å; P145-L148 HydrophobicContact CG-CD1 4.01Å; L148-E153 HydrophobicContact CD1-CB 4.19Å; L148-A154 HydrophobicContact CD2-CB 3.89Å; L148-A154 HydrophobicContact CG-CB 4.48Å; L148-L157 HydrophobicContact CD1-CD1 3.6Å
149	H	82.7	Confident	89.5	Confident	140 Å²	140	72.5 Å²	72.5	65%	0.648	35%	0.35	S	S	*	.			trans	-106.1	-25.7	-170.6	-67.8	-69.6	0	0	0	113.1	K147 E153	K147-H149 PolarHBondContact O-CD2 2.82Å; H149-E153 PolarHBondContact N-OE2 3.41Å
150	S	90.2	Very high	89.8	Confident	44 Å²	44	68.2 Å²	68.2	31%	0.308	33%	0.328	S	S	.	.			trans	-138.1	157.1	-176.2	72	0	0	0	0	112.5	Q152 E153 A154	S150-Q152 VanDerWaalsContact C-N 3.26Å; S150-Q152 PolarHBondContact O-N 3.5Å; S150-E153 PolarHBondContact O-N 2.99Å; S150-E153 WeakPolarHBondContact OG-CG 3.42Å; S150-E153 PolarHBondContact OG-N 3.35Å; S150-A154 PolarHBondContact O-N 3.44Å
151	L	90.9	Very high	90.1	Very high	38 Å²	38	64.9 Å²	64.9	20%	0.199	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-39	170.6	174.1	65.8	0	0	0	111.8	Y15 F122 E153 A154 L155	Y15-L151 HydrophobicContact CD2-CD1 4.49Å; Y15-L151 HydrophobicContact CE1-CD2 3.76Å; Y15-L151 HydrophobicContact CE2-CD1 4.05Å; Y15-L151 HydrophobicContact CE2-CD2 3.91Å; Y15-L151 VanDerWaalsContact CZ-CD2 3.41Å; Y15-L151 WeakPolarHBondContact OH-CD2 3.36Å; F122-L151 HydrophobicContact CE1-CD1 3.84Å; F122-L151 HydrophobicContact CZ-CD1 3.96Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-E153 PolarHBondContact O-N 3.23Å; L151-A154 VanDerWaalsContact O-CB 3.31Å; L151-A154 WeakPolarHBondContact O-CB 3.31Å; L151-A154 PolarHBondContact O-N 3.46Å; L151-A154 VanDerWaalsContact O-N 3.11Å; L151-L155 HydrophobicContact CD1-CD1 4.35Å; L151-L155 HydrophobicContact CD1-CG 4.22Å; L151-L155 HydrophobicContact CG-CD1 4.11Å; L151-L155 HydrophobicContact CG-CG 4.38Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.38Å
152	Q	90.7	Very high	90.3	Very high	90 Å²	90	66.4 Å²	66.4	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-41.7	-178.9	-169.2	62.1	41.5	0	0	111.7	S150 A154 L155 D156	S150-Q152 VanDerWaalsContact C-N 3.26Å; S150-Q152 PolarHBondContact O-N 3.5Å; Q152-A154 VanDerWaalsContact C-N 3.27Å; Q152-A154 PolarHBondContact O-N 2.94Å; Q152-L155 PolarHBondContact O-N 2.77Å; Q152-D156 PolarHBondContact NE2-OD1 3.33Å; Q152-D156 WeakPolarHBondContact O-CB 3.36Å; Q152-D156 VanDerWaalsContact O-CG 3.32Å; Q152-D156 PolarHBondContact O-N 3.41Å
153	E	92.4	Very high	90.8	Very high	69 Å²	69	69 Å²	69	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-39.9	173.9	-75	174.3	175.4	0	0	111.8	L148 H149 S150 L151 D156 L157	L148-E153 HydrophobicContact CD1-CB 4.19Å; H149-E153 PolarHBondContact N-OE2 3.41Å; S150-E153 PolarHBondContact O-N 2.99Å; S150-E153 WeakPolarHBondContact OG-CG 3.42Å; S150-E153 PolarHBondContact OG-N 3.35Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-E153 PolarHBondContact O-N 3.23Å; E153-D156 PolarHBondContact O-N 3.43Å; E153-L157 WeakPolarHBondContact O-CG 3.17Å; E153-L157 PolarHBondContact O-N 2.88Å; E153-L157 VanDerWaalsContact O-N 3.08Å
154	A	93.9	Very high	91.1	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-48.3	178.2	0	0	0	0	0	111.7	N119 F122 I131 L148 S150 L151 Q152 D156 L157 I158	N119-A154 HydrophobicContact CB-CB 4.37Å; N119-A154 WeakPolarHBondContact O-CB 3.36Å; F122-A154 HydrophobicContact CE2-CB 3.8Å; F122-A154 HydrophobicContact CZ-CB 3.71Å; I131-A154 HydrophobicContact CD1-CB 3.64Å; L148-A154 HydrophobicContact CD2-CB 3.89Å; L148-A154 HydrophobicContact CG-CB 4.48Å; S150-A154 PolarHBondContact O-N 3.44Å; L151-A154 VanDerWaalsContact O-CB 3.31Å; L151-A154 WeakPolarHBondContact O-CB 3.31Å; L151-A154 PolarHBondContact O-N 3.46Å; L151-A154 VanDerWaalsContact O-N 3.11Å; Q152-A154 VanDerWaalsContact C-N 3.27Å; Q152-A154 PolarHBondContact O-N 2.94Å; A154-D156 VanDerWaalsContact C-N 3.34Å; A154-D156 PolarHBondContact O-N 3.14Å; A154-L157 PolarHBondContact O-N 2.98Å; A154-I158 WeakPolarHBondContact O-CG1 3.23Å; A154-I158 PolarHBondContact O-N 3.2Å; A154-I158 VanDerWaalsContact O-N 3.07Å
155	L	93.6	Very high	91.3	Very high	12 Å²	12	67.3 Å²	67.3	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-40.2	177.8	-64.4	175.7	0	0	0	111.8	Y15 V89 F122 L151 Q152 L157 I158 R159	Y15-L155 HydrophobicContact CD1-CD1 4.12Å; Y15-L155 HydrophobicContact CD2-CD1 4.33Å; Y15-L155 HydrophobicContact CD2-CD2 4.14Å; Y15-L155 HydrophobicContact CG-CD1 3.82Å; Y15-L155 HydrophobicContact CG-CD2 4.17Å; V89-L155 HydrophobicContact CB-CD2 4.08Å; V89-L155 HydrophobicContact CG1-CD2 3.87Å; F122-L155 HydrophobicContact CE1-CD2 4.35Å; L151-L155 HydrophobicContact CD1-CD1 4.35Å; L151-L155 HydrophobicContact CD1-CG 4.22Å; L151-L155 HydrophobicContact CG-CD1 4.11Å; L151-L155 HydrophobicContact CG-CG 4.38Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.38Å; Q152-L155 PolarHBondContact O-N 2.77Å; L155-L157 VanDerWaalsContact C-N 3.31Å; L155-L157 PolarHBondContact O-N 3.45Å; L155-I158 PolarHBondContact O-N 2.88Å; L155-R159 WeakPolarHBondContact O-CB 3.25Å; L155-R159 PolarHBondContact O-N 3.33Å
156	D	92.4	Very high	91.6	Very high	63 Å²	63	68.2 Å²	68.2	34%	0.337	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-32.6	176.9	-75.5	-12.7	0	0	0	112.7	Q152 E153 A154 R160	Q152-D156 PolarHBondContact NE2-OD1 3.33Å; Q152-D156 WeakPolarHBondContact O-CB 3.36Å; Q152-D156 VanDerWaalsContact O-CG 3.32Å; Q152-D156 PolarHBondContact O-N 3.41Å; E153-D156 PolarHBondContact O-N 3.43Å; A154-D156 VanDerWaalsContact C-N 3.34Å; A154-D156 PolarHBondContact O-N 3.14Å; D156-R160 WeakPolarHBondContact O-CB 3.39Å; D156-R160 VanDerWaalsContact O-CG 3.29Å; D156-R160 WeakPolarHBondContact O-CG 3.28Å; D156-R160 PolarHBondContact O-N 3.15Å; D156-R160 VanDerWaalsContact O-N 3.14Å; D156-R160 PolarHBondContact O-NE 2.79Å
157	L	94.6	Very high	92.1	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-69.6	-45.4	173.6	-72.7	173.4	0	0	0	111.5	I131 W144 P145 L148 E153 A154 L155 R159 R160 Y161	I131-L157 HydrophobicContact CG2-CD1 3.89Å; W144-L157 HydrophobicContact CD2-CD2 4.04Å; W144-L157 HydrophobicContact CE3-CD2 3.82Å; W144-L157 HydrophobicContact CH2-CD1 4.47Å; W144-L157 HydrophobicContact CH2-CD2 4.28Å; W144-L157 HydrophobicContact CZ2-CD1 4.05Å; W144-L157 HydrophobicContact CZ2-CD2 4.48Å; W144-L157 HydrophobicContact CZ3-CD2 3.95Å; P145-L157 HydrophobicContact CG-CD1 3.85Å; L148-L157 HydrophobicContact CD1-CD1 3.6Å; E153-L157 WeakPolarHBondContact O-CG 3.17Å; E153-L157 PolarHBondContact O-N 2.88Å; E153-L157 VanDerWaalsContact O-N 3.08Å; A154-L157 PolarHBondContact O-N 2.98Å; L155-L157 VanDerWaalsContact C-N 3.31Å; L155-L157 PolarHBondContact O-N 3.45Å; L157-R159 VanDerWaalsContact C-N 3.29Å; L157-R159 PolarHBondContact O-N 3.23Å; L157-R160 PolarHBondContact O-N 2.84Å; L157-Y161 HydrophobicContact CD2-CD2 4.14Å; L157-Y161 HydrophobicContact CD2-CE2 4.37Å; L157-Y161 WeakPolarHBondContact O-CA 3.34Å; L157-Y161 PolarHBondContact O-N 3.03Å
158	I	94.6	Very high	92.6	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-41.4	177.5	-66.3	168.3	0	0	0	110.3	V89 F122 F124 I131 A154 L155 P162 C165	V89-I158 HydrophobicContact CG1-CD1 3.96Å; V89-I158 HydrophobicContact CG2-CG2 3.88Å; F122-I158 HydrophobicContact CB-CD1 3.97Å; F122-I158 HydrophobicContact CD1-CD1 4.38Å; F122-I158 HydrophobicContact CD2-CD1 3.43Å; F122-I158 VanDerWaalsContact CD2-CD1 3.43Å; F122-I158 HydrophobicContact CE2-CD1 3.94Å; F122-I158 HydrophobicContact CG-CD1 3.66Å; F124-I158 HydrophobicContact CD1-CG2 4.06Å; F124-I158 HydrophobicContact CD2-CG2 4.31Å; F124-I158 HydrophobicContact CE1-CG2 4.34Å; F124-I158 HydrophobicContact CG-CG2 4.05Å; I131-I158 HydrophobicContact CD1-CD1 4.3Å; I131-I158 HydrophobicContact CD1-CG1 4.25Å; I131-I158 HydrophobicContact CG1-CG1 4.44Å; A154-I158 WeakPolarHBondContact O-CG1 3.23Å; A154-I158 PolarHBondContact O-N 3.2Å; A154-I158 VanDerWaalsContact O-N 3.07Å; L155-I158 PolarHBondContact O-N 2.88Å; I158-P162 WeakPolarHBondContact O-CA 3.48Å; I158-P162 WeakPolarHBondContact O-CB 3.31Å; I158-P162 WeakPolarHBondContact O-CD 3.39Å; I158-C165 HydrophobicContact CG1-CB 4.07Å
159	R	92.8	Very high	93	Very high	145 Å²	145	58 Å²	58	55%	0.547	28%	0.28	S	S	.	.	H	α-helix	trans	-61.6	-46.1	177.1	-170	177.1	178.4	166.9	5.5	112.9	L17 L155 L157	L17-R159 HydrophobicContact CB-CG 4.4Å; L17-R159 HydrophobicContact CD1-CB 4.41Å; L17-R159 HydrophobicContact CD2-CB 4.02Å; L17-R159 PolarHBondContact O-NE 3.35Å; L17-R159 PolarHBondContact O-NH1 3.16Å; L17-R159 PolarHBondContact O-NH2 3.21Å; L155-R159 WeakPolarHBondContact O-CB 3.25Å; L155-R159 PolarHBondContact O-N 3.33Å; L157-R159 VanDerWaalsContact C-N 3.29Å; L157-R159 PolarHBondContact O-N 3.23Å
160	R	93	Very high	93.6	Very high	116 Å²	116	55.9 Å²	55.9	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-81.7	-34.6	-174.1	-70	-175.7	-63.8	141.5	-9.2	112.7	D143 D156 L157 P162	D143-R160 IonicContact OD2-CZ 2.59Å; D143-R160 IonicContact OD2-NH1 2.67Å; D143-R160 PolarHBondContact OD2-NH1 3.05Å; D143-R160 IonicContact OD2-NH2 3.72Å; D156-R160 WeakPolarHBondContact O-CB 3.39Å; D156-R160 VanDerWaalsContact O-CG 3.29Å; D156-R160 WeakPolarHBondContact O-CG 3.28Å; D156-R160 PolarHBondContact O-N 3.15Å; D156-R160 VanDerWaalsContact O-N 3.14Å; D156-R160 PolarHBondContact O-NE 2.79Å; L157-R160 PolarHBondContact O-N 2.84Å; R160-P162 VanDerWaalsContact C-CD 3.49Å
161	Y	94.5	Very high	93.8	Very high	57 Å²	57	53.8 Å²	53.8	22%	0.224	26%	0.258	C	S	.	.			trans	-134.3	55.2	-170.4	-50	-62.7	0	0	0	112.4	V141 D143 W144 L157 Q163 L164 C165	V141-Y161 HydrophobicContact CG1-CD2 4.39Å; V141-Y161 HydrophobicContact CG1-CE1 4.16Å; V141-Y161 HydrophobicContact CG1-CE2 3.67Å; V141-Y161 HydrophobicContact CG2-CD1 4.06Å; V141-Y161 HydrophobicContact CG2-CE1 3.88Å; V141-Y161 HydrophobicContact CG2-CG 4.46Å; D143-Y161 PolarHBondContact OD1-OH 2.97Å; D143-Y161 VanDerWaalsContact OD1-OH 3.07Å; D143-Y161 PolarHBondContact OD2-OH 3.3Å; W144-Y161 HydrophobicContact CE3-CD2 4.15Å; W144-Y161 AromaticContact CZ3-CD2 3.79Å; W144-Y161 HydrophobicContact CZ3-CD2 3.79Å; W144-Y161 HydrophobicContact CZ3-CG 4.24Å; L157-Y161 HydrophobicContact CD2-CD2 4.14Å; L157-Y161 HydrophobicContact CD2-CE2 4.37Å; L157-Y161 WeakPolarHBondContact O-CA 3.34Å; L157-Y161 PolarHBondContact O-N 3.03Å; Y161-Q163 PolarHBondContact O-N 2.97Å; Y161-Q163 VanDerWaalsContact O-N 3.14Å; Y161-L164 HydrophobicContact CG-CD1 4.39Å; Y161-L164 PolarHBondContact O-N 2.95Å; Y161-C165 PolarHBondContact O-N 3.48Å
162	P	93.1	Very high	94	Very high	44 Å²	44	55 Å²	55	29%	0.286	26%	0.26	S	S	.	.	H	α-helix	trans	-57.5	-36.4	-174.4	22.5	-33.3	0	0	0	112.7	F124 I158 R160 L164 C165 L166	F124-P162 HydrophobicContact CD1-CB 4.48Å; F124-P162 HydrophobicContact CE1-CB 3.81Å; I158-P162 WeakPolarHBondContact O-CA 3.48Å; I158-P162 WeakPolarHBondContact O-CB 3.31Å; I158-P162 WeakPolarHBondContact O-CD 3.39Å; R160-P162 VanDerWaalsContact C-CD 3.49Å; P162-L164 VanDerWaalsContact C-N 3.3Å; P162-L164 PolarHBondContact O-N 3.11Å; P162-C165 PolarHBondContact O-N 2.85Å; P162-L166 PolarHBondContact O-N 3.34Å
163	Q	93.3	Very high	94.2	Very high	151 Å²	151	56.2 Å²	56.2	71%	0.706	27%	0.266	S	S	*	.	H	α-helix	trans	-68.2	-26.8	179.5	-58.8	-62.2	-13.6	0	0	113.7	Y161	Y161-Q163 PolarHBondContact O-N 2.97Å; Y161-Q163 VanDerWaalsContact O-N 3.14Å
164	L	94.2	Very high	94.3	Very high	45 Å²	45	54.2 Å²	54.2	24%	0.236	26%	0.261	C	S	.	.	H	α-helix	trans	-87.1	-21.4	177.2	-61.5	-177.7	0	0	0	112.2	P132 V137 Q140 V141 W144 Y161 P162	P132-L164 VanDerWaalsContact CD-O 3.27Å; P132-L164 WeakPolarHBondContact CD-O 3.3Å; P132-L164 WeakPolarHBondContact CG-O 3.49Å; V137-L164 HydrophobicContact CG1-CB 4.46Å; V137-L164 HydrophobicContact CG1-CD1 4.46Å; Q140-L164 HydrophobicContact CB-CD1 4.42Å; V141-L164 HydrophobicContact CG2-CD1 3.49Å; V141-L164 VanDerWaalsContact CG2-CD1 3.49Å; W144-L164 HydrophobicContact CH2-CB 4.34Å; W144-L164 HydrophobicContact CZ3-CB 4.3Å; W144-L164 HydrophobicContact CZ3-CD1 4.28Å; Y161-L164 HydrophobicContact CG-CD1 4.39Å; Y161-L164 PolarHBondContact O-N 2.95Å; P162-L164 VanDerWaalsContact C-N 3.3Å; P162-L164 PolarHBondContact O-N 3.11Å
165	C	95.1	Very high	94.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-86.1	-13.8	177.4	-68.1	0	0	0	0	112.9	C129 L130 I158 Y161 P162 A167	C129-C165 CarbonylContact C-O 3.39Å; C129-C165 WeakPolarHBondContact CA-O 3.26Å; C129-C165 HydrophobicContact CB-CB 4.46Å; C129-C165 WeakPolarHBondContact CB-O 3.18Å; L130-C165 CarbonylContact C-O 3.58Å; L130-C165 PolarHBondContact N-O 3.14Å; I158-C165 HydrophobicContact CG1-CB 4.07Å; Y161-C165 PolarHBondContact O-N 3.48Å; P162-C165 PolarHBondContact O-N 2.85Å; C165-A167 PolarHBondContact O-N 2.97Å
166	L	95.1	Very high	94.4	Very high	53 Å²	53	57 Å²	57	28%	0.277	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-56.3	131.1	172.8	-96.1	159	0	0	0	110.7	P162	P162-L166 PolarHBondContact O-N 3.34Å
167	A	95.3	Very high	94.4	Very high	3 Å²	3	57.3 Å²	57.3	3%	0.025	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-64.2	154.4	177.6	0	0	0	0	0	111.1	V128 L130 C165 V171 R172	V128-A167 HydrophobicContact CG1-CB 4.44Å; V128-A167 VanDerWaalsContact O-CB 3.27Å; V128-A167 WeakPolarHBondContact O-CB 3.5Å; V128-A167 PolarHBondContact O-N 3.17Å; V128-A167 VanDerWaalsContact O-N 3.09Å; L130-A167 HydrophobicContact CB-CB 3.78Å; C165-A167 PolarHBondContact O-N 2.97Å; A167-V171 HydrophobicContact CB-CB 4.32Å; A167-V171 HydrophobicContact CB-CG1 4.06Å; A167-R172 HydrophobicContact CB-CG 3.85Å; A167-R172 WeakPolarHBondContact O-CD 3.31Å; A167-R172 PolarHBondContact O-NE 3.25Å
168	P	94.7	Very high	94.2	Very high	54 Å²	54	60.6 Å²	60.6	35%	0.351	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-48.7	149.4	172.8	-26.5	34.9	0	0	0	111.9	P109 D170 V171 R172	P109-P168 HydrophobicContact CG-CG 4.22Å; P168-D170 VanDerWaalsContact C-N 3.26Å; P168-D170 PolarHBondContact O-N 3.47Å; P168-V171 HydrophobicContact CB-CG2 4.22Å; P168-V171 HydrophobicContact CG-CG2 4.31Å; P168-V171 PolarHBondContact O-N 2.67Å; P168-R172 PolarHBondContact O-N 2.9Å
169	I	95.3	Very high	94	Very high	93 Å²	93	61.4 Å²	61.4	48%	0.477	30%	0.302	S	S	.	.	H	α-helix	trans	-59.5	-39.1	-174.1	-166.8	160.9	0	0	0	112.2	V171 R172 Q173	I169-V171 PolarHBondContact O-N 3.28Å; I169-R172 PolarHBondContact O-N 3.12Å; I169-Q173 HydrophobicContact CG1-CG 4.31Å; I169-Q173 WeakPolarHBondContact O-CB 3.34Å; I169-Q173 WeakPolarHBondContact O-CG 3.49Å; I169-Q173 PolarHBondContact O-N 3.02Å
170	D	95.2	Very high	93.9	Very high	94 Å²	94	58 Å²	58	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-64.4	-42.6	-179.8	-48.1	-41	0	0	0	111.1	A107 P168 Q173 A174	A107-D170 HydrophobicContact CB-CB 3.82Å; P168-D170 VanDerWaalsContact C-N 3.26Å; P168-D170 PolarHBondContact O-N 3.47Å; D170-Q173 PolarHBondContact O-N 2.9Å; D170-A174 WeakPolarHBondContact O-CB 3.23Å; D170-A174 PolarHBondContact O-N 3.23Å
171	V	95.4	Very high	93.7	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-45	175.4	174.6	0	0	0	0	111	A104 A107 L108 A167 P168 I169 A174 I175	A104-V171 HydrophobicContact CB-CB 4.33Å; A104-V171 HydrophobicContact CB-CG1 3.79Å; A107-V171 HydrophobicContact CB-CG2 4.06Å; A107-V171 WeakPolarHBondContact O-CG2 3.24Å; L108-V171 HydrophobicContact CD2-CG2 4.34Å; A167-V171 HydrophobicContact CB-CB 4.32Å; A167-V171 HydrophobicContact CB-CG1 4.06Å; P168-V171 HydrophobicContact CB-CG2 4.22Å; P168-V171 HydrophobicContact CG-CG2 4.31Å; P168-V171 PolarHBondContact O-N 2.67Å; I169-V171 PolarHBondContact O-N 3.28Å; V171-A174 PolarHBondContact O-N 3.42Å; V171-I175 HydrophobicContact CG1-CD1 4.16Å; V171-I175 WeakPolarHBondContact O-CG1 3.34Å; V171-I175 PolarHBondContact O-N 3.09Å
172	R	95.3	Very high	93.5	Very high	64 Å²	64	53 Å²	53	24%	0.242	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-42.5	178.8	-68.4	-171.5	-68	140.9	5.3	111.5	A167 P168 I169 A174 I175 D176	A167-R172 HydrophobicContact CB-CG 3.85Å; A167-R172 WeakPolarHBondContact O-CD 3.31Å; A167-R172 PolarHBondContact O-NE 3.25Å; P168-R172 PolarHBondContact O-N 2.9Å; I169-R172 PolarHBondContact O-N 3.12Å; R172-A174 PolarHBondContact O-N 3.13Å; R172-I175 PolarHBondContact O-N 3Å; R172-D176 VanDerWaalsContact O-CB 3.28Å; R172-D176 WeakPolarHBondContact O-CB 3.37Å; R172-D176 PolarHBondContact O-N 3.49Å
173	Q	95.1	Very high	93.2	Very high	115 Å²	115	53.1 Å²	53.1	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-39.7	178.4	-77.1	179.7	-11.2	0	0	112.4	I169 D170 I175 D176 S177	I169-Q173 HydrophobicContact CG1-CG 4.31Å; I169-Q173 WeakPolarHBondContact O-CB 3.34Å; I169-Q173 WeakPolarHBondContact O-CG 3.49Å; I169-Q173 PolarHBondContact O-N 3.02Å; D170-Q173 PolarHBondContact O-N 2.9Å; Q173-I175 VanDerWaalsContact C-N 3.33Å; Q173-I175 PolarHBondContact O-N 3.3Å; Q173-D176 PolarHBondContact O-N 3.32Å; Q173-S177 VanDerWaalsContact O-CB 3.28Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.34Å; Q173-S177 PolarHBondContact O-OG 3.21Å
174	A	94.4	Very high	93	Very high	26 Å²	26	51.3 Å²	51.3	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-39.3	175.5	0	0	0	0	0	112.4	A104 D170 V171 R172 S177 Q178	A104-A174 HydrophobicContact CB-CB 4.03Å; D170-A174 WeakPolarHBondContact O-CB 3.23Å; D170-A174 PolarHBondContact O-N 3.23Å; V171-A174 PolarHBondContact O-N 3.42Å; R172-A174 PolarHBondContact O-N 3.13Å; A174-S177 PolarHBondContact O-OG 3.17Å; A174-Q178 PolarHBondContact O-N 3.46Å
175	I	94.5	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-75.2	-42.2	177.7	-64.9	171.3	0	0	0	111	L100 W103 A104 V128 V171 R172 Q173 S177 Q178 L179	L100-I175 HydrophobicContact CB-CD1 4.42Å; L100-I175 WeakPolarHBondContact O-CD1 3.47Å; W103-I175 HydrophobicContact CB-CG1 4.35Å; W103-I175 HydrophobicContact CE3-CG2 4.03Å; W103-I175 HydrophobicContact CZ3-CG2 4.32Å; A104-I175 HydrophobicContact CB-CD1 4.28Å; A104-I175 HydrophobicContact CB-CG1 4.13Å; V128-I175 HydrophobicContact CB-CD1 4.08Å; V128-I175 HydrophobicContact CG1-CD1 4.06Å; V128-I175 HydrophobicContact CG2-CB 4.46Å; V128-I175 HydrophobicContact CG2-CD1 3.7Å; V128-I175 HydrophobicContact CG2-CG2 3.91Å; V171-I175 HydrophobicContact CG1-CD1 4.16Å; V171-I175 WeakPolarHBondContact O-CG1 3.34Å; V171-I175 PolarHBondContact O-N 3.09Å; R172-I175 PolarHBondContact O-N 3Å; Q173-I175 VanDerWaalsContact C-N 3.33Å; Q173-I175 PolarHBondContact O-N 3.3Å; I175-S177 VanDerWaalsContact C-N 3.29Å; I175-S177 PolarHBondContact O-N 3.47Å; I175-Q178 WeakPolarHBondContact O-CB 3.19Å; I175-Q178 PolarHBondContact O-N 3.11Å; I175-L179 HydrophobicContact CG2-CD1 4.27Å; I175-L179 WeakPolarHBondContact O-CG 3.21Å; I175-L179 PolarHBondContact O-N 3.22Å
176	D	93.7	Very high	92.4	Very high	72 Å²	72	52.6 Å²	52.6	39%	0.385	29%	0.293	S	S	.	.	H	α-helix	trans	-65.5	-32.4	178	-72	-20.7	0	0	0	111.7	R172 Q173 L179 S180	R172-D176 VanDerWaalsContact O-CB 3.28Å; R172-D176 WeakPolarHBondContact O-CB 3.37Å; R172-D176 PolarHBondContact O-N 3.49Å; Q173-D176 PolarHBondContact O-N 3.32Å; D176-L179 CarbonylContact O-C 3.55Å; D176-L179 PolarHBondContact O-N 3.25Å; D176-S180 PolarHBondContact O-N 3.08Å
177	S	92.4	Very high	92.2	Very high	69 Å²	69	57.6 Å²	57.6	48%	0.483	31%	0.309	S	S	.	.	H	α-helix	trans	-68.9	-39.2	175.3	64.8	0	0	0	0	111.5	Q173 A174 I175 L179 S180	Q173-S177 VanDerWaalsContact O-CB 3.28Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.34Å; Q173-S177 PolarHBondContact O-OG 3.21Å; A174-S177 PolarHBondContact O-OG 3.17Å; I175-S177 VanDerWaalsContact C-N 3.29Å; I175-S177 PolarHBondContact O-N 3.47Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 2.97Å; S177-S180 VanDerWaalsContact O-CB 3.24Å; S177-S180 WeakPolarHBondContact O-CB 3.08Å; S177-S180 PolarHBondContact O-N 3.34Å; S177-S180 VanDerWaalsContact O-N 3.14Å; S177-S180 PolarHBondContact O-OG 2.8Å
178	Q	90.6	Very high	91.9	Very high	71 Å²	71	64 Å²	64	33%	0.332	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-42.7	174.7	-166.4	65.5	16.3	0	0	111.7	E72 W103 A174 I175 S180 K185	E72-Q178 PolarHBondContact OE1-NE2 2.93Å; W103-Q178 HydrophobicContact CD2-CB 4.45Å; W103-Q178 HydrophobicContact CD2-CG 4.03Å; W103-Q178 HydrophobicContact CE3-CB 4.07Å; W103-Q178 HydrophobicContact CE3-CG 4.01Å; W103-Q178 HydrophobicContact CG-CG 4.41Å; W103-Q178 HydrophobicContact CZ3-CG 4.37Å; A174-Q178 PolarHBondContact O-N 3.46Å; I175-Q178 WeakPolarHBondContact O-CB 3.19Å; I175-Q178 PolarHBondContact O-N 3.11Å; Q178-S180 VanDerWaalsContact C-N 3.27Å; Q178-S180 PolarHBondContact O-N 3.02Å; Q178-K185 PolarHBondContact O-NZ 3.44Å
179	L	92	Very high	91.7	Very high	16 Å²	16	62.1 Å²	62.1	8%	0.084	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.2	179.5	-59.6	175.3	0	0	0	113.4	E72 V75 F76 M79 W103 I175 D176 S177 G181 Y182	E72-L179 WeakPolarHBondContact O-CD2 3.34Å; V75-L179 HydrophobicContact CB-CD2 4.23Å; V75-L179 HydrophobicContact CG1-CD1 3.84Å; V75-L179 HydrophobicContact CG1-CD2 4.25Å; F76-L179 HydrophobicContact CB-CD2 4.34Å; M79-L179 HydrophobicContact CG-CD1 4.07Å; W103-L179 HydrophobicContact CH2-CD2 4.1Å; W103-L179 HydrophobicContact CZ3-CD1 4.38Å; W103-L179 HydrophobicContact CZ3-CD2 3.85Å; W103-L179 HydrophobicContact CZ3-CG 4.06Å; I175-L179 HydrophobicContact CG2-CD1 4.27Å; I175-L179 WeakPolarHBondContact O-CG 3.21Å; I175-L179 PolarHBondContact O-N 3.22Å; D176-L179 CarbonylContact O-C 3.55Å; D176-L179 PolarHBondContact O-N 3.25Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 2.97Å; L179-G181 PolarHBondContact O-N 3.03Å; L179-Y182 PolarHBondContact O-N 3.27Å
180	S	90.3	Very high	91.6	Very high	74 Å²	74	60.3 Å²	60.3	52%	0.517	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	137.7	-176.5	71.9	0	0	0	0	111.2	D176 S177 Q178	D176-S180 PolarHBondContact O-N 3.08Å; S177-S180 VanDerWaalsContact O-CB 3.24Å; S177-S180 WeakPolarHBondContact O-CB 3.08Å; S177-S180 PolarHBondContact O-N 3.34Å; S177-S180 VanDerWaalsContact O-N 3.14Å; S177-S180 PolarHBondContact O-OG 2.8Å; Q178-S180 VanDerWaalsContact C-N 3.27Å; Q178-S180 PolarHBondContact O-N 3.02Å
181	G	87.7	Confident	91.6	Very high	46 Å²	46	56 Å²	56	47%	0.474	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-11.3	179.4	0	0	0	0	0	115.7	L179 E184 K185	L179-G181 PolarHBondContact O-N 3.03Å; G181-E184 CarbonylContact O-C 3.53Å; G181-E184 PolarHBondContact O-N 3.49Å; G181-K185 WeakPolarHBondContact O-CB 3.32Å; G181-K185 PolarHBondContact O-N 3.24Å
182	Y	90.2	Very high	91.6	Very high	21 Å²	21	56.7 Å²	56.7	8%	0.082	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	142.9	169.2	-75.4	-75.6	0	0	0	111.3	E72 F73 F76 L179 K185 V186	E72-Y182 HydrophobicContact CB-CE2 4.1Å; E72-Y182 WeakPolarHBondContact OE2-CE2 3.39Å; E72-Y182 PolarHBondContact OE2-OH 3.33Å; F73-Y182 HydrophobicContact CB-CE1 4.43Å; F73-Y182 AromaticContact CD2-CD1 3.69Å; F73-Y182 HydrophobicContact CD2-CD1 3.69Å; F73-Y182 AromaticContact CD2-CE1 3.78Å; F73-Y182 HydrophobicContact CD2-CE1 3.78Å; F73-Y182 HydrophobicContact CE2-CD1 4.2Å; F76-Y182 HydrophobicContact CB-CD2 4.44Å; F76-Y182 HydrophobicContact CB-CG 4.32Å; F76-Y182 HydrophobicContact CD2-CG 4.26Å; F76-Y182 WeakPolarHBondContact CE2-O 3.22Å; F76-Y182 HydrophobicContact CG-CG 4.16Å; L179-Y182 PolarHBondContact O-N 3.27Å; Y182-K185 HydrophobicContact CD1-CB 4.24Å; Y182-K185 HydrophobicContact CD2-CD 4.09Å; Y182-K185 HydrophobicContact CE1-CB 4.39Å; Y182-K185 HydrophobicContact CE1-CD 4.4Å; Y182-K185 HydrophobicContact CE2-CD 3.72Å; Y182-K185 HydrophobicContact CG-CB 4.38Å; Y182-V186 HydrophobicContact CD1-CG2 3.74Å; Y182-V186 HydrophobicContact CE1-CG2 3.75Å
183	P	87.4	Confident	91.6	Very high	48 Å²	48	53.7 Å²	53.7	31%	0.312	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86.3	-7.7	4.9	34.6	-35.6	0	0	0	115.2	F76 K185 V186	F76-P183 HydrophobicContact CE1-CB 4.08Å; F76-P183 HydrophobicContact CZ-CB 3.96Å; F76-P183 HydrophobicContact CZ-CG 4.19Å; P183-K185 VanDerWaalsContact C-N 3.29Å; P183-K185 PolarHBondContact O-N 3.36Å; P183-V186 WeakPolarHBondContact O-CB 3.1Å; P183-V186 VanDerWaalsContact O-CG2 3.28Å; P183-V186 WeakPolarHBondContact O-CG2 3.47Å; P183-V186 PolarHBondContact O-N 2.97Å
184	E	88.4	Confident	91.6	Very high	112 Å²	112	48.8 Å²	48.8	52%	0.523	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-64.8	-30.3	-176.1	-68.6	73.3	-161.5	0	0	113.6	G181 V186 R187	G181-E184 CarbonylContact O-C 3.53Å; G181-E184 PolarHBondContact O-N 3.49Å; E184-V186 PolarHBondContact O-N 2.91Å; E184-V186 VanDerWaalsContact O-N 3.14Å; E184-R187 WeakPolarHBondContact O-CB 3.42Å; E184-R187 PolarHBondContact O-N 3.33Å
185	K	88.5	Confident	91.6	Very high	57 Å²	57	47.5 Å²	47.5	25%	0.248	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-52.6	-32.6	175.7	-174.1	-177.6	177.9	-166.9	0	112	E72 Q178 G181 Y182 P183 R187 Q188	E72-K185 IonicContact OE2-NZ 3.73Å; E72-K185 PolarHBondContact OE2-NZ 3.03Å; Q178-K185 PolarHBondContact O-NZ 3.44Å; G181-K185 WeakPolarHBondContact O-CB 3.32Å; G181-K185 PolarHBondContact O-N 3.24Å; Y182-K185 HydrophobicContact CD1-CB 4.24Å; Y182-K185 HydrophobicContact CD2-CD 4.09Å; Y182-K185 HydrophobicContact CE1-CB 4.39Å; Y182-K185 HydrophobicContact CE1-CD 4.4Å; Y182-K185 HydrophobicContact CE2-CD 3.72Å; Y182-K185 HydrophobicContact CG-CB 4.38Å; P183-K185 VanDerWaalsContact C-N 3.29Å; P183-K185 PolarHBondContact O-N 3.36Å; K185-R187 PolarHBondContact O-N 2.84Å; K185-R187 VanDerWaalsContact O-N 3.17Å; K185-Q188 WeakPolarHBondContact O-CB 3.43Å; K185-Q188 PolarHBondContact O-N 3.26Å
186	V	89.6	Confident	91.7	Very high	15 Å²	15	48.7 Å²	48.7	9%	0.091	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-54.8	-36.5	176.4	177.8	0	0	0	0	111.6	Y39 F73 Y182 P183 E184 Q188 D189 W190	Y39-V186 HydrophobicContact CD2-CB 4.28Å; Y39-V186 HydrophobicContact CD2-CG1 3.53Å; Y39-V186 HydrophobicContact CD2-CG2 3.68Å; Y39-V186 HydrophobicContact CE2-CG1 4.15Å; Y39-V186 HydrophobicContact CE2-CG2 4.04Å; Y39-V186 HydrophobicContact CG-CG1 4.47Å; F73-V186 HydrophobicContact CD2-CG2 4.11Å; F73-V186 HydrophobicContact CE2-CG2 3.92Å; Y182-V186 HydrophobicContact CD1-CG2 3.74Å; Y182-V186 HydrophobicContact CE1-CG2 3.75Å; P183-V186 WeakPolarHBondContact O-CB 3.1Å; P183-V186 VanDerWaalsContact O-CG2 3.28Å; P183-V186 WeakPolarHBondContact O-CG2 3.47Å; P183-V186 PolarHBondContact O-N 2.97Å; E184-V186 PolarHBondContact O-N 2.91Å; E184-V186 VanDerWaalsContact O-N 3.14Å; V186-Q188 VanDerWaalsContact C-N 3.26Å; V186-Q188 PolarHBondContact O-N 3.38Å; V186-D189 WeakPolarHBondContact O-CB 3.46Å; V186-D189 PolarHBondContact O-N 3.13Å; V186-D189 VanDerWaalsContact O-N 3.13Å; V186-W190 HydrophobicContact CG1-CZ2 4.45Å; V186-W190 VanDerWaalsContact O-CD1 3.31Å; V186-W190 PolarHBondContact O-NE1 2.97Å
187	R	90	Very high	91.7	Very high	159 Å²	159	45.2 Å²	45.2	60%	0.6	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-67.6	-27.3	-179.4	-60.7	-173.5	-176.9	145.1	3.9	113	E184 K185 D189 W190	E184-R187 WeakPolarHBondContact O-CB 3.42Å; E184-R187 PolarHBondContact O-N 3.33Å; K185-R187 PolarHBondContact O-N 2.84Å; K185-R187 VanDerWaalsContact O-N 3.17Å; R187-D189 PolarHBondContact O-N 3.11Å; R187-W190 HydrophobicContact CB-CD2 4.42Å; R187-W190 HydrophobicContact CB-CE3 4.29Å; R187-W190 HydrophobicContact CB-CZ3 4.43Å; R187-W190 HydrophobicContact CG-CD2 4.45Å; R187-W190 HydrophobicContact CG-CE3 4.2Å; R187-W190 HydrophobicContact CG-CH2 3.75Å; R187-W190 HydrophobicContact CG-CZ2 4.01Å; R187-W190 HydrophobicContact CG-CZ3 3.86Å; R187-W190 PolarHBondContact O-N 3.44Å
188	Q	89.6	Confident	91.8	Very high	138 Å²	138	42.3 Å²	42.3	65%	0.645	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-71.6	-18.2	177.4	-57.7	174.4	-3.2	0	0	111.9	K185 V186 K249	K185-Q188 WeakPolarHBondContact O-CB 3.43Å; K185-Q188 PolarHBondContact O-N 3.26Å; V186-Q188 VanDerWaalsContact C-N 3.26Å; V186-Q188 PolarHBondContact O-N 3.38Å; Q188-K249 WeakPolarHBondContact O-CE 3.33Å; Q188-K249 PolarHBondContact O-NZ 3.49Å
189	D	90.4	Very high	91.8	Very high	13 Å²	13	40.5 Å²	40.5	7%	0.07	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-92.7	-6.5	175.9	-162.5	58.4	0	0	0	113.1	K69 V186 R187 T248 K249	K69-D189 IonicContact NZ-OD1 2.68Å; K69-D189 PolarHBondContact NZ-OD1 3Å; V186-D189 WeakPolarHBondContact O-CB 3.46Å; V186-D189 PolarHBondContact O-N 3.13Å; V186-D189 VanDerWaalsContact O-N 3.13Å; R187-D189 PolarHBondContact O-N 3.11Å; D189-T248 CarbonylContact O-C 3.58Å; D189-T248 WeakPolarHBondContact O-CA 3.31Å; D189-T248 VanDerWaalsContact OD2-CB 3.23Å; D189-T248 WeakPolarHBondContact OD2-CB 3.35Å; D189-K249 WeakPolarHBondContact O-CG 3.19Å; D189-K249 PolarHBondContact O-N 3.34Å
190	W	93.4	Very high	91.7	Very high	56 Å²	56	43.3 Å²	43.3	21%	0.212	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.2	174.9	-65.2	-9.6	0	0	0	110.6	N38 V186 R187 R246 F247	N38-W190 HydrophobicContact CB-CH2 3.94Å; N38-W190 HydrophobicContact CB-CZ2 3.63Å; N38-W190 VanDerWaalsContact O-CZ2 3.31Å; N38-W190 WeakPolarHBondContact O-CZ2 3.47Å; N38-W190 PolarHBondContact O-NE1 3.17Å; V186-W190 HydrophobicContact CG1-CZ2 4.45Å; V186-W190 VanDerWaalsContact O-CD1 3.31Å; V186-W190 PolarHBondContact O-NE1 2.97Å; R187-W190 HydrophobicContact CB-CD2 4.42Å; R187-W190 HydrophobicContact CB-CE3 4.29Å; R187-W190 HydrophobicContact CB-CZ3 4.43Å; R187-W190 HydrophobicContact CG-CD2 4.45Å; R187-W190 HydrophobicContact CG-CE3 4.2Å; R187-W190 HydrophobicContact CG-CH2 3.75Å; R187-W190 HydrophobicContact CG-CZ2 4.01Å; R187-W190 HydrophobicContact CG-CZ3 3.86Å; R187-W190 PolarHBondContact O-N 3.44Å; W190-R246 HydrophobicContact CB-CG 4.37Å; W190-R246 HydrophobicContact CG-CG 4.31Å; W190-F247 WeakPolarHBondContact CA-O 3.38Å
191	H	94.6	Very high	91.8	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.8	170.3	-171.5	81.8	0	0	0	108.8	V193 F247 K249 Y252 D395 N396 D397 W399	H191-V193 WeakPolarHBondContact NE2-CG1 3.49Å; H191-F247 PolarHBondContact N-O 3.14Å; H191-F247 PolarHBondContact O-N 2.71Å; H191-K249 HydrophobicContact CB-CG 4.09Å; H191-Y252 AromaticContact CD2-CD1 3.29Å; H191-Y252 WeakPolarHBondContact CD2-CD1 3.48Å; H191-Y252 AromaticContact CD2-CD2 3.51Å; H191-Y252 AromaticContact CD2-CE1 3.66Å; H191-Y252 AromaticContact CD2-CE2 3.89Å; H191-Y252 AromaticContact CD2-CG 3.19Å; H191-Y252 AromaticContact CD2-CZ 3.95Å; H191-Y252 AromaticContact CE1-CE1 3.94Å; H191-Y252 AromaticContact CG-CD1 3.98Å; H191-Y252 AromaticContact NE2-CD1 3.41Å; H191-Y252 WeakPolarHBondContact NE2-CD1 3.39Å; H191-Y252 AromaticContact NE2-CD2 3.9Å; H191-Y252 AromaticContact NE2-CE1 3.23Å; H191-Y252 WeakPolarHBondContact NE2-CE1 3.47Å; H191-Y252 AromaticContact NE2-CE2 3.77Å; H191-Y252 AromaticContact NE2-CG 3.73Å; H191-Y252 AromaticContact NE2-CZ 3.44Å; H191-D395 WeakPolarHBondContact CA-OD2 3.47Å; H191-D395 PolarHBondContact CE1-O 2.88Å; H191-N396 PolarHBondContact CE1-O 3.27Å; H191-D397 IonicContact CE1-OD1 3.96Å; H191-D397 PolarHBondContact CE1-OD1 2.92Å; H191-D397 VanDerWaalsContact CE1-OD1 3.23Å; H191-D397 IonicContact NE2-OD1 3.42Å; H191-D397 PolarHBondContact NE2-OD1 3.15Å; H191-W399 AromaticContact CE1-NE1 3.78Å; H191-W399 AromaticContact ND1-NE1 3.47Å; H191-W399 PolarHBondContact ND1-NE1 2.86Å
192	S	95.1	Very high	92.1	Very high	17 Å²	17	38 Å²	38	12%	0.119	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.3	-172.5	-53.8	0	0	0	0	110.6	V245 D395	S192-V245 VanDerWaalsContact CA-O 3.31Å; S192-V245 WeakPolarHBondContact CA-O 3.32Å; S192-D395 PolarHBondContact N-OD2 2.95Å; S192-D395 PolarHBondContact O-N 3.47Å
193	V	95	Very high	92.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.4	-178.8	-65.6	0	0	0	0	110.8	H191 K244 V245 F247 Y252 K279 I283	H191-V193 WeakPolarHBondContact NE2-CG1 3.49Å; V193-K244 WeakPolarHBondContact O-CA 3.42Å; V193-V245 PolarHBondContact N-O 3.35Å; V193-V245 PolarHBondContact O-N 2.91Å; V193-F247 HydrophobicContact CG2-CD2 4.12Å; V193-F247 HydrophobicContact CG2-CE2 3.62Å; V193-Y252 HydrophobicContact CB-CE2 4.43Å; V193-Y252 HydrophobicContact CG1-CD2 4.35Å; V193-Y252 HydrophobicContact CG1-CE2 3.79Å; V193-Y252 HydrophobicContact CG2-CD2 4.16Å; V193-Y252 HydrophobicContact CG2-CE2 3.92Å; V193-K279 VanDerWaalsContact CG1-CE 3.45Å; V193-I283 HydrophobicContact CG2-CG2 4.29Å
194	Y	95.2	Very high	92.3	Very high	12 Å²	12	36.5 Å²	36.5	5%	0.047	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.8	169.2	-72.1	-78.1	0	0	0	110.2	R242 R243 K244 A280 D390 G392 E394	Y194-R242 HydrophobicContact CD1-CG 3.82Å; Y194-R242 HydrophobicContact CG-CG 4.31Å; Y194-R242 VanDerWaalsContact CG-CZ 3.4Å; Y194-R242 VanDerWaalsContact CG-NH2 3.33Å; Y194-R243 WeakPolarHBondContact CA-O 3.45Å; Y194-K244 HydrophobicContact CD1-CB 4.08Å; Y194-K244 HydrophobicContact CE1-CB 3.84Å; Y194-A280 WeakPolarHBondContact O-CA 3.45Å; Y194-A280 WeakPolarHBondContact O-CB 3.39Å; Y194-D390 PolarHBondContact OH-O 2.87Å; Y194-G392 WeakPolarHBondContact CE2-O 3.48Å; Y194-G392 PolarHBondContact OH-O 3.03Å; Y194-E394 HydrophobicContact CD2-CB 3.98Å; Y194-E394 HydrophobicContact CE2-CB 4.25Å
195	C	95.4	Very high	92.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.3	175.2	-63.8	0	0	0	0	109.7	L197 R243 V245 A280	C195-L197 HydrophobicContact CB-CD1 3.98Å; C195-L197 HydrophobicContact CB-CD2 4.19Å; C195-L197 HydrophobicContact CB-CG 3.76Å; C195-R243 PolarHBondContact N-O 2.77Å; C195-R243 PolarHBondContact O-N 2.92Å; C195-V245 HydrophobicContact CB-CG2 4.01Å; C195-A280 WeakPolarHBondContact CA-O 3.43Å
196	M	95	Very high	92.5	Very high	24 Å²	24	34.1 Å²	34.1	12%	0.118	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	106.3	168	-64.8	-58.2	-64.9	0	0	108.8	L240 R242 A280 Y281 G284	M196-L240 HydrophobicContact CB-CB 4.34Å; M196-L240 HydrophobicContact CB-CD1 4.34Å; M196-L240 HydrophobicContact CE-CB 3.95Å; M196-R242 HydrophobicContact SD-CB 3.67Å; M196-R242 HydrophobicContact SD-CG 4.04Å; M196-A280 HydrophobicContact CG-CB 4.12Å; M196-A280 PolarHBondContact N-O 2.91Å; M196-Y281 HydrophobicContact CB-CD1 4.05Å; M196-Y281 HydrophobicContact CB-CD2 4.44Å; M196-Y281 HydrophobicContact CB-CE1 4.17Å; M196-Y281 HydrophobicContact CB-CG 4.19Å; M196-Y281 HydrophobicContact CE-CE2 4.36Å; M196-Y281 HydrophobicContact CG-CD1 4.14Å; M196-Y281 HydrophobicContact CG-CD2 3.68Å; M196-Y281 HydrophobicContact CG-CE1 4.14Å; M196-Y281 HydrophobicContact CG-CE2 3.66Å; M196-Y281 HydrophobicContact CG-CG 3.92Å; M196-Y281 HydrophobicContact SD-CE2 4.45Å; M196-G284 WeakPolarHBondContact O-CA 3.47Å
197	L	95.3	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.3	-171.7	-65	176.3	0	0	0	111.7	C195 A202 L205 L240 V241 V245 G284 V287	C195-L197 HydrophobicContact CB-CD1 3.98Å; C195-L197 HydrophobicContact CB-CD2 4.19Å; C195-L197 HydrophobicContact CB-CG 3.76Å; L197-A202 HydrophobicContact CB-CB 4.44Å; L197-L205 HydrophobicContact CD1-CD1 3.66Å; L197-L240 CarbonylContact O-C 3.59Å; L197-L240 WeakPolarHBondContact O-CA 3.44Å; L197-V241 PolarHBondContact N-O 2.98Å; L197-V241 WeakPolarHBondContact O-CG2 3.32Å; L197-V241 PolarHBondContact O-N 2.71Å; L197-V245 HydrophobicContact CD1-CG2 3.79Å; L197-G284 VanDerWaalsContact CD2-O 3.31Å; L197-G284 WeakPolarHBondContact CD2-O 2.96Å; L197-V287 HydrophobicContact CD2-CB 4.06Å; L197-V287 HydrophobicContact CD2-CG1 3.9Å
198	P	93.6	Very high	92.3	Very high	8 Å²	8	31.2 Å²	31.2	5%	0.052	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	141.5	166.4	-26.2	36.6	0	0	0	111.1	K200 L201 A202 F235 L240 T288	P198-K200 PolarHBondContact O-N 3.04Å; P198-K200 VanDerWaalsContact O-N 3.09Å; P198-L201 HydrophobicContact CG-CD1 4.47Å; P198-L201 PolarHBondContact O-N 3.3Å; P198-A202 PolarHBondContact O-N 2.81Å; P198-F235 HydrophobicContact CG-CB 4.12Å; P198-L240 HydrophobicContact CG-CD2 3.87Å; P198-T288 WeakPolarHBondContact CD-OG1 3.45Å; P198-T288 HydrophobicContact CG-CG2 3.93Å
199	V	90.8	Very high	92.4	Very high	32 Å²	32	27.9 Å²	27.9	19%	0.194	14%	0.136	C	C	.	.	H	α-helix	trans	-47.3	-44.8	-176	176.9	0	0	0	0	112.8	L201 A202 S203 N239 V241 A384	V199-L201 VanDerWaalsContact C-N 3.34Å; V199-L201 PolarHBondContact O-N 2.92Å; V199-A202 PolarHBondContact O-N 3.24Å; V199-S203 PolarHBondContact O-N 2.77Å; V199-S203 PolarHBondContact O-OG 3Å; V199-N239 HydrophobicContact CG2-CB 4.45Å; V199-N239 WeakPolarHBondContact CG2-O 3.44Å; V199-V241 HydrophobicContact CG2-CG1 3.87Å; V199-V241 HydrophobicContact CG2-CG2 4.47Å; V199-A384 HydrophobicContact CG1-CB 4.01Å
200	K	89.5	Confident	92.5	Very high	75 Å²	75	28.8 Å²	28.8	33%	0.326	14%	0.14	S	C	.	.	H	α-helix	trans	-58.4	-43.1	179.9	-66.4	-176	177.5	-177.6	0	112.8	P198 S203 L204 F235 E374	P198-K200 PolarHBondContact O-N 3.04Å; P198-K200 VanDerWaalsContact O-N 3.09Å; K200-S203 PolarHBondContact O-N 2.99Å; K200-L204 WeakPolarHBondContact O-CB 3.48Å; K200-L204 PolarHBondContact O-N 3.4Å; K200-F235 HydrophobicContact CB-CE1 4.35Å; K200-F235 HydrophobicContact CD-CE1 4.46Å; K200-E374 IonicContact NZ-OE1 3.2Å; K200-E374 PolarHBondContact NZ-OE1 2.88Å
201	L	93.4	Very high	92.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-73.8	-36.3	179.2	-63.5	-174.9	0	0	0	111.4	P198 V199 S203 L204 L205 F235 T288 F291 L370	P198-L201 HydrophobicContact CG-CD1 4.47Å; P198-L201 PolarHBondContact O-N 3.3Å; V199-L201 VanDerWaalsContact C-N 3.34Å; V199-L201 PolarHBondContact O-N 2.92Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.04Å; L201-L204 HydrophobicContact CD2-CD2 4.45Å; L201-L204 PolarHBondContact O-N 3.29Å; L201-L205 WeakPolarHBondContact O-CB 3.28Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.09Å; L201-F235 HydrophobicContact CD1-CB 4.23Å; L201-F235 HydrophobicContact CD1-CD1 4.34Å; L201-F235 HydrophobicContact CD1-CD2 4.13Å; L201-F235 HydrophobicContact CD1-CG 3.98Å; L201-F235 HydrophobicContact CD2-CD1 4.06Å; L201-F235 HydrophobicContact CD2-CD2 4.22Å; L201-F235 HydrophobicContact CD2-CE1 3.76Å; L201-F235 HydrophobicContact CD2-CE2 3.95Å; L201-F235 HydrophobicContact CD2-CG 4.29Å; L201-F235 HydrophobicContact CD2-CZ 3.7Å; L201-F235 HydrophobicContact CG-CD1 3.97Å; L201-F235 HydrophobicContact CG-CD2 4.44Å; L201-F235 HydrophobicContact CG-CE1 4.17Å; L201-F235 HydrophobicContact CG-CG 4.12Å; L201-F235 HydrophobicContact CG-CZ 4.49Å; L201-T288 HydrophobicContact CD1-CG2 3.82Å; L201-F291 HydrophobicContact CD1-CB 3.92Å; L201-F291 HydrophobicContact CD1-CD2 3.86Å; L201-F291 HydrophobicContact CD1-CG 4.12Å; L201-F291 HydrophobicContact CD2-CB 3.91Å; L201-F291 HydrophobicContact CD2-CD1 4.14Å; L201-F291 HydrophobicContact CD2-CD2 3.95Å; L201-F291 HydrophobicContact CD2-CG 3.73Å; L201-F291 HydrophobicContact CG-CD2 4.41Å; L201-L370 HydrophobicContact CD2-CD2 4.31Å
202	A	92.7	Very high	92.5	Very high	8 Å²	8	26.1 Å²	26.1	7%	0.066	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-41.9	172.7	0	0	0	0	0	111.7	L197 P198 V199 K206 V241 R243	L197-A202 HydrophobicContact CB-CB 4.44Å; P198-A202 PolarHBondContact O-N 2.81Å; V199-A202 PolarHBondContact O-N 3.24Å; A202-K206 WeakPolarHBondContact O-CB 3.31Å; A202-K206 PolarHBondContact O-N 3.39Å; A202-V241 HydrophobicContact CB-CG2 3.45Å; A202-V241 VanDerWaalsContact CB-CG2 3.45Å; A202-R243 HydrophobicContact CB-CB 4.2Å; A202-R243 HydrophobicContact CB-CG 4.27Å
203	S	90.2	Very high	92.5	Very high	39 Å²	39	25.3 Å²	25.3	27%	0.273	13%	0.125	S	C	.	.	H	α-helix	trans	-64.7	-42.8	173.6	-67.2	0	0	0	0	112.2	V199 K200 L201 K206 L207	V199-S203 PolarHBondContact O-N 2.77Å; V199-S203 PolarHBondContact O-OG 3Å; K200-S203 PolarHBondContact O-N 2.99Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.04Å; S203-K206 PolarHBondContact O-N 3.26Å; S203-L207 PolarHBondContact O-N 2.9Å; S203-L207 VanDerWaalsContact O-N 3.16Å
204	L	92	Very high	92.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.7	-51.6	176.8	178.9	70	0	0	0	111.4	K200 L201 K206 L207 R208 A211 F291 V366 L369 L370 L373	K200-L204 WeakPolarHBondContact O-CB 3.48Å; K200-L204 PolarHBondContact O-N 3.4Å; L201-L204 HydrophobicContact CD2-CD2 4.45Å; L201-L204 PolarHBondContact O-N 3.29Å; L204-K206 VanDerWaalsContact C-N 3.29Å; L204-K206 PolarHBondContact O-N 3.48Å; L204-L207 PolarHBondContact O-N 3.39Å; L204-R208 PolarHBondContact O-N 3.21Å; L204-A211 HydrophobicContact CD2-CB 4.33Å; L204-A211 HydrophobicContact CG-CB 4.48Å; L204-F291 HydrophobicContact CD2-CD1 4.27Å; L204-F291 HydrophobicContact CD2-CE1 3.65Å; L204-F291 HydrophobicContact CD2-CZ 4.09Å; L204-V366 HydrophobicContact CD2-CG1 4.03Å; L204-L369 HydrophobicContact CD1-CB 3.94Å; L204-L369 HydrophobicContact CD1-CD1 4.39Å; L204-L370 HydrophobicContact CB-CD2 4.37Å; L204-L370 HydrophobicContact CD2-CD2 3.99Å; L204-L370 HydrophobicContact CD2-CG 4.15Å; L204-L373 HydrophobicContact CB-CD1 4.08Å; L204-L373 HydrophobicContact CD1-CD1 3.95Å
205	L	92.7	Very high	92.4	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-67.7	-28.7	-178.7	-71.1	173.6	0	0	0	112.6	L197 L201 L207 E209 I212 V245 V287 F291	L197-L205 HydrophobicContact CD1-CD1 3.66Å; L201-L205 WeakPolarHBondContact O-CB 3.28Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.09Å; L205-L207 VanDerWaalsContact C-N 3.29Å; L205-E209 WeakPolarHBondContact O-CG 3.32Å; L205-I212 HydrophobicContact CD1-CD1 4.15Å; L205-I212 HydrophobicContact CD2-CB 3.94Å; L205-I212 HydrophobicContact CD2-CD1 4.07Å; L205-V245 HydrophobicContact CD1-CG1 3.99Å; L205-V245 HydrophobicContact CD1-CG2 3.96Å; L205-V287 HydrophobicContact CD1-CG1 4.37Å; L205-F291 HydrophobicContact CD1-CE2 4.22Å; L205-F291 HydrophobicContact CD2-CE2 4.19Å; L205-F291 HydrophobicContact CD2-CZ 3.89Å; L205-F291 HydrophobicContact CG-CE2 4.31Å; L205-F291 HydrophobicContact CG-CZ 4.31Å
206	K	89	Confident	92.4	Very high	113 Å²	113	25.1 Å²	25.1	49%	0.491	13%	0.125	S	C	.	.	H	α-helix	trans	-64.7	-34.3	170.4	-176.2	170.7	-160.8	155.1	0	112.3	A202 S203 L204 R243 D388	A202-K206 WeakPolarHBondContact O-CB 3.31Å; A202-K206 PolarHBondContact O-N 3.39Å; S203-K206 PolarHBondContact O-N 3.26Å; L204-K206 VanDerWaalsContact C-N 3.29Å; L204-K206 PolarHBondContact O-N 3.48Å; K206-R243 VanDerWaalsContact CD-NH1 3.34Å; K206-D388 IonicContact NZ-OD1 2.71Å; K206-D388 PolarHBondContact NZ-OD1 3.42Å
207	L	87	Confident	92.3	Very high	73 Å²	73	25.6 Å²	25.6	38%	0.382	13%	0.125	S	C	.	.	H	α-helix	trans	-83.9	-40	179.5	-177.9	63.8	0	0	0	112	S203 L204 L205 R341 L373	S203-L207 PolarHBondContact O-N 2.9Å; S203-L207 VanDerWaalsContact O-N 3.16Å; L204-L207 PolarHBondContact O-N 3.39Å; L205-L207 VanDerWaalsContact C-N 3.29Å; L207-R341 HydrophobicContact CD1-CG 3.43Å; L207-R341 VanDerWaalsContact CD1-CG 3.43Å; L207-L373 HydrophobicContact CD2-CD2 4.03Å
208	R	88	Confident	92	Very high	40 Å²	40	25.9 Å²	25.9	15%	0.151	13%	0.127	C	C	.	.			trans	-144.1	93.8	-172.3	-168.1	176.7	-169.8	-177.5	14.8	111.3	L204 Q210 A211 E348 N352 L369	L204-R208 PolarHBondContact O-N 3.21Å; R208-Q210 VanDerWaalsContact C-N 3.29Å; R208-Q210 HydrophobicContact CG-CB 4.27Å; R208-Q210 PolarHBondContact O-N 2.98Å; R208-A211 WeakPolarHBondContact O-CB 3.27Å; R208-A211 PolarHBondContact O-N 2.81Å; R208-E348 IonicContact CZ-OE1 2.6Å; R208-E348 IonicContact CZ-OE2 2.73Å; R208-E348 IonicContact NE-OE2 2.92Å; R208-E348 IonicContact NH1-OE1 2.7Å; R208-E348 PolarHBondContact NH1-OE1 3.34Å; R208-E348 IonicContact NH1-OE2 2.72Å; R208-E348 PolarHBondContact NH1-OE2 3.11Å; R208-E348 IonicContact NH2-OE1 2.71Å; R208-E348 IonicContact NH2-OE2 2.7Å; R208-N352 PolarHBondContact NH2-ND2 2.96Å; R208-L369 VanDerWaalsContact CD-CD1 3.45Å
209	E	91.7	Very high	91.9	Very high	67 Å²	67	25.5 Å²	25.5	31%	0.313	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-65.7	-32.7	178.8	-63	-177.7	-169.2	0	0	112.7	I40 L205 A211 I212 R246	I40-E209 HydrophobicContact CD1-CB 4.45Å; L205-E209 WeakPolarHBondContact O-CG 3.32Å; E209-A211 PolarHBondContact O-N 3Å; E209-I212 WeakPolarHBondContact O-CB 3.31Å; E209-I212 WeakPolarHBondContact O-CG2 3.3Å; E209-I212 PolarHBondContact O-N 3.33Å; E209-R246 IonicContact OE1-NH2 3.14Å; E209-R246 IonicContact OE2-CZ 3.59Å; E209-R246 IonicContact OE2-NE 3.7Å; E209-R246 PolarHBondContact OE2-NE 3.19Å; E209-R246 IonicContact OE2-NH2 2.98Å; E209-R246 PolarHBondContact OE2-NH2 3.49Å
210	Q	92.2	Very high	91.7	Very high	32 Å²	32	26.1 Å²	26.1	15%	0.15	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-53.5	-23.5	175.3	-175.6	58.6	47.8	0	0	113.5	W41 R208 I212 A213 P214	W41-Q210 PolarHBondContact O-NE2 2.98Å; R208-Q210 VanDerWaalsContact C-N 3.29Å; R208-Q210 HydrophobicContact CG-CB 4.27Å; R208-Q210 PolarHBondContact O-N 2.98Å; Q210-I212 PolarHBondContact O-N 3.2Å; Q210-A213 PolarHBondContact O-N 2.72Å; Q210-P214 VanDerWaalsContact O-CD 3.23Å; Q210-P214 WeakPolarHBondContact O-CD 3.22Å
211	A	93.6	Very high	91.3	Very high	3 Å²	3	27.4 Å²	27.4	3%	0.025	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-67.4	-14.4	177.5	0	0	0	0	0	113.4	L204 R208 E209 P214 F291 V366	L204-A211 HydrophobicContact CD2-CB 4.33Å; L204-A211 HydrophobicContact CG-CB 4.48Å; R208-A211 WeakPolarHBondContact O-CB 3.27Å; R208-A211 PolarHBondContact O-N 2.81Å; E209-A211 PolarHBondContact O-N 3Å; A211-P214 WeakPolarHBondContact O-CD 3.45Å; A211-P214 WeakPolarHBondContact O-CG 3.3Å; A211-F291 HydrophobicContact CB-CE1 4.22Å; A211-F291 HydrophobicContact CB-CZ 4.22Å; A211-F291 WeakPolarHBondContact O-CZ 3.16Å; A211-V366 HydrophobicContact CB-CG2 4.24Å
212	I	95.9	Very high	90.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-39.5	177.1	-162.2	57.6	0	0	0	112	I40 L205 E209 Q210 A215 V216 V245 F247 L251 V287 F291	I40-I212 HydrophobicContact CG2-CG2 4.05Å; L205-I212 HydrophobicContact CD1-CD1 4.15Å; L205-I212 HydrophobicContact CD2-CB 3.94Å; L205-I212 HydrophobicContact CD2-CD1 4.07Å; E209-I212 WeakPolarHBondContact O-CB 3.31Å; E209-I212 WeakPolarHBondContact O-CG2 3.3Å; E209-I212 PolarHBondContact O-N 3.33Å; Q210-I212 PolarHBondContact O-N 3.2Å; I212-A215 PolarHBondContact O-N 2.83Å; I212-V216 HydrophobicContact CG1-CG2 4.32Å; I212-V216 WeakPolarHBondContact O-CG2 3.42Å; I212-V216 PolarHBondContact O-N 3Å; I212-V245 HydrophobicContact CD1-CG1 4Å; I212-V245 HydrophobicContact CG1-CG1 4.18Å; I212-F247 HydrophobicContact CD1-CD1 4.28Å; I212-F247 HydrophobicContact CD1-CE1 3.52Å; I212-F247 HydrophobicContact CD1-CZ 3.95Å; I212-F247 HydrophobicContact CG1-CD1 3.53Å; I212-F247 HydrophobicContact CG1-CE1 3.3Å; I212-F247 HydrophobicContact CG1-CG 4.43Å; I212-F247 HydrophobicContact CG1-CZ 4.04Å; I212-L251 HydrophobicContact CG2-CD1 4.37Å; I212-V287 HydrophobicContact CD1-CB 4.48Å; I212-V287 HydrophobicContact CD1-CG1 3.68Å; I212-V287 HydrophobicContact CD1-CG2 3.93Å; I212-F291 HydrophobicContact CD1-CE2 4.49Å
213	A	95.3	Very high	89.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.1	-54.1	-176.5	0	0	0	0	0	112.6	I40 W41 Q210 A215 V216 R217 L251	I40-A213 HydrophobicContact CG2-CB 4.36Å; W41-A213 WeakPolarHBondContact O-CB 3.46Å; Q210-A213 PolarHBondContact O-N 2.72Å; A213-A215 VanDerWaalsContact C-N 3.27Å; A213-A215 PolarHBondContact O-N 3.36Å; A213-V216 PolarHBondContact O-N 3.14Å; A213-V216 VanDerWaalsContact O-N 3.15Å; A213-R217 VanDerWaalsContact C-NH1 3.31Å; A213-R217 WeakPolarHBondContact O-CG 3.41Å; A213-R217 PolarHBondContact O-N 3.04Å; A213-L251 HydrophobicContact CB-CD1 3.74Å; A213-L251 HydrophobicContact CB-CD2 4.36Å
214	P	93	Very high	88.6	Confident	7 Å²	7	41 Å²	41	5%	0.045	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-30.1	178	23.6	-33.2	0	0	0	113.3	Q210 A211 R217 A218 L294 D362 V366	Q210-P214 VanDerWaalsContact O-CD 3.23Å; Q210-P214 WeakPolarHBondContact O-CD 3.22Å; A211-P214 WeakPolarHBondContact O-CD 3.45Å; A211-P214 WeakPolarHBondContact O-CG 3.3Å; P214-R217 VanDerWaalsContact CA-NH1 3.28Å; P214-R217 VanDerWaalsContact N-NH1 3.15Å; P214-A218 VanDerWaalsContact O-CB 3.29Å; P214-A218 WeakPolarHBondContact O-CB 3.36Å; P214-A218 PolarHBondContact O-N 2.96Å; P214-L294 HydrophobicContact CB-CD1 4.16Å; P214-L294 HydrophobicContact CB-CD2 3.95Å; P214-L294 HydrophobicContact CG-CD2 4.22Å; P214-D362 HydrophobicContact CB-CB 3.65Å; P214-D362 WeakPolarHBondContact CB-OD2 3.48Å; P214-D362 HydrophobicContact CG-CB 4.15Å; P214-V366 HydrophobicContact CG-CG2 4.49Å
215	A	94.8	Very high	87.4	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.9	-43.6	174.1	0	0	0	0	0	111.6	I212 A213 A218 F219 G290 F291	I212-A215 PolarHBondContact O-N 2.83Å; A213-A215 VanDerWaalsContact C-N 3.27Å; A213-A215 PolarHBondContact O-N 3.36Å; A215-A218 PolarHBondContact O-N 3.21Å; A215-F219 PolarHBondContact O-N 3.03Å; A215-G290 WeakPolarHBondContact O-CA 3.47Å; A215-F291 HydrophobicContact CB-CD1 3.85Å; A215-F291 HydrophobicContact CB-CD2 3.7Å; A215-F291 HydrophobicContact CB-CE1 3.77Å; A215-F291 HydrophobicContact CB-CE2 3.62Å; A215-F291 HydrophobicContact CB-CG 3.81Å; A215-F291 HydrophobicContact CB-CZ 3.66Å
216	V	95.6	Very high	86.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-44.4	175.4	173.3	0	0	0	0	111	I212 A213 A218 F219 C220 F247 L251 M254 L255	I212-V216 HydrophobicContact CG1-CG2 4.32Å; I212-V216 WeakPolarHBondContact O-CG2 3.42Å; I212-V216 PolarHBondContact O-N 3Å; A213-V216 PolarHBondContact O-N 3.14Å; A213-V216 VanDerWaalsContact O-N 3.15Å; V216-A218 PolarHBondContact O-N 3.29Å; V216-F219 WeakPolarHBondContact O-CB 3.42Å; V216-F219 PolarHBondContact O-N 2.88Å; V216-F219 VanDerWaalsContact O-N 3.15Å; V216-C220 PolarHBondContact O-N 3.38Å; V216-C220 PolarHBondContact O-SG 2.77Å; V216-F247 HydrophobicContact CG2-CD1 4.44Å; V216-F247 HydrophobicContact CG2-CE1 4.25Å; V216-L251 HydrophobicContact CB-CD2 3.92Å; V216-L251 HydrophobicContact CG1-CB 4.39Å; V216-L251 HydrophobicContact CG1-CD2 3.77Å; V216-L251 HydrophobicContact CG2-CD2 4.5Å; V216-M254 HydrophobicContact CG1-CB 4.17Å; V216-M254 HydrophobicContact CG1-SD 4.42Å; V216-L255 HydrophobicContact CB-CD2 4.44Å; V216-L255 HydrophobicContact CG1-CD2 3.99Å; V216-L255 HydrophobicContact CG1-CG 4.08Å; V216-L255 HydrophobicContact CG2-CD1 3.85Å; V216-L255 HydrophobicContact CG2-CD2 4.14Å; V216-L255 HydrophobicContact CG2-CG 3.96Å
217	R	91.4	Very high	85.7	Confident	34 Å²	34	44.4 Å²	44.4	13%	0.128	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-46.5	176	-64.4	-162.6	-48.6	-74.1	4.7	111.3	Y42 D43 A213 P214 F219 C220 C221 D362	Y42-R217 HydrophobicContact CD2-CG 4.5Å; Y42-R217 HydrophobicContact CE2-CG 3.84Å; Y42-R217 WeakPolarHBondContact O-CD 3.41Å; Y42-R217 PolarHBondContact O-NH1 3.1Å; D43-R217 IonicContact OD1-CZ 3.82Å; D43-R217 IonicContact OD1-NE 3.42Å; D43-R217 PolarHBondContact OD1-NE 2.82Å; D43-R217 VanDerWaalsContact OD1-NE 3.14Å; D43-R217 IonicContact OD1-NH1 2.69Å; D43-R217 IonicContact OD1-NH2 3.87Å; D43-R217 PolarHBondContact OD1-NH2 3.07Å; A213-R217 VanDerWaalsContact C-NH1 3.31Å; A213-R217 WeakPolarHBondContact O-CG 3.41Å; A213-R217 PolarHBondContact O-N 3.04Å; P214-R217 VanDerWaalsContact CA-NH1 3.28Å; P214-R217 VanDerWaalsContact N-NH1 3.15Å; R217-F219 VanDerWaalsContact C-N 3.27Å; R217-F219 PolarHBondContact O-N 2.99Å; R217-C220 PolarHBondContact O-N 3.29Å; R217-C220 VanDerWaalsContact O-N 3.11Å; R217-C221 WeakPolarHBondContact O-CB 3.44Å; R217-C221 PolarHBondContact O-N 3.41Å; R217-C221 PolarHBondContact O-SG 3.17Å; R217-D362 IonicContact CZ-OD2 3.9Å; R217-D362 IonicContact NH1-OD2 3.61Å; R217-D362 IonicContact NH2-OD2 3.95Å; R217-D362 PolarHBondContact NH2-OD2 3.42Å
218	A	89.5	Confident	85	Confident	6 Å²	6	46.1 Å²	46.1	5%	0.05	23%	0.228	C	C	.	.	H	α-helix	trans	-60.4	-36.2	176	0	0	0	0	0	112.7	P214 A215 V216 R222 L293 L294	P214-A218 VanDerWaalsContact O-CB 3.29Å; P214-A218 WeakPolarHBondContact O-CB 3.36Å; P214-A218 PolarHBondContact O-N 2.96Å; A215-A218 PolarHBondContact O-N 3.21Å; V216-A218 PolarHBondContact O-N 3.29Å; A218-R222 PolarHBondContact O-N 2.94Å; A218-L293 HydrophobicContact CB-CB 4.17Å; A218-L293 WeakPolarHBondContact O-CD1 3.23Å; A218-L294 HydrophobicContact CB-CB 4.03Å; A218-L294 HydrophobicContact CB-CD1 4.32Å
219	F	91.4	Very high	84.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-39	173.8	176	-96	0	0	0	112.9	A215 V216 R217 R222 L255 D258 F260 R286 I289	A215-F219 PolarHBondContact O-N 3.03Å; V216-F219 WeakPolarHBondContact O-CB 3.42Å; V216-F219 PolarHBondContact O-N 2.88Å; V216-F219 VanDerWaalsContact O-N 3.15Å; R217-F219 VanDerWaalsContact C-N 3.27Å; R217-F219 PolarHBondContact O-N 2.99Å; F219-R222 WeakPolarHBondContact O-CB 3.31Å; F219-R222 WeakPolarHBondContact O-CD 3.46Å; F219-R222 WeakPolarHBondContact O-CG 3.32Å; F219-R222 PolarHBondContact O-NH1 3.32Å; F219-L255 HydrophobicContact CB-CD2 4.38Å; F219-L255 HydrophobicContact CD1-CD2 3.36Å; F219-L255 HydrophobicContact CE1-CD2 3.79Å; F219-L255 HydrophobicContact CG-CD2 3.99Å; F219-D258 HydrophobicContact CE1-CB 4.34Å; F219-D258 WeakPolarHBondContact CE1-OD2 3.44Å; F219-D258 WeakPolarHBondContact CZ-OD2 3.11Å; F219-F260 HydrophobicContact CE2-CD1 4.07Å; F219-F260 HydrophobicContact CE2-CD2 4.36Å; F219-F260 HydrophobicContact CE2-CE1 4.31Å; F219-F260 HydrophobicContact CE2-CG 4.1Å; F219-F260 HydrophobicContact CZ-CB 3.91Å; F219-F260 HydrophobicContact CZ-CD1 4.09Å; F219-F260 HydrophobicContact CZ-CD2 4.3Å; F219-F260 AromaticContact CZ-CG 3.83Å; F219-F260 HydrophobicContact CZ-CG 3.83Å; F219-R286 HydrophobicContact CD2-CB 4.25Å; F219-R286 WeakPolarHBondContact CD2-O 3.4Å; F219-R286 HydrophobicContact CE1-CB 4.18Å; F219-R286 HydrophobicContact CE1-CG 4.21Å; F219-R286 HydrophobicContact CE2-CB 3.82Å; F219-R286 HydrophobicContact CE2-CG 3.86Å; F219-R286 HydrophobicContact CZ-CB 3.79Å; F219-R286 HydrophobicContact CZ-CG 3.54Å; F219-I289 HydrophobicContact CD2-CB 4.12Å; F219-I289 HydrophobicContact CD2-CG2 3.66Å; F219-I289 HydrophobicContact CE2-CB 4.41Å; F219-I289 HydrophobicContact CE2-CG2 3.98Å
220	C	87.1	Confident	83.3	Confident	46 Å²	46	44.1 Å²	44.1	31%	0.311	22%	0.223	S	C	.	.	H	α-helix	trans	-75.8	-38.9	-179.2	-60.5	0	0	0	0	111.9	V216 R217 R222 M254	V216-C220 PolarHBondContact O-N 3.38Å; V216-C220 PolarHBondContact O-SG 2.77Å; R217-C220 PolarHBondContact O-N 3.29Å; R217-C220 VanDerWaalsContact O-N 3.11Å; C220-R222 PolarHBondContact O-N 2.55Å; C220-M254 HydrophobicContact CB-CE 4.02Å
221	C	81.3	Confident	82.4	Confident	101 Å²	101	50.5 Å²	50.5	68%	0.682	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	14.5	176.1	-61.5	0	0	0	0	113.5	R217 D223	R217-C221 WeakPolarHBondContact O-CB 3.44Å; R217-C221 PolarHBondContact O-N 3.41Å; R217-C221 PolarHBondContact O-SG 3.17Å; C221-D223 PolarHBondContact O-N 2.92Å
222	R	81	Confident	81.7	Confident	67 Å²	67	57.1 Å²	57.1	25%	0.253	29%	0.286	S	S	.	.			trans	-60.4	135.4	-178	67.4	-174.6	178.8	-100.5	0.8	110.6	A218 F219 C220 M227 D258 L293	A218-R222 PolarHBondContact O-N 2.94Å; F219-R222 WeakPolarHBondContact O-CB 3.31Å; F219-R222 WeakPolarHBondContact O-CD 3.46Å; F219-R222 WeakPolarHBondContact O-CG 3.32Å; F219-R222 PolarHBondContact O-NH1 3.32Å; C220-R222 PolarHBondContact O-N 2.55Å; R222-M227 HydrophobicContact CB-SD 4.38Å; R222-D258 IonicContact CZ-OD1 3.23Å; R222-D258 IonicContact CZ-OD2 3.95Å; R222-D258 IonicContact NH1-OD1 2.75Å; R222-D258 IonicContact NH1-OD2 2.72Å; R222-D258 PolarHBondContact NH1-OD2 2.93Å; R222-D258 IonicContact NH2-OD1 3.93Å; R222-D258 PolarHBondContact NH2-OD1 3.41Å; R222-D258 IonicContact NH2-OD2 2.7Å; R222-D258 PolarHBondContact NH2-OD2 3.06Å; R222-L293 HydrophobicContact CB-CD1 3.76Å
223	D	69.4	Low	81.2	Confident	75 Å²	75	59.3 Å²	59.3	40%	0.401	30%	0.3	S	S	.	.			trans	-114.2	166.6	169.8	74.4	4.6	0	0	0	111	C221 L225 S226 M227	C221-D223 PolarHBondContact O-N 2.92Å; D223-L225 PolarHBondContact O-N 3.44Å; D223-L225 PolarHBondContact OD1-N 3.05Å; D223-S226 PolarHBondContact O-N 3.22Å; D223-S226 WeakPolarHBondContact OD1-CA 3.47Å; D223-S226 WeakPolarHBondContact OD1-CB 3.45Å; D223-S226 PolarHBondContact OD1-N 2.81Å; D223-S226 PolarHBondContact OD1-OG 2.71Å; D223-M227 WeakPolarHBondContact O-CG 3.49Å; D223-M227 PolarHBondContact O-N 3.27Å
224	Y	69.7	Low	80.8	Confident	191 Å²	191	62.2 Å²	62.2	75%	0.749	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.2	179.4	170.7	-101.1	0	0	0	113
225	L	65.3	Low	80.7	Confident	104 Å²	104	62.1 Å²	62.1	55%	0.545	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-42.7	-178.6	-66.5	176	0	0	0	111.6	D223 M227 K228	D223-L225 PolarHBondContact O-N 3.44Å; D223-L225 PolarHBondContact OD1-N 3.05Å; L225-M227 VanDerWaalsContact C-N 3.26Å; L225-M227 PolarHBondContact O-N 3.18Å; L225-K228 VanDerWaalsContact O-CB 3.25Å; L225-K228 WeakPolarHBondContact O-CB 3.21Å; L225-K228 VanDerWaalsContact O-CG 3.32Å; L225-K228 WeakPolarHBondContact O-CG 3.41Å; L225-K228 PolarHBondContact O-N 3.25Å
226	S	70.6	Confident	80.4	Confident	42 Å²	42	64.8 Å²	64.8	29%	0.294	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-63	-35.1	179.7	-54.9	0	0	0	0	111	D223 K228 C229	D223-S226 PolarHBondContact O-N 3.22Å; D223-S226 WeakPolarHBondContact OD1-CA 3.47Å; D223-S226 WeakPolarHBondContact OD1-CB 3.45Å; D223-S226 PolarHBondContact OD1-N 2.81Å; D223-S226 PolarHBondContact OD1-OG 2.71Å; S226-K228 PolarHBondContact O-N 3.26Å; S226-C229 WeakPolarHBondContact O-CB 3.18Å; S226-C229 PolarHBondContact O-N 3.44Å; S226-C229 PolarHBondContact O-SG 3.45Å
227	M	76.8	Confident	80	Confident	45 Å²	45	66.2 Å²	66.2	22%	0.222	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-62.2	-7.1	174.8	-62.5	-59.9	-67.3	0	0	113.9	R222 D223 L225 C229 F230 F260 P263 L293	R222-M227 HydrophobicContact CB-SD 4.38Å; D223-M227 WeakPolarHBondContact O-CG 3.49Å; D223-M227 PolarHBondContact O-N 3.27Å; L225-M227 VanDerWaalsContact C-N 3.26Å; L225-M227 PolarHBondContact O-N 3.18Å; M227-C229 PolarHBondContact O-N 3.07Å; M227-F230 HydrophobicContact CB-CD2 4.39Å; M227-F230 HydrophobicContact CB-CE2 4.49Å; M227-F230 HydrophobicContact CE-CD2 3.75Å; M227-F230 HydrophobicContact CE-CE2 3.43Å; M227-F230 VanDerWaalsContact CE-CE2 3.43Å; M227-F230 HydrophobicContact CE-CZ 4.38Å; M227-F230 VanDerWaalsContact O-CD2 3.23Å; M227-F230 WeakPolarHBondContact O-CD2 3.37Å; M227-F230 HydrophobicContact SD-CD2 4.24Å; M227-F230 HydrophobicContact SD-CE2 3.54Å; M227-F230 VanDerWaalsContact SD-CE2 3.54Å; M227-F230 HydrophobicContact SD-CZ 4.5Å; M227-F260 HydrophobicContact CE-CE2 3.91Å; M227-F260 HydrophobicContact CE-CZ 3.81Å; M227-P263 HydrophobicContact CE-CG 3.78Å; M227-L293 HydrophobicContact SD-CD2 4.38Å
228	K	72.3	Confident	79.8	Confident	109 Å²	109	67.2 Å²	67.2	47%	0.474	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-71.3	-17.5	171.7	-66	175.1	-177	170.5	0	113	L225 S226 F230 K231	L225-K228 VanDerWaalsContact O-CB 3.25Å; L225-K228 WeakPolarHBondContact O-CB 3.21Å; L225-K228 VanDerWaalsContact O-CG 3.32Å; L225-K228 WeakPolarHBondContact O-CG 3.41Å; L225-K228 PolarHBondContact O-N 3.25Å; S226-K228 PolarHBondContact O-N 3.26Å; K228-F230 PolarHBondContact O-N 3.1Å; K228-K231 PolarHBondContact O-N 3.38Å
229	C	70.1	Confident	79.7	Confident	33 Å²	33	73.4 Å²	73.4	22%	0.223	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-61.3	-24.5	179.3	69	0	0	0	0	112.9	S226 M227 K231 N232 A296	S226-C229 WeakPolarHBondContact O-CB 3.18Å; S226-C229 PolarHBondContact O-N 3.44Å; S226-C229 PolarHBondContact O-SG 3.45Å; M227-C229 PolarHBondContact O-N 3.07Å; C229-K231 PolarHBondContact O-N 2.91Å; C229-N232 CarbonylContact O-C 3.57Å; C229-N232 PolarHBondContact O-N 3.34Å; C229-A296 HydrophobicContact CB-CB 4.11Å
230	F	72.8	Confident	79.7	Confident	32 Å²	32	75.2 Å²	75.2	14%	0.14	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-67.4	-5.1	179.1	-64.1	-66.9	0	0	0	115.2	M227 K228 N232 I289 E292 L293	M227-F230 HydrophobicContact CB-CD2 4.39Å; M227-F230 HydrophobicContact CB-CE2 4.49Å; M227-F230 HydrophobicContact CE-CD2 3.75Å; M227-F230 HydrophobicContact CE-CE2 3.43Å; M227-F230 VanDerWaalsContact CE-CE2 3.43Å; M227-F230 HydrophobicContact CE-CZ 4.38Å; M227-F230 VanDerWaalsContact O-CD2 3.23Å; M227-F230 WeakPolarHBondContact O-CD2 3.37Å; M227-F230 HydrophobicContact SD-CD2 4.24Å; M227-F230 HydrophobicContact SD-CE2 3.54Å; M227-F230 VanDerWaalsContact SD-CE2 3.54Å; M227-F230 HydrophobicContact SD-CZ 4.5Å; K228-F230 PolarHBondContact O-N 3.1Å; F230-N232 VanDerWaalsContact C-N 3.26Å; F230-N232 PolarHBondContact O-N 2.88Å; F230-I289 HydrophobicContact CE1-CB 4.28Å; F230-I289 HydrophobicContact CE1-CG1 3.82Å; F230-I289 HydrophobicContact CE1-CG2 4.28Å; F230-I289 HydrophobicContact CE2-CG2 4.19Å; F230-I289 HydrophobicContact CZ-CB 3.98Å; F230-I289 HydrophobicContact CZ-CG1 3.9Å; F230-I289 HydrophobicContact CZ-CG2 3.5Å; F230-E292 HydrophobicContact CE1-CB 3.89Å; F230-E292 HydrophobicContact CE1-CG 4.04Å; F230-E292 HydrophobicContact CZ-CB 4.14Å; F230-L293 HydrophobicContact CE2-CD2 4.4Å; F230-L293 HydrophobicContact CZ-CG 4.45Å
231	K	74	Confident	80	Confident	165 Å²	165	74.7 Å²	74.7	72%	0.717	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-65.8	-31.7	170.7	-70.8	-175.6	-178.2	-179.7	0	112.4	K228 C229	K228-K231 PolarHBondContact O-N 3.38Å; C229-K231 PolarHBondContact O-N 2.91Å
232	N	79.5	Confident	80.5	Confident	143 Å²	143	75.9 Å²	75.9	77%	0.765	38%	0.379	S	S	*	.	S	Bend	trans	-138.6	74.6	178.5	-74.6	-36.7	0	0	0	109.1	C229 F230	C229-N232 CarbonylContact O-C 3.57Å; C229-N232 PolarHBondContact O-N 3.34Å; F230-N232 VanDerWaalsContact C-N 3.26Å; F230-N232 PolarHBondContact O-N 2.88Å
233	P	84.9	Confident	81	Confident	45 Å²	45	74.5 Å²	74.5	29%	0.292	37%	0.373	S	S	.	.			trans	-66.5	135.6	-175.7	28.1	-33.4	0	0	0	110.9	F235 P236 E292	P233-F235 VanDerWaalsContact C-N 3.27Å; P233-P236 HydrophobicContact CG-CB 4.26Å; P233-E292 WeakPolarHBondContact CA-OE1 3.41Å; P233-E292 WeakPolarHBondContact CB-OE1 3.29Å
234	R	86.6	Confident	82.2	Confident	62 Å²	62	73.1 Å²	73.1	23%	0.234	36%	0.364	C	S	.	.	S	Bend	trans	-70.6	-26.9	170	-162.8	173.2	-156.6	-158.6	1.9	112	P236 E292 E374	R234-P236 WeakPolarHBondContact O-CD 3.31Å; R234-E292 VanDerWaalsContact CB-OE2 3.27Å; R234-E292 WeakPolarHBondContact CB-OE2 3.43Å; R234-E292 VanDerWaalsContact N-CD 3.32Å; R234-E292 PolarHBondContact N-OE1 2.86Å; R234-E292 PolarHBondContact N-OE2 2.74Å; R234-E292 VanDerWaalsContact N-OE2 3.17Å; R234-E374 IonicContact NH2-OE2 2.87Å
235	F	90.3	Very high	83.4	Confident	5 Å²	5	64.4 Å²	64.4	2%	0.022	33%	0.33	C	S	.	.	S	Bend	trans	-126.4	69.4	-176	-51.1	-61.1	0	0	0	109.8	P198 K200 L201 P233 T288 F291 E292 L370	P198-F235 HydrophobicContact CG-CB 4.12Å; K200-F235 HydrophobicContact CB-CE1 4.35Å; K200-F235 HydrophobicContact CD-CE1 4.46Å; L201-F235 HydrophobicContact CD1-CB 4.23Å; L201-F235 HydrophobicContact CD1-CD1 4.34Å; L201-F235 HydrophobicContact CD1-CD2 4.13Å; L201-F235 HydrophobicContact CD1-CG 3.98Å; L201-F235 HydrophobicContact CD2-CD1 4.06Å; L201-F235 HydrophobicContact CD2-CD2 4.22Å; L201-F235 HydrophobicContact CD2-CE1 3.76Å; L201-F235 HydrophobicContact CD2-CE2 3.95Å; L201-F235 HydrophobicContact CD2-CG 4.29Å; L201-F235 HydrophobicContact CD2-CZ 3.7Å; L201-F235 HydrophobicContact CG-CD1 3.97Å; L201-F235 HydrophobicContact CG-CD2 4.44Å; L201-F235 HydrophobicContact CG-CE1 4.17Å; L201-F235 HydrophobicContact CG-CG 4.12Å; L201-F235 HydrophobicContact CG-CZ 4.49Å; P233-F235 VanDerWaalsContact C-N 3.27Å; F235-T288 HydrophobicContact CB-CG2 3.7Å; F235-F291 HydrophobicContact CD2-CB 4.3Å; F235-F291 HydrophobicContact CE2-CB 4.1Å; F235-E292 WeakPolarHBondContact CA-OE1 3.41Å; F235-E292 HydrophobicContact CB-CG 4.42Å; F235-E292 HydrophobicContact CD2-CG 3.9Å; F235-E292 PolarHBondContact N-OE1 2.92Å; F235-L370 HydrophobicContact CE1-CD2 4.19Å; F235-L370 HydrophobicContact CZ-CD1 3.7Å; F235-L370 HydrophobicContact CZ-CD2 4.09Å
236	P	88.2	Confident	84.9	Confident	56 Å²	56	61.3 Å²	61.3	36%	0.364	31%	0.312	S	S	.	.			trans	-61	154.6	175	27.5	-34.8	0	0	0	110.6	P233 R234 A238	P233-P236 HydrophobicContact CG-CB 4.26Å; R234-P236 WeakPolarHBondContact O-CD 3.31Å; P236-A238 PolarHBondContact O-N 3.06Å
237	P	88.4	Confident	86	Confident	30 Å²	30	59.3 Å²	59.3	20%	0.195	30%	0.298	C	S	.	.	S	Bend	trans	-73.9	48.9	177.3	30.7	-34.2	0	0	0	112.9	L240 D267 W268	P237-L240 HydrophobicContact CB-CD1 4.48Å; P237-D267 VanDerWaalsContact CG-C 3.47Å; P237-D267 HydrophobicContact CG-CB 3.52Å; P237-D267 WeakPolarHBondContact CG-O 3.32Å; P237-W268 HydrophobicContact CB-CD2 3.56Å; P237-W268 HydrophobicContact CB-CE3 3.73Å; P237-W268 HydrophobicContact CB-CG 4.1Å; P237-W268 HydrophobicContact CB-CH2 4.03Å; P237-W268 HydrophobicContact CB-CZ2 3.86Å; P237-W268 HydrophobicContact CB-CZ3 3.97Å; P237-W268 HydrophobicContact CG-CD2 4.07Å; P237-W268 HydrophobicContact CG-CG 4.09Å
238	A	87.1	Confident	86.9	Confident	54 Å²	54	57.5 Å²	57.5	45%	0.446	29%	0.289	S	S	.	.			trans	-113.5	146.8	177.4	0	0	0	0	0	109.9	P236 L240	P236-A238 PolarHBondContact O-N 3.06Å; A238-L240 VanDerWaalsContact C-N 3.28Å; A238-L240 PolarHBondContact O-N 3.28Å
239	N	86.4	Confident	88	Confident	137 Å²	137	55.2 Å²	55.2	73%	0.733	28%	0.279	S	S	*	.	S	Bend	trans	52.9	44.6	-179.5	-56.4	-31.3	0	0	0	112.9	V199 V241	V199-N239 HydrophobicContact CG2-CB 4.45Å; V199-N239 WeakPolarHBondContact CG2-O 3.44Å; N239-V241 PolarHBondContact O-N 3.03Å
240	L	92.2	Very high	89.1	Confident	38 Å²	38	56.1 Å²	56.1	20%	0.199	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.7	178.5	-60.6	176.7	0	0	0	110.2	M196 L197 P198 P237 A238 W268 Y281	M196-L240 HydrophobicContact CB-CB 4.34Å; M196-L240 HydrophobicContact CB-CD1 4.34Å; M196-L240 HydrophobicContact CE-CB 3.95Å; L197-L240 CarbonylContact O-C 3.59Å; L197-L240 WeakPolarHBondContact O-CA 3.44Å; P198-L240 HydrophobicContact CG-CD2 3.87Å; P237-L240 HydrophobicContact CB-CD1 4.48Å; A238-L240 VanDerWaalsContact C-N 3.28Å; A238-L240 PolarHBondContact O-N 3.28Å; L240-W268 HydrophobicContact CD1-CH2 4.35Å; L240-W268 HydrophobicContact CD1-CZ3 3.87Å; L240-W268 HydrophobicContact CD2-CH2 4Å; L240-W268 HydrophobicContact CD2-CZ3 4.35Å; L240-Y281 HydrophobicContact CD1-CD1 4.25Å; L240-Y281 HydrophobicContact CD1-CE1 3.77Å
241	V	92.5	Very high	90.2	Very high	35 Å²	35	54.6 Å²	54.6	21%	0.212	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.7	174.2	-66.1	0	0	0	0	109.8	L197 V199 A202 N239 R243	L197-V241 PolarHBondContact N-O 2.98Å; L197-V241 WeakPolarHBondContact O-CG2 3.32Å; L197-V241 PolarHBondContact O-N 2.71Å; V199-V241 HydrophobicContact CG2-CG1 3.87Å; V199-V241 HydrophobicContact CG2-CG2 4.47Å; A202-V241 HydrophobicContact CB-CG2 3.45Å; A202-V241 VanDerWaalsContact CB-CG2 3.45Å; N239-V241 PolarHBondContact O-N 3.03Å; V241-R243 PolarHBondContact O-N 2.87Å
242	R	92.6	Very high	91.3	Very high	126 Å²	126	46.9 Å²	46.9	48%	0.475	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.6	174.3	-168.9	175.2	-175.4	-115.6	4.3	108.8	Y194 M196	Y194-R242 HydrophobicContact CD1-CG 3.82Å; Y194-R242 HydrophobicContact CG-CG 4.31Å; Y194-R242 VanDerWaalsContact CG-CZ 3.4Å; Y194-R242 VanDerWaalsContact CG-NH2 3.33Å; M196-R242 HydrophobicContact SD-CB 3.67Å; M196-R242 HydrophobicContact SD-CG 4.04Å
243	R	91.8	Very high	92	Very high	37 Å²	37	40.8 Å²	40.8	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.2	-178.8	-179.6	71.1	-171.1	169.3	17.4	109.6	Y194 C195 A202 K206 V241 V245 D388	Y194-R243 WeakPolarHBondContact CA-O 3.45Å; C195-R243 PolarHBondContact N-O 2.77Å; C195-R243 PolarHBondContact O-N 2.92Å; A202-R243 HydrophobicContact CB-CB 4.2Å; A202-R243 HydrophobicContact CB-CG 4.27Å; K206-R243 VanDerWaalsContact CD-NH1 3.34Å; V241-R243 PolarHBondContact O-N 2.87Å; R243-V245 HydrophobicContact CB-CG2 4.48Å; R243-V245 HydrophobicContact CG-CG2 4.08Å; R243-V245 PolarHBondContact O-N 2.87Å; R243-D388 IonicContact CZ-OD2 2.8Å; R243-D388 VanDerWaalsContact CZ-OD2 3.23Å; R243-D388 IonicContact NH1-OD1 3.56Å; R243-D388 PolarHBondContact NH1-OD1 2.94Å; R243-D388 IonicContact NH1-OD2 3.27Å; R243-D388 PolarHBondContact NH1-OD2 3.3Å; R243-D388 IonicContact NH2-OD2 3.42Å
244	K	94.3	Very high	92.4	Very high	47 Å²	47	41.3 Å²	41.3	20%	0.204	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	120.8	167.2	-168.7	168.5	178.9	171.5	0	108.7	V193 Y194 E393	V193-K244 WeakPolarHBondContact O-CA 3.42Å; Y194-K244 HydrophobicContact CD1-CB 4.08Å; Y194-K244 HydrophobicContact CE1-CB 3.84Å; K244-E393 PolarHBondContact NZ-O 2.73Å
245	V	95.2	Very high	92.8	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.2	-179	-178.2	0	0	0	0	108.3	S192 V193 C195 L197 L205 I212 R243 F247	S192-V245 VanDerWaalsContact CA-O 3.31Å; S192-V245 WeakPolarHBondContact CA-O 3.32Å; V193-V245 PolarHBondContact N-O 3.35Å; V193-V245 PolarHBondContact O-N 2.91Å; C195-V245 HydrophobicContact CB-CG2 4.01Å; L197-V245 HydrophobicContact CD1-CG2 3.79Å; L205-V245 HydrophobicContact CD1-CG1 3.99Å; L205-V245 HydrophobicContact CD1-CG2 3.96Å; I212-V245 HydrophobicContact CD1-CG1 4Å; I212-V245 HydrophobicContact CG1-CG1 4.18Å; R243-V245 HydrophobicContact CB-CG2 4.48Å; R243-V245 HydrophobicContact CG-CG2 4.08Å; R243-V245 PolarHBondContact O-N 2.87Å; V245-F247 HydrophobicContact CB-CD2 4.5Å; V245-F247 HydrophobicContact CB-CE2 3.7Å; V245-F247 HydrophobicContact CB-CZ 4.15Å; V245-F247 HydrophobicContact CG1-CD2 4.16Å; V245-F247 HydrophobicContact CG1-CE1 4.39Å; V245-F247 HydrophobicContact CG1-CE2 3.52Å; V245-F247 HydrophobicContact CG1-CZ 3.66Å; V245-F247 WeakPolarHBondContact O-CD2 3.31Å
246	R	95.4	Very high	92.9	Very high	40 Å²	40	39.5 Å²	39.5	15%	0.151	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.5	176.2	-177.4	170	61.9	173	0.7	109.9	I40 W190 E209	I40-R246 HydrophobicContact CD1-CB 4.47Å; I40-R246 HydrophobicContact CD1-CG 4.05Å; W190-R246 HydrophobicContact CB-CG 4.37Å; W190-R246 HydrophobicContact CG-CG 4.31Å; E209-R246 IonicContact OE1-NH2 3.14Å; E209-R246 IonicContact OE2-CZ 3.59Å; E209-R246 IonicContact OE2-NE 3.7Å; E209-R246 PolarHBondContact OE2-NE 3.19Å; E209-R246 IonicContact OE2-NH2 2.98Å; E209-R246 PolarHBondContact OE2-NH2 3.49Å
247	F	95.7	Very high	93.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	166.9	174.4	-58.3	-101.2	0	0	0	109.2	W190 H191 V193 I212 V216 V245 L251 L255 I283 V287	W190-F247 WeakPolarHBondContact CA-O 3.38Å; H191-F247 PolarHBondContact N-O 3.14Å; H191-F247 PolarHBondContact O-N 2.71Å; V193-F247 HydrophobicContact CG2-CD2 4.12Å; V193-F247 HydrophobicContact CG2-CE2 3.62Å; I212-F247 HydrophobicContact CD1-CD1 4.28Å; I212-F247 HydrophobicContact CD1-CE1 3.52Å; I212-F247 HydrophobicContact CD1-CZ 3.95Å; I212-F247 HydrophobicContact CG1-CD1 3.53Å; I212-F247 HydrophobicContact CG1-CE1 3.3Å; I212-F247 HydrophobicContact CG1-CG 4.43Å; I212-F247 HydrophobicContact CG1-CZ 4.04Å; V216-F247 HydrophobicContact CG2-CD1 4.44Å; V216-F247 HydrophobicContact CG2-CE1 4.25Å; V245-F247 HydrophobicContact CB-CD2 4.5Å; V245-F247 HydrophobicContact CB-CE2 3.7Å; V245-F247 HydrophobicContact CB-CZ 4.15Å; V245-F247 HydrophobicContact CG1-CD2 4.16Å; V245-F247 HydrophobicContact CG1-CE1 4.39Å; V245-F247 HydrophobicContact CG1-CE2 3.52Å; V245-F247 HydrophobicContact CG1-CZ 3.66Å; V245-F247 WeakPolarHBondContact O-CD2 3.31Å; F247-L251 HydrophobicContact CB-CB 4.37Å; F247-L251 HydrophobicContact CD1-CB 4.33Å; F247-L255 HydrophobicContact CE1-CD1 3.83Å; F247-L255 HydrophobicContact CZ-CD1 4.38Å; F247-I283 HydrophobicContact CZ-CG2 4.15Å; F247-V287 HydrophobicContact CE1-CG2 4.01Å; F247-V287 HydrophobicContact CZ-CG2 3.86Å
248	T	94.9	Very high	93.1	Very high	6 Å²	6	43.3 Å²	43.3	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	153.9	150.5	61.2	0	0	0	0	108.9	I40 D189 M250 L251 Y252	I40-T248 HydrophobicContact CB-CG2 4.09Å; I40-T248 HydrophobicContact CG2-CG2 4.41Å; I40-T248 WeakPolarHBondContact O-CG2 3.33Å; D189-T248 CarbonylContact O-C 3.58Å; D189-T248 WeakPolarHBondContact O-CA 3.31Å; D189-T248 VanDerWaalsContact OD2-CB 3.23Å; D189-T248 WeakPolarHBondContact OD2-CB 3.35Å; T248-M250 PolarHBondContact O-N 2.85Å; T248-L251 HydrophobicContact CG2-CD1 4.43Å; T248-L251 PolarHBondContact O-N 2.69Å; T248-L251 WeakPolarHBondContact OG1-CB 3.5Å; T248-L251 WeakPolarHBondContact OG1-CD1 3.44Å; T248-L251 WeakPolarHBondContact OG1-CG 3.23Å; T248-L251 PolarHBondContact OG1-N 2.94Å; T248-Y252 PolarHBondContact O-N 2.79Å
249	K	94.2	Very high	93.1	Very high	61 Å²	61	48 Å²	48	27%	0.265	24%	0.241	S	C	.	.	H	α-helix	trans	-52.6	-43.9	175.1	-83.7	178.8	175.5	169	0	111.2	Q188 D189 H191 Y252 A253 W399	Q188-K249 WeakPolarHBondContact O-CE 3.33Å; Q188-K249 PolarHBondContact O-NZ 3.49Å; D189-K249 WeakPolarHBondContact O-CG 3.19Å; D189-K249 PolarHBondContact O-N 3.34Å; H191-K249 HydrophobicContact CB-CG 4.09Å; K249-Y252 PolarHBondContact O-N 2.58Å; K249-A253 WeakPolarHBondContact O-CB 3.28Å; K249-A253 PolarHBondContact O-N 3.48Å; K249-W399 HydrophobicContact CB-CH2 3.44Å; K249-W399 VanDerWaalsContact CB-CH2 3.44Å; K249-W399 HydrophobicContact CB-CZ2 3.58Å; K249-W399 HydrophobicContact CB-CZ3 4.07Å; K249-W399 HydrophobicContact CD-CD2 4.19Å; K249-W399 HydrophobicContact CD-CE3 4.35Å; K249-W399 HydrophobicContact CD-CH2 4.4Å; K249-W399 HydrophobicContact CD-CZ2 4.24Å; K249-W399 HydrophobicContact CD-CZ3 4.46Å; K249-W399 HydrophobicContact CG-CD2 4.41Å; K249-W399 HydrophobicContact CG-CH2 3.93Å; K249-W399 HydrophobicContact CG-CZ2 3.59Å; K249-W399 HydrophobicContact CG-CZ3 4.46Å; K249-W399 VanDerWaalsContact O-CH2 3.23Å; K249-W399 WeakPolarHBondContact O-CH2 3.26Å
250	M	93.9	Very high	93.1	Very high	52 Å²	52	42.5 Å²	42.5	26%	0.256	21%	0.211	S	C	.	.	H	α-helix	trans	-59.1	-51.5	177.4	-168.9	-178.9	81.3	0	0	112.2	Y42 C67 T248 Y252 A253 M254	Y42-M250 HydrophobicContact CD1-CE 4.31Å; Y42-M250 HydrophobicContact CD2-CE 3.02Å; Y42-M250 HydrophobicContact CE2-CE 3.36Å; Y42-M250 HydrophobicContact CG-CE 3.54Å; C67-M250 HydrophobicContact CB-CE 3.63Å; C67-M250 HydrophobicContact CB-SD 4.18Å; T248-M250 PolarHBondContact O-N 2.85Å; M250-Y252 VanDerWaalsContact C-N 3.26Å; M250-Y252 PolarHBondContact O-N 3.44Å; M250-A253 PolarHBondContact O-N 3.18Å; M250-A253 VanDerWaalsContact O-N 3.16Å; M250-M254 HydrophobicContact CE-SD 4.49Å; M250-M254 VanDerWaalsContact O-CG 3.3Å; M250-M254 WeakPolarHBondContact O-CG 3.19Å; M250-M254 PolarHBondContact O-N 2.93Å
251	L	96	Very high	92.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-37.4	179.1	-70.7	172.2	0	0	0	111.9	I40 Y42 I212 A213 V216 F247 T248 L255	I40-L251 HydrophobicContact CG2-CD1 4.04Å; Y42-L251 HydrophobicContact CD2-CD2 3.73Å; Y42-L251 HydrophobicContact CD2-CG 4.48Å; Y42-L251 HydrophobicContact CE2-CD2 4.01Å; I212-L251 HydrophobicContact CG2-CD1 4.37Å; A213-L251 HydrophobicContact CB-CD1 3.74Å; A213-L251 HydrophobicContact CB-CD2 4.36Å; V216-L251 HydrophobicContact CB-CD2 3.92Å; V216-L251 HydrophobicContact CG1-CB 4.39Å; V216-L251 HydrophobicContact CG1-CD2 3.77Å; V216-L251 HydrophobicContact CG2-CD2 4.5Å; F247-L251 HydrophobicContact CB-CB 4.37Å; F247-L251 HydrophobicContact CD1-CB 4.33Å; T248-L251 HydrophobicContact CG2-CD1 4.43Å; T248-L251 PolarHBondContact O-N 2.69Å; T248-L251 WeakPolarHBondContact OG1-CB 3.5Å; T248-L251 WeakPolarHBondContact OG1-CD1 3.44Å; T248-L251 WeakPolarHBondContact OG1-CG 3.23Å; T248-L251 PolarHBondContact OG1-N 2.94Å; L251-L255 PolarHBondContact O-N 2.93Å
252	Y	96.6	Very high	92.3	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-47.7	174.2	178.3	-106.1	0	0	0	112.1	H191 V193 T248 K249 M250 M254 L255 A256 K279 I283 D397 W399 L400	H191-Y252 AromaticContact CD2-CD1 3.29Å; H191-Y252 WeakPolarHBondContact CD2-CD1 3.48Å; H191-Y252 AromaticContact CD2-CD2 3.51Å; H191-Y252 AromaticContact CD2-CE1 3.66Å; H191-Y252 AromaticContact CD2-CE2 3.89Å; H191-Y252 AromaticContact CD2-CG 3.19Å; H191-Y252 AromaticContact CD2-CZ 3.95Å; H191-Y252 AromaticContact CE1-CE1 3.94Å; H191-Y252 AromaticContact CG-CD1 3.98Å; H191-Y252 AromaticContact NE2-CD1 3.41Å; H191-Y252 WeakPolarHBondContact NE2-CD1 3.39Å; H191-Y252 AromaticContact NE2-CD2 3.9Å; H191-Y252 AromaticContact NE2-CE1 3.23Å; H191-Y252 WeakPolarHBondContact NE2-CE1 3.47Å; H191-Y252 AromaticContact NE2-CE2 3.77Å; H191-Y252 AromaticContact NE2-CG 3.73Å; H191-Y252 AromaticContact NE2-CZ 3.44Å; V193-Y252 HydrophobicContact CB-CE2 4.43Å; V193-Y252 HydrophobicContact CG1-CD2 4.35Å; V193-Y252 HydrophobicContact CG1-CE2 3.79Å; V193-Y252 HydrophobicContact CG2-CD2 4.16Å; V193-Y252 HydrophobicContact CG2-CE2 3.92Å; T248-Y252 PolarHBondContact O-N 2.79Å; K249-Y252 PolarHBondContact O-N 2.58Å; M250-Y252 VanDerWaalsContact C-N 3.26Å; M250-Y252 PolarHBondContact O-N 3.44Å; Y252-M254 VanDerWaalsContact C-N 3.3Å; Y252-M254 PolarHBondContact O-N 3.35Å; Y252-L255 PolarHBondContact O-N 2.91Å; Y252-A256 HydrophobicContact CD1-CB 4.3Å; Y252-A256 HydrophobicContact CE1-CB 3.89Å; Y252-A256 HydrophobicContact CE2-CB 4.39Å; Y252-A256 WeakPolarHBondContact O-CB 3.43Å; Y252-A256 PolarHBondContact O-N 3.47Å; Y252-K279 WeakPolarHBondContact OH-CE 3.33Å; Y252-K279 PolarHBondContact OH-NZ 3.12Å; Y252-I283 HydrophobicContact CE2-CD1 4.05Å; Y252-I283 HydrophobicContact CE2-CG1 4.12Å; Y252-D397 VanDerWaalsContact CE1-OD1 3.26Å; Y252-D397 WeakPolarHBondContact CE1-OD1 3.32Å; Y252-D397 PolarHBondContact OH-OD1 2.72Å; Y252-D397 PolarHBondContact OH-OD2 3.47Å; Y252-W399 HydrophobicContact CD1-CZ2 4.1Å; Y252-L400 HydrophobicContact CD1-CD1 4.18Å; Y252-L400 HydrophobicContact CE1-CD1 3.73Å
253	A	94.8	Very high	91.6	Very high	16 Å²	16	43.7 Å²	43.7	13%	0.132	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-43.3	178.7	0	0	0	0	0	112.1	K249 M250 L255 A256 L257 W399 L400	K249-A253 WeakPolarHBondContact O-CB 3.28Å; K249-A253 PolarHBondContact O-N 3.48Å; M250-A253 PolarHBondContact O-N 3.18Å; M250-A253 VanDerWaalsContact O-N 3.16Å; A253-L255 PolarHBondContact O-N 2.85Å; A253-A256 PolarHBondContact O-N 2.62Å; A253-L257 HydrophobicContact CB-CD1 4.24Å; A253-L257 WeakPolarHBondContact O-CB 3.48Å; A253-L257 WeakPolarHBondContact O-CG 3.48Å; A253-L257 PolarHBondContact O-N 3.36Å; A253-W399 HydrophobicContact CB-CH2 3.92Å; A253-L400 HydrophobicContact CB-CD2 3.59Å
254	M	93.4	Very high	90.7	Very high	55 Å²	55	48.5 Å²	48.5	27%	0.271	26%	0.26	S	S	.	.	H	α-helix	trans	-57.4	-35.7	176.9	-69.7	177.7	90.1	0	0	112.3	Y42 V216 C220 M250 Y252 D258	Y42-M254 HydrophobicContact CE2-CE 4.35Å; Y42-M254 HydrophobicContact CE2-SD 3.92Å; V216-M254 HydrophobicContact CG1-CB 4.17Å; V216-M254 HydrophobicContact CG1-SD 4.42Å; C220-M254 HydrophobicContact CB-CE 4.02Å; M250-M254 HydrophobicContact CE-SD 4.49Å; M250-M254 VanDerWaalsContact O-CG 3.3Å; M250-M254 WeakPolarHBondContact O-CG 3.19Å; M250-M254 PolarHBondContact O-N 2.93Å; Y252-M254 VanDerWaalsContact C-N 3.3Å; Y252-M254 PolarHBondContact O-N 3.35Å; M254-D258 WeakPolarHBondContact O-CB 3.38Å
255	L	94.9	Very high	89.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-80.4	-42.3	174.2	-66.2	-172.3	0	0	0	112.6	V216 F219 F247 L251 Y252 A253 I283 R286 V287	V216-L255 HydrophobicContact CB-CD2 4.44Å; V216-L255 HydrophobicContact CG1-CD2 3.99Å; V216-L255 HydrophobicContact CG1-CG 4.08Å; V216-L255 HydrophobicContact CG2-CD1 3.85Å; V216-L255 HydrophobicContact CG2-CD2 4.14Å; V216-L255 HydrophobicContact CG2-CG 3.96Å; F219-L255 HydrophobicContact CB-CD2 4.38Å; F219-L255 HydrophobicContact CD1-CD2 3.36Å; F219-L255 HydrophobicContact CE1-CD2 3.79Å; F219-L255 HydrophobicContact CG-CD2 3.99Å; F247-L255 HydrophobicContact CE1-CD1 3.83Å; F247-L255 HydrophobicContact CZ-CD1 4.38Å; L251-L255 PolarHBondContact O-N 2.93Å; Y252-L255 PolarHBondContact O-N 2.91Å; A253-L255 PolarHBondContact O-N 2.85Å; L255-I283 HydrophobicContact CB-CD1 4.23Å; L255-I283 HydrophobicContact CD1-CG2 4.09Å; L255-R286 HydrophobicContact CD2-CB 4.1Å; L255-R286 VanDerWaalsContact O-CD 3.28Å; L255-R286 WeakPolarHBondContact O-CD 3.43Å; L255-R286 PolarHBondContact O-NH1 3.35Å; L255-V287 HydrophobicContact CD1-CG2 3.61Å
256	A	93.3	Very high	89	Confident	29 Å²	29	58.4 Å²	58.4	24%	0.24	30%	0.299	C	S	.	.	H	α-helix	trans	-71.4	-41.9	-170.6	0	0	0	0	0	112.3	Y252 A253 I283 R286 L400	Y252-A256 HydrophobicContact CD1-CB 4.3Å; Y252-A256 HydrophobicContact CE1-CB 3.89Å; Y252-A256 HydrophobicContact CE2-CB 4.39Å; Y252-A256 WeakPolarHBondContact O-CB 3.43Å; Y252-A256 PolarHBondContact O-N 3.47Å; A253-A256 PolarHBondContact O-N 2.62Å; A256-I283 HydrophobicContact CB-CD1 4.33Å; A256-R286 PolarHBondContact O-NH1 3.34Å; A256-L400 HydrophobicContact CB-CD1 3.98Å
257	L	90.9	Very high	88.5	Confident	122 Å²	122	62.2 Å²	62.2	64%	0.639	32%	0.323	S	S	*	.	S	Bend	trans	-82.1	-13.8	-175.9	-62.8	175.3	0	0	0	113.6	A253 N259 L400	A253-L257 HydrophobicContact CB-CD1 4.24Å; A253-L257 WeakPolarHBondContact O-CB 3.48Å; A253-L257 WeakPolarHBondContact O-CG 3.48Å; A253-L257 PolarHBondContact O-N 3.36Å; L257-N259 PolarHBondContact O-N 3.22Å; L257-L400 HydrophobicContact CD1-CD2 4.34Å
258	D	88.5	Confident	88.1	Confident	44 Å²	44	63.2 Å²	63.2	24%	0.235	33%	0.326	C	S	.	.	S	Bend	trans	-73.2	123	178.4	179.9	43.4	0	0	0	111.2	F219 R222 M254 F260 R286	F219-D258 HydrophobicContact CE1-CB 4.34Å; F219-D258 WeakPolarHBondContact CE1-OD2 3.44Å; F219-D258 WeakPolarHBondContact CZ-OD2 3.11Å; R222-D258 IonicContact CZ-OD1 3.23Å; R222-D258 IonicContact CZ-OD2 3.95Å; R222-D258 IonicContact NH1-OD1 2.75Å; R222-D258 IonicContact NH1-OD2 2.72Å; R222-D258 PolarHBondContact NH1-OD2 2.93Å; R222-D258 IonicContact NH2-OD1 3.93Å; R222-D258 PolarHBondContact NH2-OD1 3.41Å; R222-D258 IonicContact NH2-OD2 2.7Å; R222-D258 PolarHBondContact NH2-OD2 3.06Å; M254-D258 WeakPolarHBondContact O-CB 3.38Å; D258-F260 PolarHBondContact O-N 3.18Å; D258-F260 VanDerWaalsContact OD2-CB 3.31Å; D258-F260 WeakPolarHBondContact OD2-CB 3.45Å; D258-R286 VanDerWaalsContact O-CZ 3.32Å; D258-R286 PolarHBondContact O-NH2 3.03Å
259	N	87	Confident	87.6	Confident	152 Å²	152	71.7 Å²	71.7	81%	0.813	36%	0.363	S	S	*	.			trans	-81.3	67.5	179.2	-166.4	17.1	0	0	0	110.8	L257	L257-N259 PolarHBondContact O-N 3.22Å
260	F	87.9	Confident	87.4	Confident	23 Å²	23	71 Å²	71	10%	0.101	36%	0.362	C	S	.	.			trans	-104.8	126.2	179.9	-179.1	-90.2	0	0	0	111.8	F219 M227 D258 P263 M285 R286 I289	F219-F260 HydrophobicContact CE2-CD1 4.07Å; F219-F260 HydrophobicContact CE2-CD2 4.36Å; F219-F260 HydrophobicContact CE2-CE1 4.31Å; F219-F260 HydrophobicContact CE2-CG 4.1Å; F219-F260 HydrophobicContact CZ-CB 3.91Å; F219-F260 HydrophobicContact CZ-CD1 4.09Å; F219-F260 HydrophobicContact CZ-CD2 4.3Å; F219-F260 AromaticContact CZ-CG 3.83Å; F219-F260 HydrophobicContact CZ-CG 3.83Å; M227-F260 HydrophobicContact CE-CE2 3.91Å; M227-F260 HydrophobicContact CE-CZ 3.81Å; D258-F260 PolarHBondContact O-N 3.18Å; D258-F260 VanDerWaalsContact OD2-CB 3.31Å; D258-F260 WeakPolarHBondContact OD2-CB 3.45Å; F260-P263 HydrophobicContact CZ-CG 4.35Å; F260-M285 HydrophobicContact CD1-CE 3.85Å; F260-M285 HydrophobicContact CE1-CE 3.94Å; F260-R286 HydrophobicContact CD1-CG 4.47Å; F260-R286 PolarHBondContact O-NH2 3.41Å; F260-I289 HydrophobicContact CD1-CD1 4.47Å; F260-I289 HydrophobicContact CE1-CD1 3.39Å; F260-I289 HydrophobicContact CZ-CD1 3.7Å
261	E	85.4	Confident	87.2	Confident	155 Å²	155	70.1 Å²	70.1	72%	0.724	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-103.4	148.1	171.1	-68.1	-171.3	167.2	0	0	111.5
262	P	82.4	Confident	86.9	Confident	37 Å²	37	73.8 Å²	73.8	24%	0.24	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-55.5	136.6	176.1	17.9	-27.7	0	0	0	111.1	W268 L270 M285	P262-W268 HydrophobicContact CB-CB 4.06Å; P262-L270 HydrophobicContact CG-CD1 3.93Å; P262-L270 HydrophobicContact CG-CG 4.33Å; P262-M285 HydrophobicContact CB-CE 4.5Å; P262-M285 HydrophobicContact CB-SD 3.65Å; P262-M285 HydrophobicContact CG-SD 4.21Å
263	P	77.2	Confident	86.4	Confident	31 Å²	31	77.9 Å²	77.9	20%	0.201	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-55.4	138.8	175.7	-23	31.4	0	0	0	110.5	M227 F260 R265 S266	M227-P263 HydrophobicContact CE-CG 3.78Å; F260-P263 HydrophobicContact CZ-CG 4.35Å; P263-R265 PolarHBondContact O-N 3.18Å; P263-S266 VanDerWaalsContact O-CB 3.31Å; P263-S266 WeakPolarHBondContact O-CB 3.07Å; P263-S266 PolarHBondContact O-N 3.02Å; P263-S266 PolarHBondContact O-OG 3.02Å
264	P	73.3	Confident	85.9	Confident	139 Å²	139	84.4 Å²	84.4	90%	0.903	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.7	-173.7	-25.6	31.8	0	0	0	115.2
265	R	74.4	Confident	85.7	Confident	236 Å²	236	85.1 Å²	85.1	89%	0.891	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	6.7	179.3	-62.1	-178.3	-179.6	159.5	0.8	113.1	P263	P263-R265 PolarHBondContact O-N 3.18Å
266	S	79.4	Confident	85.3	Confident	25 Å²	25	89.8 Å²	89.8	18%	0.175	49%	0.49	C	S	.	.	S	Bend	trans	-84.8	151.1	177.2	74.1	0	0	0	0	110.5	P263 W268	P263-S266 VanDerWaalsContact O-CB 3.31Å; P263-S266 WeakPolarHBondContact O-CB 3.07Å; P263-S266 PolarHBondContact O-N 3.02Å; P263-S266 PolarHBondContact O-OG 3.02Å; S266-W268 PolarHBondContact O-N 2.88Å
267	D	84.5	Confident	85.2	Confident	120 Å²	120	91.3 Å²	91.3	64%	0.642	50%	0.496	S	S	*	.	S	Bend	trans	-77	3.2	175.5	-64.8	-41.9	0	0	0	112.7	P237 K269	P237-D267 VanDerWaalsContact CG-C 3.47Å; P237-D267 HydrophobicContact CG-CB 3.52Å; P237-D267 WeakPolarHBondContact CG-O 3.32Å; D267-K269 PolarHBondContact O-N 3.18Å
268	W	87.2	Confident	85.3	Confident	21 Å²	21	88 Å²	88	8%	0.08	48%	0.477	C	S	.	.			trans	-72.2	118.8	-179.7	-75.8	99.6	0	0	0	110.4	P237 L240 P262 S266 M285 T288	P237-W268 HydrophobicContact CB-CD2 3.56Å; P237-W268 HydrophobicContact CB-CE3 3.73Å; P237-W268 HydrophobicContact CB-CG 4.1Å; P237-W268 HydrophobicContact CB-CH2 4.03Å; P237-W268 HydrophobicContact CB-CZ2 3.86Å; P237-W268 HydrophobicContact CB-CZ3 3.97Å; P237-W268 HydrophobicContact CG-CD2 4.07Å; P237-W268 HydrophobicContact CG-CG 4.09Å; L240-W268 HydrophobicContact CD1-CH2 4.35Å; L240-W268 HydrophobicContact CD1-CZ3 3.87Å; L240-W268 HydrophobicContact CD2-CH2 4Å; L240-W268 HydrophobicContact CD2-CZ3 4.35Å; P262-W268 HydrophobicContact CB-CB 4.06Å; S266-W268 PolarHBondContact O-N 2.88Å; W268-M285 HydrophobicContact CB-CG 4.41Å; W268-M285 HydrophobicContact CB-SD 3.98Å; W268-M285 HydrophobicContact CD2-CB 3.94Å; W268-M285 HydrophobicContact CD2-CG 3.56Å; W268-M285 HydrophobicContact CD2-SD 4.27Å; W268-M285 HydrophobicContact CE3-CB 3.67Å; W268-M285 HydrophobicContact CE3-CG 3.83Å; W268-M285 HydrophobicContact CG-CG 3.83Å; W268-M285 HydrophobicContact CG-SD 4.03Å; W268-M285 HydrophobicContact CH2-CB 4.17Å; W268-M285 HydrophobicContact CZ2-CB 4.41Å; W268-M285 HydrophobicContact CZ2-CG 4.41Å; W268-M285 HydrophobicContact CZ3-CB 3.79Å; W268-M285 HydrophobicContact CZ3-CG 4.36Å; W268-T288 HydrophobicContact CH2-CG2 4.39Å; W268-T288 HydrophobicContact CZ2-CG2 3.69Å
269	K	85.5	Confident	85.5	Confident	184 Å²	184	87.9 Å²	87.9	80%	0.8	47%	0.474	S	S	*	.			trans	-113.2	104.6	172.5	-63.6	-178	-175.8	179.2	0	108.4	D267	D267-K269 PolarHBondContact O-N 3.18Å
270	L	89.6	Confident	85.8	Confident	48 Å²	48	80.9 Å²	80.9	25%	0.251	44%	0.438	S	S	.	.			trans	-76.8	140.3	173.1	-65.9	174.8	0	0	0	109.4	P262 F278 N282 M285	P262-L270 HydrophobicContact CG-CD1 3.93Å; P262-L270 HydrophobicContact CG-CG 4.33Å; L270-F278 HydrophobicContact CB-CE2 4.2Å; L270-F278 HydrophobicContact CD1-CE2 4.35Å; L270-N282 HydrophobicContact CD2-CB 4.41Å; L270-M285 HydrophobicContact CD1-CE 4.07Å; L270-M285 HydrophobicContact CD1-SD 4.26Å; L270-M285 HydrophobicContact CD2-SD 4.24Å; L270-M285 HydrophobicContact CG-SD 4.35Å
271	P	89.9	Confident	86.1	Confident	33 Å²	33	82.9 Å²	82.9	21%	0.214	45%	0.445	C	S	.	.			trans	-67.4	175.2	169.7	31.9	-35.5	0	0	0	110.3	D275 F278 Y281	P271-D275 HydrophobicContact CB-CB 3.95Å; P271-D275 HydrophobicContact CG-CB 4.39Å; P271-F278 HydrophobicContact CG-CB 4.16Å; P271-F278 HydrophobicContact CG-CD2 4.28Å; P271-F278 VanDerWaalsContact O-CD2 3.24Å; P271-F278 WeakPolarHBondContact O-CD2 3.49Å; P271-Y281 HydrophobicContact CG-CD2 3.96Å; P271-Y281 HydrophobicContact CG-CG 4.24Å
272	S	88.6	Confident	86.5	Confident	76 Å²	76	76.4 Å²	76.4	53%	0.531	42%	0.415	S	S	.	.			trans	-60.9	148	175.6	178.8	0	0	0	0	110.8	N274 D275 F278	S272-N274 PolarHBondContact O-N 3.28Å; S272-N274 VanDerWaalsContact O-N 3.08Å; S272-D275 WeakPolarHBondContact O-CB 3.29Å; S272-D275 PolarHBondContact O-N 2.98Å; S272-F278 WeakPolarHBondContact O-CB 3.25Å
273	C	85.5	Confident	87.2	Confident	90 Å²	90	74.9 Å²	74.9	61%	0.608	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.2	176.4	55	0	0	0	0	114.1	D275	C273-D275 VanDerWaalsContact C-N 3.34Å
274	N	84.7	Confident	88.1	Confident	152 Å²	152	73.4 Å²	73.4	81%	0.813	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.1	176.7	-64	-24.4	0	0	0	113.4	S272	S272-N274 PolarHBondContact O-N 3.28Å; S272-N274 VanDerWaalsContact O-N 3.08Å
275	D	89.1	Confident	89.1	Confident	71 Å²	71	66.8 Å²	66.8	38%	0.38	35%	0.352	S	S	.	.	S	Bend	trans	-78.2	131.8	177.6	-166.5	-45.3	0	0	0	110	P271 S272 C273 T277 F278	P271-D275 HydrophobicContact CB-CB 3.95Å; P271-D275 HydrophobicContact CG-CB 4.39Å; S272-D275 WeakPolarHBondContact O-CB 3.29Å; S272-D275 PolarHBondContact O-N 2.98Å; C273-D275 VanDerWaalsContact C-N 3.34Å; D275-T277 VanDerWaalsContact CG-OG1 3.25Å; D275-T277 PolarHBondContact O-N 3.44Å; D275-T277 WeakPolarHBondContact OD1-CB 3.39Å; D275-T277 PolarHBondContact OD1-N 3.42Å; D275-T277 PolarHBondContact OD1-OG1 3.22Å; D275-F278 WeakPolarHBondContact O-CB 3.48Å; D275-F278 PolarHBondContact O-N 3.44Å
276	A	87.8	Confident	90.1	Very high	97 Å²	97	56.2 Å²	56.2	80%	0.802	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.6	177	0	0	0	0	0	113
277	T	90.5	Very high	90.9	Very high	61 Å²	61	55 Å²	55	37%	0.374	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.7	177.3	64.7	0	0	0	0	113.6	D275 K279 A280 Y281	D275-T277 VanDerWaalsContact CG-OG1 3.25Å; D275-T277 PolarHBondContact O-N 3.44Å; D275-T277 WeakPolarHBondContact OD1-CB 3.39Å; D275-T277 PolarHBondContact OD1-N 3.42Å; D275-T277 PolarHBondContact OD1-OG1 3.22Å; T277-K279 PolarHBondContact O-N 3.37Å; T277-A280 PolarHBondContact O-N 2.69Å; T277-Y281 WeakPolarHBondContact O-CD2 3.36Å; T277-Y281 PolarHBondContact O-N 2.95Å
278	F	92.8	Very high	91.4	Very high	54 Å²	54	49.3 Å²	49.3	24%	0.237	27%	0.274	C	S	.	.	H	α-helix	trans	-54.5	-48.8	-176.7	177.3	-102.5	0	0	0	113	L270 P271 S272 D275 A280 Y281 N282	L270-F278 HydrophobicContact CB-CE2 4.2Å; L270-F278 HydrophobicContact CD1-CE2 4.35Å; P271-F278 HydrophobicContact CG-CB 4.16Å; P271-F278 HydrophobicContact CG-CD2 4.28Å; P271-F278 VanDerWaalsContact O-CD2 3.24Å; P271-F278 WeakPolarHBondContact O-CD2 3.49Å; S272-F278 WeakPolarHBondContact O-CB 3.25Å; D275-F278 WeakPolarHBondContact O-CB 3.48Å; D275-F278 PolarHBondContact O-N 3.44Å; F278-A280 VanDerWaalsContact C-N 3.28Å; F278-A280 PolarHBondContact O-N 3.17Å; F278-Y281 PolarHBondContact O-N 2.85Å; F278-N282 HydrophobicContact CE1-CB 4.31Å; F278-N282 HydrophobicContact CZ-CB 4.35Å; F278-N282 VanDerWaalsContact O-CB 3.26Å; F278-N282 WeakPolarHBondContact O-CB 3.27Å; F278-N282 PolarHBondContact O-N 2.98Å
279	K	92.4	Very high	91.6	Very high	40 Å²	40	48.4 Å²	48.4	17%	0.174	27%	0.27	C	S	.	.	H	α-helix	trans	-53.7	-47	177	177.5	175.7	167.6	166.9	0	111.4	V193 Y252 T277 Y281 N282 I283 D397	V193-K279 VanDerWaalsContact CG1-CE 3.45Å; Y252-K279 WeakPolarHBondContact OH-CE 3.33Å; Y252-K279 PolarHBondContact OH-NZ 3.12Å; T277-K279 PolarHBondContact O-N 3.37Å; K279-Y281 PolarHBondContact O-N 3.31Å; K279-N282 PolarHBondContact O-N 3.19Å; K279-I283 HydrophobicContact CG-CG1 4.4Å; K279-I283 WeakPolarHBondContact O-CG1 3.31Å; K279-I283 PolarHBondContact O-N 3.42Å; K279-D397 WeakPolarHBondContact CE-OD2 3.28Å; K279-D397 IonicContact NZ-OD1 3.99Å; K279-D397 PolarHBondContact NZ-OD1 2.92Å; K279-D397 IonicContact NZ-OD2 3.13Å; K279-D397 PolarHBondContact NZ-OD2 3.13Å
280	A	94.1	Very high	92	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-38.1	-178.3	0	0	0	0	0	113.3	Y194 C195 M196 T277 F278 G284	Y194-A280 WeakPolarHBondContact O-CA 3.45Å; Y194-A280 WeakPolarHBondContact O-CB 3.39Å; C195-A280 WeakPolarHBondContact CA-O 3.43Å; M196-A280 HydrophobicContact CG-CB 4.12Å; M196-A280 PolarHBondContact N-O 2.91Å; T277-A280 PolarHBondContact O-N 2.69Å; F278-A280 VanDerWaalsContact C-N 3.28Å; F278-A280 PolarHBondContact O-N 3.17Å; A280-G284 WeakPolarHBondContact O-CA 3.48Å; A280-G284 PolarHBondContact O-N 3.09Å; A280-G284 VanDerWaalsContact O-N 3.07Å
281	Y	94.7	Very high	92.2	Very high	65 Å²	65	37.3 Å²	37.3	26%	0.255	22%	0.22	S	C	.	.	H	α-helix	trans	-69.8	-41.1	173.5	-86.4	-86.7	0	0	0	112.3	M196 L240 P271 T277 F278 K279 M285	M196-Y281 HydrophobicContact CB-CD1 4.05Å; M196-Y281 HydrophobicContact CB-CD2 4.44Å; M196-Y281 HydrophobicContact CB-CE1 4.17Å; M196-Y281 HydrophobicContact CB-CG 4.19Å; M196-Y281 HydrophobicContact CE-CE2 4.36Å; M196-Y281 HydrophobicContact CG-CD1 4.14Å; M196-Y281 HydrophobicContact CG-CD2 3.68Å; M196-Y281 HydrophobicContact CG-CE1 4.14Å; M196-Y281 HydrophobicContact CG-CE2 3.66Å; M196-Y281 HydrophobicContact CG-CG 3.92Å; M196-Y281 HydrophobicContact SD-CE2 4.45Å; L240-Y281 HydrophobicContact CD1-CD1 4.25Å; L240-Y281 HydrophobicContact CD1-CE1 3.77Å; P271-Y281 HydrophobicContact CG-CD2 3.96Å; P271-Y281 HydrophobicContact CG-CG 4.24Å; T277-Y281 WeakPolarHBondContact O-CD2 3.36Å; T277-Y281 PolarHBondContact O-N 2.95Å; F278-Y281 PolarHBondContact O-N 2.85Å; K279-Y281 PolarHBondContact O-N 3.31Å; Y281-M285 WeakPolarHBondContact O-CB 3.44Å; Y281-M285 PolarHBondContact O-N 3.05Å
282	N	93.9	Very high	92.2	Very high	18 Å²	18	36.3 Å²	36.3	10%	0.096	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-55.8	-177.2	-170.8	-11.5	0	0	0	111.3	L270 F278 K279 G284 M285 R286	L270-N282 HydrophobicContact CD2-CB 4.41Å; F278-N282 HydrophobicContact CE1-CB 4.31Å; F278-N282 HydrophobicContact CZ-CB 4.35Å; F278-N282 VanDerWaalsContact O-CB 3.26Å; F278-N282 WeakPolarHBondContact O-CB 3.27Å; F278-N282 PolarHBondContact O-N 2.98Å; K279-N282 PolarHBondContact O-N 3.19Å; N282-G284 VanDerWaalsContact C-N 3.32Å; N282-G284 PolarHBondContact O-N 3.32Å; N282-M285 WeakPolarHBondContact O-CB 3.17Å; N282-M285 PolarHBondContact O-N 2.92Å; N282-R286 PolarHBondContact ND2-NH2 3.49Å; N282-R286 WeakPolarHBondContact O-CG 3.39Å; N282-R286 PolarHBondContact O-N 3.14Å; N282-R286 PolarHBondContact OD1-NE 3.03Å; N282-R286 PolarHBondContact OD1-NH1 3.08Å; N282-R286 PolarHBondContact OD1-NH2 2.93Å
283	I	95.6	Very high	92.2	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-40.5	177.4	-57.8	-61.9	0	0	0	110.5	V193 F247 Y252 L255 A256 K279 M285 R286 V287	V193-I283 HydrophobicContact CG2-CG2 4.29Å; F247-I283 HydrophobicContact CZ-CG2 4.15Å; Y252-I283 HydrophobicContact CE2-CD1 4.05Å; Y252-I283 HydrophobicContact CE2-CG1 4.12Å; L255-I283 HydrophobicContact CB-CD1 4.23Å; L255-I283 HydrophobicContact CD1-CG2 4.09Å; A256-I283 HydrophobicContact CB-CD1 4.33Å; K279-I283 HydrophobicContact CG-CG1 4.4Å; K279-I283 WeakPolarHBondContact O-CG1 3.31Å; K279-I283 PolarHBondContact O-N 3.42Å; I283-M285 VanDerWaalsContact C-N 3.35Å; I283-M285 PolarHBondContact O-N 3.23Å; I283-R286 PolarHBondContact O-N 2.92Å; I283-V287 HydrophobicContact CG2-CG2 4.3Å; I283-V287 VanDerWaalsContact O-CG2 3.32Å; I283-V287 WeakPolarHBondContact O-CG2 3.35Å; I283-V287 PolarHBondContact O-N 3.16Å
284	G	95.8	Very high	92.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-40.4	176.3	0	0	0	0	0	113.6	M196 L197 A280 N282 T288	M196-G284 WeakPolarHBondContact O-CA 3.47Å; L197-G284 VanDerWaalsContact CD2-O 3.31Å; L197-G284 WeakPolarHBondContact CD2-O 2.96Å; A280-G284 WeakPolarHBondContact O-CA 3.48Å; A280-G284 PolarHBondContact O-N 3.09Å; A280-G284 VanDerWaalsContact O-N 3.07Å; N282-G284 VanDerWaalsContact C-N 3.32Å; N282-G284 PolarHBondContact O-N 3.32Å; G284-T288 WeakPolarHBondContact O-CB 3.23Å; G284-T288 PolarHBondContact O-N 2.91Å; G284-T288 PolarHBondContact O-OG1 3.49Å
285	M	94.4	Very high	92.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-50.4	172.6	175.5	-171.4	73.3	0	0	111	F260 P262 W268 L270 Y281 N282 I283 V287 T288 I289	F260-M285 HydrophobicContact CD1-CE 3.85Å; F260-M285 HydrophobicContact CE1-CE 3.94Å; P262-M285 HydrophobicContact CB-CE 4.5Å; P262-M285 HydrophobicContact CB-SD 3.65Å; P262-M285 HydrophobicContact CG-SD 4.21Å; W268-M285 HydrophobicContact CB-CG 4.41Å; W268-M285 HydrophobicContact CB-SD 3.98Å; W268-M285 HydrophobicContact CD2-CB 3.94Å; W268-M285 HydrophobicContact CD2-CG 3.56Å; W268-M285 HydrophobicContact CD2-SD 4.27Å; W268-M285 HydrophobicContact CE3-CB 3.67Å; W268-M285 HydrophobicContact CE3-CG 3.83Å; W268-M285 HydrophobicContact CG-CG 3.83Å; W268-M285 HydrophobicContact CG-SD 4.03Å; W268-M285 HydrophobicContact CH2-CB 4.17Å; W268-M285 HydrophobicContact CZ2-CB 4.41Å; W268-M285 HydrophobicContact CZ2-CG 4.41Å; W268-M285 HydrophobicContact CZ3-CB 3.79Å; W268-M285 HydrophobicContact CZ3-CG 4.36Å; L270-M285 HydrophobicContact CD1-CE 4.07Å; L270-M285 HydrophobicContact CD1-SD 4.26Å; L270-M285 HydrophobicContact CD2-SD 4.24Å; L270-M285 HydrophobicContact CG-SD 4.35Å; Y281-M285 WeakPolarHBondContact O-CB 3.44Å; Y281-M285 PolarHBondContact O-N 3.05Å; N282-M285 WeakPolarHBondContact O-CB 3.17Å; N282-M285 PolarHBondContact O-N 2.92Å; I283-M285 VanDerWaalsContact C-N 3.35Å; I283-M285 PolarHBondContact O-N 3.23Å; M285-V287 PolarHBondContact O-N 2.76Å; M285-T288 PolarHBondContact O-N 3.1Å; M285-T288 VanDerWaalsContact O-N 3.11Å; M285-I289 HydrophobicContact CG-CD1 3.77Å; M285-I289 HydrophobicContact CG-CG1 4.39Å; M285-I289 VanDerWaalsContact O-CG1 3.32Å; M285-I289 WeakPolarHBondContact O-CG1 3.08Å; M285-I289 PolarHBondContact O-N 3.24Å; M285-I289 HydrophobicContact SD-CD1 4.42Å
286	R	95.3	Very high	92.3	Very high	14 Å²	14	19.5 Å²	19.5	5%	0.053	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-43.6	-178.6	-66	177.3	179.4	153.5	1.7	111.9	F219 L255 A256 D258 F260 N282 I283 T288 I289 G290	F219-R286 HydrophobicContact CD2-CB 4.25Å; F219-R286 WeakPolarHBondContact CD2-O 3.4Å; F219-R286 HydrophobicContact CE1-CB 4.18Å; F219-R286 HydrophobicContact CE1-CG 4.21Å; F219-R286 HydrophobicContact CE2-CB 3.82Å; F219-R286 HydrophobicContact CE2-CG 3.86Å; F219-R286 HydrophobicContact CZ-CB 3.79Å; F219-R286 HydrophobicContact CZ-CG 3.54Å; L255-R286 HydrophobicContact CD2-CB 4.1Å; L255-R286 VanDerWaalsContact O-CD 3.28Å; L255-R286 WeakPolarHBondContact O-CD 3.43Å; L255-R286 PolarHBondContact O-NH1 3.35Å; A256-R286 PolarHBondContact O-NH1 3.34Å; D258-R286 VanDerWaalsContact O-CZ 3.32Å; D258-R286 PolarHBondContact O-NH2 3.03Å; F260-R286 HydrophobicContact CD1-CG 4.47Å; F260-R286 PolarHBondContact O-NH2 3.41Å; N282-R286 PolarHBondContact ND2-NH2 3.49Å; N282-R286 WeakPolarHBondContact O-CG 3.39Å; N282-R286 PolarHBondContact O-N 3.14Å; N282-R286 PolarHBondContact OD1-NE 3.03Å; N282-R286 PolarHBondContact OD1-NH1 3.08Å; N282-R286 PolarHBondContact OD1-NH2 2.93Å; I283-R286 PolarHBondContact O-N 2.92Å; R286-T288 VanDerWaalsContact C-N 3.35Å; R286-T288 PolarHBondContact O-N 3.45Å; R286-I289 PolarHBondContact O-N 3.47Å; R286-G290 PolarHBondContact O-N 2.92Å
287	V	96.4	Very high	91.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.4	-45.5	173	171	0	0	0	0	111.2	L197 L205 I212 F247 L255 I283 M285 I289 G290 F291	L197-V287 HydrophobicContact CD2-CB 4.06Å; L197-V287 HydrophobicContact CD2-CG1 3.9Å; L205-V287 HydrophobicContact CD1-CG1 4.37Å; I212-V287 HydrophobicContact CD1-CB 4.48Å; I212-V287 HydrophobicContact CD1-CG1 3.68Å; I212-V287 HydrophobicContact CD1-CG2 3.93Å; F247-V287 HydrophobicContact CE1-CG2 4.01Å; F247-V287 HydrophobicContact CZ-CG2 3.86Å; L255-V287 HydrophobicContact CD1-CG2 3.61Å; I283-V287 HydrophobicContact CG2-CG2 4.3Å; I283-V287 VanDerWaalsContact O-CG2 3.32Å; I283-V287 WeakPolarHBondContact O-CG2 3.35Å; I283-V287 PolarHBondContact O-N 3.16Å; M285-V287 PolarHBondContact O-N 2.76Å; V287-I289 PolarHBondContact O-N 3.36Å; V287-G290 PolarHBondContact O-N 3.39Å; V287-F291 HydrophobicContact CG1-CD2 3.8Å; V287-F291 HydrophobicContact CG1-CE2 3.68Å; V287-F291 VanDerWaalsContact O-CD2 3.29Å; V287-F291 WeakPolarHBondContact O-CD2 3.43Å; V287-F291 PolarHBondContact O-N 3.1Å
288	T	95	Very high	91.3	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-63.9	-42.8	-179.9	-56	0	0	0	0	111.7	P198 L201 F235 W268 G284 M285 R286 G290 F291 E292	P198-T288 WeakPolarHBondContact CD-OG1 3.45Å; P198-T288 HydrophobicContact CG-CG2 3.93Å; L201-T288 HydrophobicContact CD1-CG2 3.82Å; F235-T288 HydrophobicContact CB-CG2 3.7Å; W268-T288 HydrophobicContact CH2-CG2 4.39Å; W268-T288 HydrophobicContact CZ2-CG2 3.69Å; G284-T288 WeakPolarHBondContact O-CB 3.23Å; G284-T288 PolarHBondContact O-N 2.91Å; G284-T288 PolarHBondContact O-OG1 3.49Å; M285-T288 PolarHBondContact O-N 3.1Å; M285-T288 VanDerWaalsContact O-N 3.11Å; R286-T288 VanDerWaalsContact C-N 3.35Å; R286-T288 PolarHBondContact O-N 3.45Å; T288-G290 VanDerWaalsContact C-N 3.32Å; T288-G290 PolarHBondContact O-N 2.91Å; T288-F291 PolarHBondContact O-N 3.36Å; T288-E292 WeakPolarHBondContact O-CG 3.4Å; T288-E292 PolarHBondContact O-N 3.48Å
289	I	91.9	Very high	90.3	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-60	-43.7	173.9	-71.2	174.1	0	0	0	110.3	F219 F230 F260 M285 R286 V287 F291 E292 L293	F219-I289 HydrophobicContact CD2-CB 4.12Å; F219-I289 HydrophobicContact CD2-CG2 3.66Å; F219-I289 HydrophobicContact CE2-CB 4.41Å; F219-I289 HydrophobicContact CE2-CG2 3.98Å; F230-I289 HydrophobicContact CE1-CB 4.28Å; F230-I289 HydrophobicContact CE1-CG1 3.82Å; F230-I289 HydrophobicContact CE1-CG2 4.28Å; F230-I289 HydrophobicContact CE2-CG2 4.19Å; F230-I289 HydrophobicContact CZ-CB 3.98Å; F230-I289 HydrophobicContact CZ-CG1 3.9Å; F230-I289 HydrophobicContact CZ-CG2 3.5Å; F260-I289 HydrophobicContact CD1-CD1 4.47Å; F260-I289 HydrophobicContact CE1-CD1 3.39Å; F260-I289 HydrophobicContact CZ-CD1 3.7Å; M285-I289 HydrophobicContact CG-CD1 3.77Å; M285-I289 HydrophobicContact CG-CG1 4.39Å; M285-I289 VanDerWaalsContact O-CG1 3.32Å; M285-I289 WeakPolarHBondContact O-CG1 3.08Å; M285-I289 PolarHBondContact O-N 3.24Å; M285-I289 HydrophobicContact SD-CD1 4.42Å; R286-I289 PolarHBondContact O-N 3.47Å; V287-I289 PolarHBondContact O-N 3.36Å; I289-F291 VanDerWaalsContact C-N 3.34Å; I289-F291 PolarHBondContact O-N 3.48Å; I289-E292 WeakPolarHBondContact O-CB 3.23Å; I289-E292 PolarHBondContact O-N 3.3Å; I289-E292 VanDerWaalsContact O-N 3.15Å; I289-L293 HydrophobicContact CG2-CD1 3.95Å; I289-L293 HydrophobicContact CG2-CG 4.49Å; I289-L293 VanDerWaalsContact O-CG 3.3Å; I289-L293 WeakPolarHBondContact O-CG 3.26Å; I289-L293 PolarHBondContact O-N 2.83Å
290	G	93	Very high	88.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.3	-45.9	174.3	0	0	0	0	0	113.1	A215 R286 V287 T288 E292 L293 L294	A215-G290 WeakPolarHBondContact O-CA 3.47Å; R286-G290 PolarHBondContact O-N 2.92Å; V287-G290 PolarHBondContact O-N 3.39Å; T288-G290 VanDerWaalsContact C-N 3.32Å; T288-G290 PolarHBondContact O-N 2.91Å; G290-E292 PolarHBondContact O-N 3.14Å; G290-L293 PolarHBondContact O-N 3.37Å; G290-L294 VanDerWaalsContact O-CB 3.27Å; G290-L294 WeakPolarHBondContact O-CB 3.39Å; G290-L294 PolarHBondContact O-N 3.12Å
291	F	93.9	Very high	87	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.1	-34	175.3	-82.9	-68.2	0	0	0	113.6	L201 L204 L205 A211 I212 A215 F235 V287 T288 I289 L294 C295 V366	L201-F291 HydrophobicContact CD1-CB 3.92Å; L201-F291 HydrophobicContact CD1-CD2 3.86Å; L201-F291 HydrophobicContact CD1-CG 4.12Å; L201-F291 HydrophobicContact CD2-CB 3.91Å; L201-F291 HydrophobicContact CD2-CD1 4.14Å; L201-F291 HydrophobicContact CD2-CD2 3.95Å; L201-F291 HydrophobicContact CD2-CG 3.73Å; L201-F291 HydrophobicContact CG-CD2 4.41Å; L204-F291 HydrophobicContact CD2-CD1 4.27Å; L204-F291 HydrophobicContact CD2-CE1 3.65Å; L204-F291 HydrophobicContact CD2-CZ 4.09Å; L205-F291 HydrophobicContact CD1-CE2 4.22Å; L205-F291 HydrophobicContact CD2-CE2 4.19Å; L205-F291 HydrophobicContact CD2-CZ 3.89Å; L205-F291 HydrophobicContact CG-CE2 4.31Å; L205-F291 HydrophobicContact CG-CZ 4.31Å; A211-F291 HydrophobicContact CB-CE1 4.22Å; A211-F291 HydrophobicContact CB-CZ 4.22Å; A211-F291 WeakPolarHBondContact O-CZ 3.16Å; I212-F291 HydrophobicContact CD1-CE2 4.49Å; A215-F291 HydrophobicContact CB-CD1 3.85Å; A215-F291 HydrophobicContact CB-CD2 3.7Å; A215-F291 HydrophobicContact CB-CE1 3.77Å; A215-F291 HydrophobicContact CB-CE2 3.62Å; A215-F291 HydrophobicContact CB-CG 3.81Å; A215-F291 HydrophobicContact CB-CZ 3.66Å; F235-F291 HydrophobicContact CD2-CB 4.3Å; F235-F291 HydrophobicContact CE2-CB 4.1Å; V287-F291 HydrophobicContact CG1-CD2 3.8Å; V287-F291 HydrophobicContact CG1-CE2 3.68Å; V287-F291 VanDerWaalsContact O-CD2 3.29Å; V287-F291 WeakPolarHBondContact O-CD2 3.43Å; V287-F291 PolarHBondContact O-N 3.1Å; T288-F291 PolarHBondContact O-N 3.36Å; I289-F291 VanDerWaalsContact C-N 3.34Å; I289-F291 PolarHBondContact O-N 3.48Å; F291-L294 HydrophobicContact CD1-CD2 4.42Å; F291-C295 WeakPolarHBondContact O-CB 3.14Å; F291-C295 PolarHBondContact O-N 2.92Å; F291-C295 PolarHBondContact O-SG 2.69Å; F291-V366 HydrophobicContact CD1-CG1 4.04Å; F291-V366 HydrophobicContact CE1-CG1 4.01Å
292	E	91.2	Very high	84.9	Confident	11 Å²	11	31 Å²	31	5%	0.051	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-47.6	174.3	-73.7	-73.6	-154.1	0	0	112	F230 P233 R234 F235 T288 I289 G290 L294 C295 A296	F230-E292 HydrophobicContact CE1-CB 3.89Å; F230-E292 HydrophobicContact CE1-CG 4.04Å; F230-E292 HydrophobicContact CZ-CB 4.14Å; P233-E292 WeakPolarHBondContact CA-OE1 3.41Å; P233-E292 WeakPolarHBondContact CB-OE1 3.29Å; R234-E292 VanDerWaalsContact CB-OE2 3.27Å; R234-E292 WeakPolarHBondContact CB-OE2 3.43Å; R234-E292 VanDerWaalsContact N-CD 3.32Å; R234-E292 PolarHBondContact N-OE1 2.86Å; R234-E292 PolarHBondContact N-OE2 2.74Å; R234-E292 VanDerWaalsContact N-OE2 3.17Å; F235-E292 WeakPolarHBondContact CA-OE1 3.41Å; F235-E292 HydrophobicContact CB-CG 4.42Å; F235-E292 HydrophobicContact CD2-CG 3.9Å; F235-E292 PolarHBondContact N-OE1 2.92Å; T288-E292 WeakPolarHBondContact O-CG 3.4Å; T288-E292 PolarHBondContact O-N 3.48Å; I289-E292 WeakPolarHBondContact O-CB 3.23Å; I289-E292 PolarHBondContact O-N 3.3Å; I289-E292 VanDerWaalsContact O-N 3.15Å; G290-E292 PolarHBondContact O-N 3.14Å; E292-L294 VanDerWaalsContact C-N 3.32Å; E292-L294 PolarHBondContact O-N 2.81Å; E292-C295 PolarHBondContact O-N 3.04Å; E292-A296 PolarHBondContact O-N 3.17Å
293	L	88.1	Confident	82.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-44.8	177.3	-67.4	168.1	0	0	0	110.5	A218 R222 M227 F230 I289 G290 C295 A296 Q297	A218-L293 HydrophobicContact CB-CB 4.17Å; A218-L293 WeakPolarHBondContact O-CD1 3.23Å; R222-L293 HydrophobicContact CB-CD1 3.76Å; M227-L293 HydrophobicContact SD-CD2 4.38Å; F230-L293 HydrophobicContact CE2-CD2 4.4Å; F230-L293 HydrophobicContact CZ-CG 4.45Å; I289-L293 HydrophobicContact CG2-CD1 3.95Å; I289-L293 HydrophobicContact CG2-CG 4.49Å; I289-L293 VanDerWaalsContact O-CG 3.3Å; I289-L293 WeakPolarHBondContact O-CG 3.26Å; I289-L293 PolarHBondContact O-N 2.83Å; G290-L293 PolarHBondContact O-N 3.37Å; L293-C295 VanDerWaalsContact C-N 3.35Å; L293-C295 PolarHBondContact O-N 2.65Å; L293-A296 WeakPolarHBondContact O-CB 3.39Å; L293-A296 PolarHBondContact O-N 2.6Å; L293-A296 VanDerWaalsContact O-N 3.13Å; L293-Q297 WeakPolarHBondContact O-CG 3.44Å; L293-Q297 PolarHBondContact O-N 3.17Å
294	L	89.3	Confident	79.8	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.1	176.6	-171.1	67.5	0	0	0	111.9	P214 A218 G290 F291 E292 A296 Q297 A298 A363 V366	P214-L294 HydrophobicContact CB-CD1 4.16Å; P214-L294 HydrophobicContact CB-CD2 3.95Å; P214-L294 HydrophobicContact CG-CD2 4.22Å; A218-L294 HydrophobicContact CB-CB 4.03Å; A218-L294 HydrophobicContact CB-CD1 4.32Å; G290-L294 VanDerWaalsContact O-CB 3.27Å; G290-L294 WeakPolarHBondContact O-CB 3.39Å; G290-L294 PolarHBondContact O-N 3.12Å; F291-L294 HydrophobicContact CD1-CD2 4.42Å; E292-L294 VanDerWaalsContact C-N 3.32Å; E292-L294 PolarHBondContact O-N 2.81Å; L294-A296 VanDerWaalsContact C-N 3.34Å; L294-A296 PolarHBondContact O-N 3.32Å; L294-Q297 PolarHBondContact O-N 2.94Å; L294-A298 PolarHBondContact O-N 3.42Å; L294-A363 HydrophobicContact CD1-CB 3.8Å; L294-A363 HydrophobicContact CG-CB 4.19Å; L294-A363 VanDerWaalsContact O-CB 3.26Å; L294-A363 WeakPolarHBondContact O-CB 3.17Å; L294-V366 HydrophobicContact CD2-CB 3.98Å; L294-V366 HydrophobicContact CD2-CG1 4.08Å; L294-V366 HydrophobicContact CD2-CG2 3.83Å
295	C	88.2	Confident	77	Confident	4 Å²	4	48.9 Å²	48.9	3%	0.027	26%	0.262	C	S	.	.	H	α-helix	trans	-68.1	-32.2	175.4	-70.5	0	0	0	0	112.9	F291 E292 L293 A298 V367	F291-C295 WeakPolarHBondContact O-CB 3.14Å; F291-C295 PolarHBondContact O-N 2.92Å; F291-C295 PolarHBondContact O-SG 2.69Å; E292-C295 PolarHBondContact O-N 3.04Å; L293-C295 VanDerWaalsContact C-N 3.35Å; L293-C295 PolarHBondContact O-N 2.65Å; C295-A298 PolarHBondContact O-N 2.95Å; C295-V367 HydrophobicContact CB-CG2 4.1Å
296	A	83.8	Confident	74.3	Confident	26 Å²	26	51.9 Å²	51.9	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-43.9	175.7	0	0	0	0	0	111	C229 E292 L293 L294 A298 R299 D300	C229-A296 HydrophobicContact CB-CB 4.11Å; E292-A296 PolarHBondContact O-N 3.17Å; L293-A296 WeakPolarHBondContact O-CB 3.39Å; L293-A296 PolarHBondContact O-N 2.6Å; L293-A296 VanDerWaalsContact O-N 3.13Å; L294-A296 VanDerWaalsContact C-N 3.34Å; L294-A296 PolarHBondContact O-N 3.32Å; A296-A298 VanDerWaalsContact C-N 3.26Å; A296-A298 PolarHBondContact O-N 2.8Å; A296-R299 WeakPolarHBondContact O-CB 3.28Å; A296-R299 PolarHBondContact O-N 2.74Å; A296-R299 VanDerWaalsContact O-N 3.1Å; A296-D300 PolarHBondContact O-N 3.18Å
297	Q	80.2	Confident	71.4	Confident	81 Å²	81	58 Å²	58	38%	0.379	31%	0.314	S	S	.	.	H	α-helix	trans	-57.8	-36.9	175.7	-69	171.1	-6	0	0	112.6	L293 L294 R299 D300 A301 A363	L293-Q297 WeakPolarHBondContact O-CG 3.44Å; L293-Q297 PolarHBondContact O-N 3.17Å; L294-Q297 PolarHBondContact O-N 2.94Å; Q297-R299 VanDerWaalsContact C-N 3.33Å; Q297-R299 PolarHBondContact O-N 3.33Å; Q297-D300 PolarHBondContact O-N 3.23Å; Q297-A301 PolarHBondContact O-N 2.98Å; Q297-A301 VanDerWaalsContact O-N 3.14Å; Q297-A363 HydrophobicContact CB-CB 4.07Å
298	A	77.5	Confident	68.5	Low	4 Å²	4	67.3 Å²	67.3	3%	0.033	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-36	177.9	0	0	0	0	0	112.9	L294 C295 A296 D300 A301 E302 A363 V364 V367	L294-A298 PolarHBondContact O-N 3.42Å; C295-A298 PolarHBondContact O-N 2.95Å; A296-A298 VanDerWaalsContact C-N 3.26Å; A296-A298 PolarHBondContact O-N 2.8Å; A298-D300 VanDerWaalsContact C-N 3.26Å; A298-D300 PolarHBondContact O-N 2.9Å; A298-A301 PolarHBondContact O-N 3.06Å; A298-A301 VanDerWaalsContact O-N 3.14Å; A298-E302 PolarHBondContact O-N 2.82Å; A298-E302 VanDerWaalsContact O-N 3.16Å; A298-A363 HydrophobicContact CB-CB 3.9Å; A298-V364 HydrophobicContact CB-CG2 4.44Å; A298-V367 HydrophobicContact CB-CB 4.22Å; A298-V367 HydrophobicContact CB-CG2 3.59Å
299	R	70.8	Confident	66	Low	161 Å²	161	71.6 Å²	71.6	61%	0.608	38%	0.377	S	S	*	.	H	α-helix	trans	-65.7	-33.5	179	-66.8	-176.9	-177.2	-179.1	4	111.7	A296 Q297 A301	A296-R299 WeakPolarHBondContact O-CB 3.28Å; A296-R299 PolarHBondContact O-N 2.74Å; A296-R299 VanDerWaalsContact O-N 3.1Å; Q297-R299 VanDerWaalsContact C-N 3.33Å; Q297-R299 PolarHBondContact O-N 3.33Å; R299-A301 VanDerWaalsContact C-N 3.35Å
300	D	61	Low	63.5	Low	137 Å²	137	75.6 Å²	75.6	73%	0.733	41%	0.405	S	S	*	.	H	α-helix	trans	-74.9	-29.2	175.3	-62.3	-28	0	0	0	111.4	A296 Q297 A298	A296-D300 PolarHBondContact O-N 3.18Å; Q297-D300 PolarHBondContact O-N 3.23Å; A298-D300 VanDerWaalsContact C-N 3.26Å; A298-D300 PolarHBondContact O-N 2.9Å
301	A	57.5	Low	61.3	Low	36 Å²	36	78.2 Å²	78.2	30%	0.298	42%	0.424	S	S	.	.	H	α-helix	trans	-84.5	-10.6	-178.1	0	0	0	0	0	115.4	Q297 A298 R299 F303 V304 V364	Q297-A301 PolarHBondContact O-N 2.98Å; Q297-A301 VanDerWaalsContact O-N 3.14Å; A298-A301 PolarHBondContact O-N 3.06Å; A298-A301 VanDerWaalsContact O-N 3.14Å; R299-A301 VanDerWaalsContact C-N 3.35Å; A301-F303 PolarHBondContact O-N 3.47Å; A301-V304 PolarHBondContact O-N 2.94Å; A301-V304 VanDerWaalsContact O-N 3.16Å; A301-V364 HydrophobicContact CB-CG2 4.21Å
302	E	49.6	Very low	59.1	Low	145 Å²	145	86.3 Å²	86.3	68%	0.678	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-3.8	-178.3	-88.3	-175.3	169.9	0	0	114.9	A298	A298-E302 PolarHBondContact O-N 2.82Å; A298-E302 VanDerWaalsContact O-N 3.16Å
303	F	43.8	Very low	57.7	Low	204 Å²	204	87.8 Å²	87.8	90%	0.895	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.4	172.5	-99.8	-86.8	0	0	0	115.7	A301	A301-F303 PolarHBondContact O-N 3.47Å
304	V	38.7	Very low	57.1	Low	119 Å²	119	91.7 Å²	91.7	72%	0.721	50%	0.501	S	S	*	.	S	Bend	trans	-106.2	103.4	179.8	-171.2	0	0	0	0	110.3	A301 V306	A301-V304 PolarHBondContact O-N 2.94Å; A301-V304 VanDerWaalsContact O-N 3.16Å; V304-V306 PolarHBondContact O-N 2.88Å; V304-V306 VanDerWaalsContact O-N 3.16Å
305	G	36.8	Very low	56.4	Low	75 Å²	75	93.8 Å²	93.8	77%	0.773	51%	0.511	S	S	*	.			trans	-55.6	115	-175.3	0	0	0	0	0	112.8	N307	G305-N307 PolarHBondContact O-N 2.78Å
306	V	39.3	Very low	56	Low	63 Å²	63	94.3 Å²	94.3	38%	0.382	51%	0.513	S	S	.	.			trans	-79.6	113.2	177.8	179.7	0	0	0	0	110.2	V304 K308 R368	V304-V306 PolarHBondContact O-N 2.88Å; V304-V306 VanDerWaalsContact O-N 3.16Å; V306-K308 PolarHBondContact O-N 2.73Å; V306-R368 VanDerWaalsContact CB-NH2 3.26Å
307	N	33.5	Very low	55.9	Low	142 Å²	142	98.1 Å²	98.1	76%	0.759	53%	0.526	S	S	*	.			trans	-64.2	125	174.4	-116.3	-15	0	0	0	110.4	G305 L309	G305-N307 PolarHBondContact O-N 2.78Å; N307-L309 PolarHBondContact O-N 2.7Å
308	K	36.4	Very low	56	Low	196 Å²	196	101.2 Å²	101.2	85%	0.852	53%	0.534	S	S	*	.			trans	-78	88.5	-179.3	-151.3	176.8	-166.9	176.8	0	107.8	V306 S310	V306-K308 PolarHBondContact O-N 2.73Å; K308-S310 PolarHBondContact O-N 3Å
309	L	41	Very low	56.2	Low	91 Å²	91	101 Å²	101	48%	0.476	53%	0.533	S	S	.	.			trans	-66.1	108.3	168.2	-168.9	69.4	0	0	0	107.9	N307 S311	N307-L309 PolarHBondContact O-N 2.7Å; L309-S311 PolarHBondContact O-N 3.2Å
310	S	40.8	Very low	56.8	Low	85 Å²	85	94.1 Å²	94.1	59%	0.594	51%	0.508	S	S	*	.			trans	-54.1	122.9	-178.9	-63.8	0	0	0	0	110.2	K308 E312 S313	K308-S310 PolarHBondContact O-N 3Å; S310-E312 PolarHBondContact O-N 3.23Å; S310-S313 PolarHBondContact O-N 3.45Å
311	S	45	Very low	58	Low	56 Å²	56	91 Å²	91	39%	0.392	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	26.1	174	-57.8	0	0	0	0	113.8	L309	L309-S311 PolarHBondContact O-N 3.2Å
312	E	49	Very low	59.3	Low	170 Å²	170	90.5 Å²	90.5	79%	0.794	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	19.6	-177.2	-66.4	-173.8	165.6	0	0	111.9	S310	S310-E312 PolarHBondContact O-N 3.23Å
313	S	61.4	Low	61	Low	41 Å²	41	83.7 Å²	83.7	29%	0.287	46%	0.455	S	S	.	.			trans	-66.8	144	170.4	88.5	0	0	0	0	110	S310 L315 W316 Q317	S310-S313 PolarHBondContact O-N 3.45Å; S313-L315 PolarHBondContact O-N 2.75Å; S313-L315 VanDerWaalsContact O-N 3.12Å; S313-L315 WeakPolarHBondContact OG-CB 3.3Å; S313-L315 PolarHBondContact OG-N 2.71Å; S313-W316 WeakPolarHBondContact O-CB 3.25Å; S313-W316 PolarHBondContact O-N 3.24Å; S313-W316 PolarHBondContact OG-N 3.28Å; S313-W316 VanDerWaalsContact OG-N 3.17Å; S313-Q317 PolarHBondContact O-N 3.22Å
314	S	74.8	Confident	63	Low	85 Å²	85	78.6 Å²	78.6	59%	0.594	43%	0.432	S	S	*	.	H	α-helix	trans	-57.6	-26.8	175.2	69.1	0	0	0	0	112.1	Q317 R318	S314-Q317 PolarHBondContact O-N 3.17Å; S314-R318 WeakPolarHBondContact O-CG 3.39Å; S314-R318 PolarHBondContact O-N 3.27Å; S314-R318 VanDerWaalsContact O-N 3.14Å
315	L	75.2	Confident	65.2	Low	48 Å²	48	79 Å²	79	25%	0.251	43%	0.43	S	S	.	.	H	α-helix	trans	-65.3	-42.8	175	-120	161.3	0	0	0	112.1	L25 S313 R318 F319 F350	L25-L315 HydrophobicContact CB-CD2 4.15Å; L25-L315 HydrophobicContact CD2-CD1 4.34Å; L25-L315 HydrophobicContact CD2-CD2 4.24Å; L25-L315 HydrophobicContact CG-CD2 4.33Å; S313-L315 PolarHBondContact O-N 2.75Å; S313-L315 VanDerWaalsContact O-N 3.12Å; S313-L315 WeakPolarHBondContact OG-CB 3.3Å; S313-L315 PolarHBondContact OG-N 2.71Å; L315-R318 PolarHBondContact O-N 2.85Å; L315-F319 WeakPolarHBondContact O-CB 2.89Å; L315-F319 PolarHBondContact O-N 3.4Å; L315-F350 HydrophobicContact CB-CZ 4.22Å
316	W	79.6	Confident	67.4	Low	15 Å²	15	80.7 Å²	80.7	6%	0.057	41%	0.413	C	S	.	.	H	α-helix	trans	-62.3	-42.8	174.9	166.5	-112	0	0	0	112.2	S313 R318 F319 L320 L343 A346 K347 F350	S313-W316 WeakPolarHBondContact O-CB 3.25Å; S313-W316 PolarHBondContact O-N 3.24Å; S313-W316 PolarHBondContact OG-N 3.28Å; S313-W316 VanDerWaalsContact OG-N 3.17Å; W316-R318 VanDerWaalsContact C-N 3.34Å; W316-R318 PolarHBondContact O-N 2.96Å; W316-F319 AromaticContact CE3-CD1 3.73Å; W316-F319 HydrophobicContact CE3-CD1 3.73Å; W316-F319 HydrophobicContact CE3-CE1 4.39Å; W316-F319 HydrophobicContact CH2-CD1 4.47Å; W316-F319 AromaticContact CZ3-CD1 3.49Å; W316-F319 HydrophobicContact CZ3-CD1 3.49Å; W316-F319 VanDerWaalsContact CZ3-CD1 3.49Å; W316-F319 AromaticContact CZ3-CE1 3.75Å; W316-F319 HydrophobicContact CZ3-CE1 3.75Å; W316-F319 PolarHBondContact O-N 3.31Å; W316-L320 HydrophobicContact CH2-CD1 3.39Å; W316-L320 HydrophobicContact CZ2-CD1 3.14Å; W316-L320 HydrophobicContact CZ3-CD1 4.24Å; W316-L320 PolarHBondContact O-N 3.16Å; W316-L343 HydrophobicContact CH2-CD1 4.37Å; W316-L343 HydrophobicContact CZ2-CD1 3.99Å; W316-A346 HydrophobicContact CH2-CB 4.34Å; W316-K347 HydrophobicContact CH2-CB 3.94Å; W316-K347 HydrophobicContact CH2-CD 4.47Å; W316-K347 HydrophobicContact CH2-CG 3.18Å; W316-K347 HydrophobicContact CZ2-CB 4.4Å; W316-K347 HydrophobicContact CZ2-CD 4.12Å; W316-K347 HydrophobicContact CZ2-CG 3.22Å; W316-K347 HydrophobicContact CZ3-CB 4.42Å; W316-K347 HydrophobicContact CZ3-CG 4Å; W316-F350 HydrophobicContact CB-CE1 4.19Å; W316-F350 HydrophobicContact CB-CZ 4.35Å; W316-F350 HydrophobicContact CE3-CB 3.87Å; W316-F350 AromaticContact CE3-CD1 3.85Å; W316-F350 HydrophobicContact CE3-CD1 3.85Å; W316-F350 HydrophobicContact CE3-CD2 4.14Å; W316-F350 HydrophobicContact CE3-CE1 4.46Å; W316-F350 AromaticContact CE3-CG 3.67Å; W316-F350 HydrophobicContact CE3-CG 3.67Å; W316-F350 HydrophobicContact CZ3-CB 3.73Å; W316-F350 HydrophobicContact CZ3-CG 4.07Å
317	Q	82.2	Confident	69.5	Low	107 Å²	107	79.7 Å²	79.7	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-39.9	178.5	-68.3	-67	-27.7	0	0	111.9	S313 S314 T321	S313-Q317 PolarHBondContact O-N 3.22Å; S314-Q317 PolarHBondContact O-N 3.17Å; Q317-T321 PolarHBondContact O-N 2.97Å; Q317-T321 VanDerWaalsContact O-N 3.1Å; Q317-T321 PolarHBondContact O-OG1 2.95Å
318	R	81.2	Confident	71.9	Confident	145 Å²	145	74 Å²	74	55%	0.547	38%	0.384	S	S	.	.	H	α-helix	trans	-62.6	-47.2	172.5	-72.4	176	177.8	174.9	-1.1	110.8	S26 S314 L315 W316 L320 T321 D322	S26-R318 WeakPolarHBondContact OG-CB 3.47Å; S26-R318 PolarHBondContact OG-O 3.08Å; S314-R318 WeakPolarHBondContact O-CG 3.39Å; S314-R318 PolarHBondContact O-N 3.27Å; S314-R318 VanDerWaalsContact O-N 3.14Å; L315-R318 PolarHBondContact O-N 2.85Å; W316-R318 VanDerWaalsContact C-N 3.34Å; W316-R318 PolarHBondContact O-N 2.96Å; R318-L320 VanDerWaalsContact C-N 3.29Å; R318-L320 PolarHBondContact O-N 3.25Å; R318-T321 WeakPolarHBondContact O-CA 3.29Å; R318-T321 WeakPolarHBondContact O-CB 3.12Å; R318-T321 PolarHBondContact O-N 2.92Å; R318-D322 VanDerWaalsContact O-CG 3.23Å; R318-D322 PolarHBondContact O-N 2.66Å
319	F	82	Confident	74.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.5	-42.1	-179.3	173.5	-104.3	0	0	0	111.8	S26 L29 A30 L315 W316 T321 D322 L323 A346 F349 F350	S26-F319 WeakPolarHBondContact OG-CA 3.25Å; S26-F319 PolarHBondContact OG-N 3.17Å; L29-F319 HydrophobicContact CB-CD2 3.86Å; L29-F319 HydrophobicContact CB-CE2 3.8Å; A30-F319 HydrophobicContact CB-CD2 4.27Å; A30-F319 HydrophobicContact CB-CE2 4.24Å; L315-F319 WeakPolarHBondContact O-CB 2.89Å; L315-F319 PolarHBondContact O-N 3.4Å; W316-F319 AromaticContact CE3-CD1 3.73Å; W316-F319 HydrophobicContact CE3-CD1 3.73Å; W316-F319 HydrophobicContact CE3-CE1 4.39Å; W316-F319 HydrophobicContact CH2-CD1 4.47Å; W316-F319 AromaticContact CZ3-CD1 3.49Å; W316-F319 HydrophobicContact CZ3-CD1 3.49Å; W316-F319 VanDerWaalsContact CZ3-CD1 3.49Å; W316-F319 AromaticContact CZ3-CE1 3.75Å; W316-F319 HydrophobicContact CZ3-CE1 3.75Å; W316-F319 PolarHBondContact O-N 3.31Å; F319-T321 VanDerWaalsContact C-N 3.33Å; F319-T321 PolarHBondContact O-N 3.2Å; F319-D322 PolarHBondContact O-N 3.23Å; F319-L323 HydrophobicContact CD1-CD1 3.8Å; F319-L323 HydrophobicContact CE1-CD1 3.26Å; F319-L323 HydrophobicContact CE1-CG 4.27Å; F319-L323 HydrophobicContact CE2-CD1 4.1Å; F319-L323 HydrophobicContact CE2-CG 4.29Å; F319-L323 HydrophobicContact CG-CD1 4.43Å; F319-L323 HydrophobicContact CZ-CD1 3.44Å; F319-L323 VanDerWaalsContact CZ-CD1 3.44Å; F319-L323 HydrophobicContact CZ-CG 4.08Å; F319-L323 WeakPolarHBondContact O-CB 3.24Å; F319-L323 WeakPolarHBondContact O-CG 3.48Å; F319-L323 PolarHBondContact O-N 3.49Å; F319-A346 HydrophobicContact CE1-CB 4.35Å; F319-F349 HydrophobicContact CE2-CD1 4.43Å; F319-F349 HydrophobicContact CE2-CE1 4.4Å; F319-F349 AromaticContact CZ-CD1 3.83Å; F319-F349 HydrophobicContact CZ-CD1 3.83Å; F319-F349 HydrophobicContact CZ-CE1 4.23Å; F319-F350 HydrophobicContact CB-CD2 3.91Å; F319-F350 HydrophobicContact CB-CE2 3.9Å; F319-F350 HydrophobicContact CD1-CB 4.06Å; F319-F350 AromaticContact CD1-CD2 3.57Å; F319-F350 HydrophobicContact CD1-CD2 3.57Å; F319-F350 HydrophobicContact CD1-CE2 4.4Å; F319-F350 HydrophobicContact CD1-CG 4.11Å; F319-F350 HydrophobicContact CD2-CD2 4.08Å; F319-F350 HydrophobicContact CE1-CB 3.82Å; F319-F350 HydrophobicContact CE1-CD2 4.03Å; F319-F350 HydrophobicContact CE1-CG 4.34Å; F319-F350 AromaticContact CG-CD2 3.58Å; F319-F350 HydrophobicContact CG-CD2 3.58Å; F319-F350 HydrophobicContact CG-CE2 4.07Å; F319-F350 HydrophobicContact CZ-CB 4.42Å; F319-F350 HydrophobicContact CZ-CD2 4.47Å
320	L	84.3	Confident	76.4	Confident	17 Å²	17	67.5 Å²	67.5	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-38.9	175.8	-149.6	98.5	0	0	0	112.9	W316 R318 K324 F329 L343	W316-L320 HydrophobicContact CH2-CD1 3.39Å; W316-L320 HydrophobicContact CZ2-CD1 3.14Å; W316-L320 HydrophobicContact CZ3-CD1 4.24Å; W316-L320 PolarHBondContact O-N 3.16Å; R318-L320 VanDerWaalsContact C-N 3.29Å; R318-L320 PolarHBondContact O-N 3.25Å; L320-K324 WeakPolarHBondContact O-CG 3.24Å; L320-K324 PolarHBondContact O-N 3.07Å; L320-F329 HydrophobicContact CD1-CZ 4.41Å; L320-F329 HydrophobicContact CG-CZ 4.41Å; L320-L343 HydrophobicContact CD1-CD1 3.35Å; L320-L343 HydrophobicContact CD2-CD1 4.38Å; L320-L343 HydrophobicContact CG-CD1 4.4Å
321	T	85.9	Confident	78.3	Confident	70 Å²	70	71.1 Å²	71.1	43%	0.429	36%	0.364	S	S	.	.	H	α-helix	trans	-67.3	-43.2	178.7	-54.8	0	0	0	0	110.2	Q317 R318 F319 K324 N325	Q317-T321 PolarHBondContact O-N 2.97Å; Q317-T321 VanDerWaalsContact O-N 3.1Å; Q317-T321 PolarHBondContact O-OG1 2.95Å; R318-T321 WeakPolarHBondContact O-CA 3.29Å; R318-T321 WeakPolarHBondContact O-CB 3.12Å; R318-T321 PolarHBondContact O-N 2.92Å; F319-T321 VanDerWaalsContact C-N 3.33Å; F319-T321 PolarHBondContact O-N 3.2Å; T321-K324 WeakPolarHBondContact O-CB 3.42Å; T321-K324 PolarHBondContact O-N 3.41Å; T321-N325 VanDerWaalsContact O-CG 3.23Å; T321-N325 PolarHBondContact O-N 3.05Å; T321-N325 PolarHBondContact O-ND2 3.34Å
322	D	84.1	Confident	80	Confident	26 Å²	26	72.7 Å²	72.7	14%	0.139	37%	0.365	C	S	.	.	H	α-helix	trans	-66.2	-39.4	178.8	-60.7	-25.3	0	0	0	111.3	S26 N27 A30 R318 F319 N325 R326	S26-D322 WeakPolarHBondContact CB-OD2 3.32Å; S26-D322 PolarHBondContact OG-OD2 3.4Å; N27-D322 PolarHBondContact OD1-OD1 3.45Å; N27-D322 PolarHBondContact OD1-OD2 3.35Å; A30-D322 HydrophobicContact CB-CB 3.92Å; R318-D322 VanDerWaalsContact O-CG 3.23Å; R318-D322 PolarHBondContact O-N 2.66Å; F319-D322 PolarHBondContact O-N 3.23Å; D322-N325 PolarHBondContact O-N 3.32Å; D322-R326 WeakPolarHBondContact O-CG 3.5Å; D322-R326 PolarHBondContact O-N 2.88Å; D322-R326 VanDerWaalsContact O-N 3.08Å
323	L	85.8	Confident	81.5	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-42.9	171.3	-84.1	170.1	0	0	0	112.6	A30 H33 F319 N325 R326 G327 Y328 F329 A346	A30-L323 HydrophobicContact CB-CG 4.44Å; H33-L323 HydrophobicContact CB-CD2 4.49Å; F319-L323 HydrophobicContact CD1-CD1 3.8Å; F319-L323 HydrophobicContact CE1-CD1 3.26Å; F319-L323 HydrophobicContact CE1-CG 4.27Å; F319-L323 HydrophobicContact CE2-CD1 4.1Å; F319-L323 HydrophobicContact CE2-CG 4.29Å; F319-L323 HydrophobicContact CG-CD1 4.43Å; F319-L323 HydrophobicContact CZ-CD1 3.44Å; F319-L323 VanDerWaalsContact CZ-CD1 3.44Å; F319-L323 HydrophobicContact CZ-CG 4.08Å; F319-L323 WeakPolarHBondContact O-CB 3.24Å; F319-L323 WeakPolarHBondContact O-CG 3.48Å; F319-L323 PolarHBondContact O-N 3.49Å; L323-N325 VanDerWaalsContact C-N 3.35Å; L323-R326 PolarHBondContact O-N 3.46Å; L323-G327 PolarHBondContact O-N 2.84Å; L323-Y328 HydrophobicContact CB-CD1 4.46Å; L323-Y328 HydrophobicContact CD1-CD1 4.38Å; L323-Y328 HydrophobicContact CD2-CD1 4.04Å; L323-Y328 HydrophobicContact CD2-CD2 4.23Å; L323-Y328 HydrophobicContact CD2-CG 3.73Å; L323-Y328 VanDerWaalsContact O-CB 3.32Å; L323-Y328 WeakPolarHBondContact O-CB 3.46Å; L323-Y328 PolarHBondContact O-N 3.04Å; L323-Y328 VanDerWaalsContact O-N 3.1Å; L323-F329 HydrophobicContact CB-CE2 4.32Å; L323-A346 HydrophobicContact CD1-CB 3.78Å
324	K	85.9	Confident	82.6	Confident	96 Å²	96	74.3 Å²	74.3	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-44.2	176.1	-78	178.9	-179.3	-177.2	0	111.4	L320 T321 R326 G327 F329 Y339	L320-K324 WeakPolarHBondContact O-CG 3.24Å; L320-K324 PolarHBondContact O-N 3.07Å; T321-K324 WeakPolarHBondContact O-CB 3.42Å; T321-K324 PolarHBondContact O-N 3.41Å; K324-R326 PolarHBondContact O-N 3.23Å; K324-G327 PolarHBondContact O-N 3.36Å; K324-F329 HydrophobicContact CB-CD2 4.49Å; K324-F329 HydrophobicContact CG-CD2 3.55Å; K324-F329 HydrophobicContact CG-CE2 3.59Å; K324-Y339 VanDerWaalsContact CE-OH 3.26Å; K324-Y339 WeakPolarHBondContact CE-OH 3.44Å; K324-Y339 PolarHBondContact NZ-OH 3.49Å
325	N	85.1	Confident	82.8	Confident	129 Å²	129	72.9 Å²	72.9	69%	0.69	38%	0.377	S	S	*	.	H	α-helix	trans	-63.6	-30	178.5	-67.1	-20.5	0	0	0	112.3	T321 D322 L323 G327	T321-N325 VanDerWaalsContact O-CG 3.23Å; T321-N325 PolarHBondContact O-N 3.05Å; T321-N325 PolarHBondContact O-ND2 3.34Å; D322-N325 PolarHBondContact O-N 3.32Å; L323-N325 VanDerWaalsContact C-N 3.35Å; N325-G327 VanDerWaalsContact C-N 3.28Å; N325-G327 PolarHBondContact O-N 3.44Å
326	R	82.7	Confident	83.1	Confident	110 Å²	110	72 Å²	72	42%	0.415	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2.4	174.5	-69.5	177.1	-178.7	-98.3	0.2	114	D322 L323 K324 Y328	D322-R326 WeakPolarHBondContact O-CG 3.5Å; D322-R326 PolarHBondContact O-N 2.88Å; D322-R326 VanDerWaalsContact O-N 3.08Å; L323-R326 PolarHBondContact O-N 3.46Å; K324-R326 PolarHBondContact O-N 3.23Å; R326-Y328 VanDerWaalsContact C-N 3.33Å; R326-Y328 PolarHBondContact O-N 3.02Å
327	G	83.9	Confident	83	Confident	41 Å²	41	75.2 Å²	75.2	42%	0.423	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	17	176.9	0	0	0	0	0	114.8	L323 K324 N325 F329 K330	L323-G327 PolarHBondContact O-N 2.84Å; K324-G327 PolarHBondContact O-N 3.36Å; N325-G327 VanDerWaalsContact C-N 3.28Å; N325-G327 PolarHBondContact O-N 3.44Å; G327-F329 PolarHBondContact O-N 3.45Å; G327-K330 PolarHBondContact O-N 3.03Å
328	Y	84.2	Confident	82.7	Confident	24 Å²	24	71 Å²	71	9%	0.094	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-36.7	-175.4	175.6	-111.9	0	0	0	113.6	H33 L323 R326 K330 L342 A346	H33-Y328 AromaticContact CE1-CD2 3.77Å; H33-Y328 AromaticContact CE1-CE2 3.11Å; H33-Y328 WeakPolarHBondContact CE1-CE2 3.47Å; H33-Y328 AromaticContact CE1-CZ 3.51Å; H33-Y328 AromaticContact ND1-CE2 3.86Å; H33-Y328 AromaticContact NE2-CE2 3.88Å; H33-Y328 AromaticContact NE2-CZ 3.8Å; L323-Y328 HydrophobicContact CB-CD1 4.46Å; L323-Y328 HydrophobicContact CD1-CD1 4.38Å; L323-Y328 HydrophobicContact CD2-CD1 4.04Å; L323-Y328 HydrophobicContact CD2-CD2 4.23Å; L323-Y328 HydrophobicContact CD2-CG 3.73Å; L323-Y328 VanDerWaalsContact O-CB 3.32Å; L323-Y328 WeakPolarHBondContact O-CB 3.46Å; L323-Y328 PolarHBondContact O-N 3.04Å; L323-Y328 VanDerWaalsContact O-N 3.1Å; R326-Y328 VanDerWaalsContact C-N 3.33Å; R326-Y328 PolarHBondContact O-N 3.02Å; Y328-K330 PolarHBondContact O-N 3.25Å; Y328-K330 VanDerWaalsContact O-N 3.14Å; Y328-L342 HydrophobicContact CE1-CB 3.84Å; Y328-L342 HydrophobicContact CE1-CD2 4.29Å; Y328-L342 WeakPolarHBondContact CE1-O 3.36Å; Y328-L342 HydrophobicContact CE2-CD2 4.32Å; Y328-L342 PolarHBondContact OH-O 3.26Å; Y328-A346 HydrophobicContact CE1-CB 3.98Å
329	F	86.7	Confident	82.9	Confident	11 Å²	11	64.7 Å²	64.7	5%	0.048	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	7.5	-178.3	-65.3	-80.7	0	0	0	114	L320 L323 K324 G327 N331 E332 Y339 L342 L343	L320-F329 HydrophobicContact CD1-CZ 4.41Å; L320-F329 HydrophobicContact CG-CZ 4.41Å; L323-F329 HydrophobicContact CB-CE2 4.32Å; K324-F329 HydrophobicContact CB-CD2 4.49Å; K324-F329 HydrophobicContact CG-CD2 3.55Å; K324-F329 HydrophobicContact CG-CE2 3.59Å; G327-F329 PolarHBondContact O-N 3.45Å; F329-N331 PolarHBondContact O-N 3.32Å; F329-E332 WeakPolarHBondContact O-CB 3.46Å; F329-E332 VanDerWaalsContact O-CG 3.31Å; F329-E332 WeakPolarHBondContact O-CG 3.34Å; F329-E332 PolarHBondContact O-N 2.92Å; F329-Y339 HydrophobicContact CB-CD2 4.04Å; F329-Y339 HydrophobicContact CB-CE2 4.12Å; F329-Y339 AromaticContact CD1-CD2 3.42Å; F329-Y339 HydrophobicContact CD1-CD2 3.42Å; F329-Y339 VanDerWaalsContact CD1-CD2 3.42Å; F329-Y339 AromaticContact CD1-CE2 3.36Å; F329-Y339 HydrophobicContact CD1-CE2 3.36Å; F329-Y339 HydrophobicContact CD1-CG 4.18Å; F329-Y339 HydrophobicContact CD2-CE2 4.21Å; F329-Y339 HydrophobicContact CE1-CD2 4.09Å; F329-Y339 AromaticContact CE1-CE2 3.74Å; F329-Y339 HydrophobicContact CE1-CE2 3.74Å; F329-Y339 AromaticContact CE1-CZ 3.98Å; F329-Y339 AromaticContact CG-CD2 3.87Å; F329-Y339 HydrophobicContact CG-CD2 3.87Å; F329-Y339 AromaticContact CG-CE2 3.62Å; F329-Y339 HydrophobicContact CG-CE2 3.62Å; F329-Y339 HydrophobicContact CZ-CE2 4.31Å; F329-L342 HydrophobicContact CD1-CB 3.96Å; F329-L342 HydrophobicContact CE1-CB 4.14Å; F329-L343 HydrophobicContact CE1-CB 4.16Å; F329-L343 HydrophobicContact CE1-CD1 4.49Å; F329-L343 HydrophobicContact CZ-CD1 4.34Å
330	K	83.6	Confident	82.8	Confident	138 Å²	138	67.4 Å²	67.4	60%	0.6	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	32.8	173.9	-58.5	179.2	-175.5	175.5	0	114.1	G327 Y328 E332	G327-K330 PolarHBondContact O-N 3.03Å; Y328-K330 PolarHBondContact O-N 3.25Å; Y328-K330 VanDerWaalsContact O-N 3.14Å; K330-E332 PolarHBondContact O-N 3.47Å
331	N	81.9	Confident	82.6	Confident	161 Å²	161	74 Å²	74	86%	0.861	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	20.6	-173.6	-57.1	-34.2	0	0	0	115.1	F329	F329-N331 PolarHBondContact O-N 3.32Å
332	E	79.7	Confident	82.4	Confident	89 Å²	89	72 Å²	72	42%	0.416	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-62.7	140.2	172.1	-71.1	-72.8	170.7	0	0	110.9	F329 K330 V334 S336	F329-E332 WeakPolarHBondContact O-CB 3.46Å; F329-E332 VanDerWaalsContact O-CG 3.31Å; F329-E332 WeakPolarHBondContact O-CG 3.34Å; F329-E332 PolarHBondContact O-N 2.92Å; K330-E332 PolarHBondContact O-N 3.47Å; E332-V334 PolarHBondContact O-N 3.05Å; E332-S336 PolarHBondContact OE2-OG 3.36Å
333	I	80.4	Confident	82.4	Confident	139 Å²	139	72.3 Å²	72.3	71%	0.713	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-68	135.3	-179.1	-55	172.3	0	0	0	108.8	G335 S336 Y339	I333-G335 PolarHBondContact O-N 2.9Å; I333-G335 VanDerWaalsContact O-N 3.16Å; I333-S336 VanDerWaalsContact O-CB 3.23Å; I333-S336 WeakPolarHBondContact O-CB 3.34Å; I333-S336 PolarHBondContact O-N 3.4Å; I333-S336 PolarHBondContact O-OG 3.43Å; I333-Y339 VanDerWaalsContact O-CB 3.28Å; I333-Y339 WeakPolarHBondContact O-CB 3.39Å
334	V	84.4	Confident	82.2	Confident	106 Å²	106	76.2 Å²	76.2	64%	0.642	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	120.7	178.1	-178.6	0	0	0	0	109.6	E332 Y339	E332-V334 PolarHBondContact O-N 3.05Å; V334-Y339 HydrophobicContact CG1-CE1 4.04Å; V334-Y339 HydrophobicContact CG2-CE2 4.1Å
335	G	78.9	Confident	81.8	Confident	56 Å²	56	73.7 Å²	73.7	58%	0.577	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-4.6	-177.7	0	0	0	0	0	115.2	I333	I333-G335 PolarHBondContact O-N 2.9Å; I333-G335 VanDerWaalsContact O-N 3.16Å
336	S	82.9	Confident	81.7	Confident	30 Å²	30	67.5 Å²	67.5	21%	0.21	38%	0.378	C	S	.	.	S	Bend	trans	-63.3	157.9	168.1	65.7	0	0	0	0	111.5	E332 I333 G338 Y339 C340	E332-S336 PolarHBondContact OE2-OG 3.36Å; I333-S336 VanDerWaalsContact O-CB 3.23Å; I333-S336 WeakPolarHBondContact O-CB 3.34Å; I333-S336 PolarHBondContact O-N 3.4Å; I333-S336 PolarHBondContact O-OG 3.43Å; S336-G338 VanDerWaalsContact C-N 3.26Å; S336-G338 PolarHBondContact O-N 3.25Å; S336-Y339 PolarHBondContact O-N 3.48Å; S336-Y339 WeakPolarHBondContact OG-CB 3.45Å; S336-Y339 PolarHBondContact OG-N 2.98Å; S336-Y339 VanDerWaalsContact OG-N 3.1Å; S336-C340 WeakPolarHBondContact O-CB 3.36Å; S336-C340 PolarHBondContact O-N 3.06Å; S336-C340 PolarHBondContact O-SG 3.47Å; S336-C340 VanDerWaalsContact O-SG 3.34Å
337	A	76.7	Confident	81.6	Confident	81 Å²	81	65.8 Å²	65.8	67%	0.669	37%	0.374	S	S	*	.	H	α-helix	trans	-59.2	-37.7	176.9	0	0	0	0	0	112.3	R341	A337-R341 WeakPolarHBondContact O-CB 3.34Å; A337-R341 PolarHBondContact O-N 3.44Å
338	G	76.8	Confident	81.2	Confident	18 Å²	18	65.6 Å²	65.6	19%	0.186	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-48.7	174.9	0	0	0	0	0	112.1	S336 C340 R341 L342	S336-G338 VanDerWaalsContact C-N 3.26Å; S336-G338 PolarHBondContact O-N 3.25Å; G338-C340 PolarHBondContact O-N 2.91Å; G338-R341 WeakPolarHBondContact O-CB 3.24Å; G338-R341 PolarHBondContact O-N 2.95Å; G338-L342 WeakPolarHBondContact O-CG 3.47Å; G338-L342 PolarHBondContact O-N 3.44Å
339	Y	85	Confident	81	Confident	14 Å²	14	66 Å²	66	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-59.4	-45.6	175.8	-177.7	-86.8	0	0	0	112.2	K324 F329 I333 V334 S336 R341 L342 L343	K324-Y339 VanDerWaalsContact CE-OH 3.26Å; K324-Y339 WeakPolarHBondContact CE-OH 3.44Å; K324-Y339 PolarHBondContact NZ-OH 3.49Å; F329-Y339 HydrophobicContact CB-CD2 4.04Å; F329-Y339 HydrophobicContact CB-CE2 4.12Å; F329-Y339 AromaticContact CD1-CD2 3.42Å; F329-Y339 HydrophobicContact CD1-CD2 3.42Å; F329-Y339 VanDerWaalsContact CD1-CD2 3.42Å; F329-Y339 AromaticContact CD1-CE2 3.36Å; F329-Y339 HydrophobicContact CD1-CE2 3.36Å; F329-Y339 HydrophobicContact CD1-CG 4.18Å; F329-Y339 HydrophobicContact CD2-CE2 4.21Å; F329-Y339 HydrophobicContact CE1-CD2 4.09Å; F329-Y339 AromaticContact CE1-CE2 3.74Å; F329-Y339 HydrophobicContact CE1-CE2 3.74Å; F329-Y339 AromaticContact CE1-CZ 3.98Å; F329-Y339 AromaticContact CG-CD2 3.87Å; F329-Y339 HydrophobicContact CG-CD2 3.87Å; F329-Y339 AromaticContact CG-CE2 3.62Å; F329-Y339 HydrophobicContact CG-CE2 3.62Å; F329-Y339 HydrophobicContact CZ-CE2 4.31Å; I333-Y339 VanDerWaalsContact O-CB 3.28Å; I333-Y339 WeakPolarHBondContact O-CB 3.39Å; V334-Y339 HydrophobicContact CG1-CE1 4.04Å; V334-Y339 HydrophobicContact CG2-CE2 4.1Å; S336-Y339 PolarHBondContact O-N 3.48Å; S336-Y339 WeakPolarHBondContact OG-CB 3.45Å; S336-Y339 PolarHBondContact OG-N 2.98Å; S336-Y339 VanDerWaalsContact OG-N 3.1Å; Y339-R341 VanDerWaalsContact C-N 3.31Å; Y339-R341 PolarHBondContact O-N 3.17Å; Y339-L342 PolarHBondContact O-N 3Å; Y339-L343 HydrophobicContact CE1-CB 4.41Å; Y339-L343 HydrophobicContact CE1-CD2 4.08Å; Y339-L343 VanDerWaalsContact O-CB 3.24Å; Y339-L343 WeakPolarHBondContact O-CB 3.49Å; Y339-L343 PolarHBondContact O-N 3.48Å
340	C	79.9	Confident	80.6	Confident	57 Å²	57	66 Å²	66	39%	0.385	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-40.2	178.3	-71	0	0	0	0	111.6	S336 G338 L343 E344	S336-C340 WeakPolarHBondContact O-CB 3.36Å; S336-C340 PolarHBondContact O-N 3.06Å; S336-C340 PolarHBondContact O-SG 3.47Å; S336-C340 VanDerWaalsContact O-SG 3.34Å; G338-C340 PolarHBondContact O-N 2.91Å; C340-L343 PolarHBondContact O-N 2.93Å; C340-E344 WeakPolarHBondContact O-CB 3.48Å; C340-E344 PolarHBondContact O-N 2.65Å
341	R	79.6	Confident	80.3	Confident	156 Å²	156	63.7 Å²	63.7	59%	0.589	35%	0.354	S	S	*	.	H	α-helix	trans	-62.1	-48.9	176.1	-168.2	-174.6	-67.4	138.7	-1	112	L207 A337 G338 Y339 L343 E344 A345	L207-R341 HydrophobicContact CD1-CG 3.43Å; L207-R341 VanDerWaalsContact CD1-CG 3.43Å; A337-R341 WeakPolarHBondContact O-CB 3.34Å; A337-R341 PolarHBondContact O-N 3.44Å; G338-R341 WeakPolarHBondContact O-CB 3.24Å; G338-R341 PolarHBondContact O-N 2.95Å; Y339-R341 VanDerWaalsContact C-N 3.31Å; Y339-R341 PolarHBondContact O-N 3.17Å; R341-L343 VanDerWaalsContact C-N 3.31Å; R341-L343 PolarHBondContact O-N 3.24Å; R341-E344 PolarHBondContact O-N 2.87Å; R341-A345 PolarHBondContact O-N 3.25Å
342	L	82.6	Confident	79.8	Confident	28 Å²	28	56.9 Å²	56.9	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-38.7	177	-69.2	171.5	0	0	0	111.5	Y328 F329 G338 Y339 A345 A346	Y328-L342 HydrophobicContact CE1-CB 3.84Å; Y328-L342 HydrophobicContact CE1-CD2 4.29Å; Y328-L342 WeakPolarHBondContact CE1-O 3.36Å; Y328-L342 HydrophobicContact CE2-CD2 4.32Å; Y328-L342 PolarHBondContact OH-O 3.26Å; F329-L342 HydrophobicContact CD1-CB 3.96Å; F329-L342 HydrophobicContact CE1-CB 4.14Å; G338-L342 WeakPolarHBondContact O-CG 3.47Å; G338-L342 PolarHBondContact O-N 3.44Å; Y339-L342 PolarHBondContact O-N 3Å; L342-A345 PolarHBondContact O-N 3.08Å; L342-A346 WeakPolarHBondContact O-CB 3.13Å; L342-A346 PolarHBondContact O-N 3.47Å
343	L	84.3	Confident	79.6	Confident	32 Å²	32	52.7 Å²	52.7	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-41.8	176.6	-179.2	64.4	0	0	0	112.1	W316 L320 F329 Y339 C340 R341 A346 K347	W316-L343 HydrophobicContact CH2-CD1 4.37Å; W316-L343 HydrophobicContact CZ2-CD1 3.99Å; L320-L343 HydrophobicContact CD1-CD1 3.35Å; L320-L343 HydrophobicContact CD2-CD1 4.38Å; L320-L343 HydrophobicContact CG-CD1 4.4Å; F329-L343 HydrophobicContact CE1-CB 4.16Å; F329-L343 HydrophobicContact CE1-CD1 4.49Å; F329-L343 HydrophobicContact CZ-CD1 4.34Å; Y339-L343 HydrophobicContact CE1-CB 4.41Å; Y339-L343 HydrophobicContact CE1-CD2 4.08Å; Y339-L343 VanDerWaalsContact O-CB 3.24Å; Y339-L343 WeakPolarHBondContact O-CB 3.49Å; Y339-L343 PolarHBondContact O-N 3.48Å; C340-L343 PolarHBondContact O-N 2.93Å; R341-L343 VanDerWaalsContact C-N 3.31Å; R341-L343 PolarHBondContact O-N 3.24Å; L343-A346 PolarHBondContact O-N 3.12Å; L343-K347 WeakPolarHBondContact O-CG 3.11Å; L343-K347 PolarHBondContact O-N 3.05Å
344	E	79.9	Confident	79.2	Confident	85 Å²	85	47.3 Å²	47.3	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-46	176.7	-156.6	95.1	-156.9	0	0	110.5	C340 R341 A346 K347 E348 K372	C340-E344 WeakPolarHBondContact O-CB 3.48Å; C340-E344 PolarHBondContact O-N 2.65Å; R341-E344 PolarHBondContact O-N 2.87Å; E344-A346 PolarHBondContact O-N 2.59Å; E344-K347 WeakPolarHBondContact O-CB 3.23Å; E344-K347 PolarHBondContact O-N 3.42Å; E344-E348 PolarHBondContact O-N 3.2Å; E344-K372 IonicContact OE1-NZ 3.12Å; E344-K372 PolarHBondContact OE1-NZ 3.04Å
345	A	79.3	Confident	78.5	Confident	42 Å²	42	43.9 Å²	43.9	35%	0.347	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-45.8	175.9	0	0	0	0	0	111.9	R341 L342 K347 E348 F349	R341-A345 PolarHBondContact O-N 3.25Å; L342-A345 PolarHBondContact O-N 3.08Å; A345-K347 PolarHBondContact O-N 3.04Å; A345-E348 PolarHBondContact O-N 3.22Å; A345-F349 PolarHBondContact O-N 3.4Å
346	A	83.1	Confident	77.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-38.8	176.8	0	0	0	0	0	112.9	W316 F319 L323 Y328 L342 L343 E344 E348 F350	W316-A346 HydrophobicContact CH2-CB 4.34Å; F319-A346 HydrophobicContact CE1-CB 4.35Å; L323-A346 HydrophobicContact CD1-CB 3.78Å; Y328-A346 HydrophobicContact CE1-CB 3.98Å; L342-A346 WeakPolarHBondContact O-CB 3.13Å; L342-A346 PolarHBondContact O-N 3.47Å; L343-A346 PolarHBondContact O-N 3.12Å; E344-A346 PolarHBondContact O-N 2.59Å; A346-E348 VanDerWaalsContact C-N 3.32Å; A346-F350 WeakPolarHBondContact O-CB 3.38Å; A346-F350 PolarHBondContact O-N 3.16Å
347	K	80.5	Confident	76.5	Confident	73 Å²	73	47.2 Å²	47.2	32%	0.317	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-43	175.4	-80.9	176.7	-177.2	174.8	0	111.5	W316 L343 E344 A345 F350 K351	W316-K347 HydrophobicContact CH2-CB 3.94Å; W316-K347 HydrophobicContact CH2-CD 4.47Å; W316-K347 HydrophobicContact CH2-CG 3.18Å; W316-K347 HydrophobicContact CZ2-CB 4.4Å; W316-K347 HydrophobicContact CZ2-CD 4.12Å; W316-K347 HydrophobicContact CZ2-CG 3.22Å; W316-K347 HydrophobicContact CZ3-CB 4.42Å; W316-K347 HydrophobicContact CZ3-CG 4Å; L343-K347 WeakPolarHBondContact O-CG 3.11Å; L343-K347 PolarHBondContact O-N 3.05Å; E344-K347 WeakPolarHBondContact O-CB 3.23Å; E344-K347 PolarHBondContact O-N 3.42Å; A345-K347 PolarHBondContact O-N 3.04Å; K347-F350 PolarHBondContact O-N 3.39Å; K347-K351 WeakPolarHBondContact O-CG 3.16Å; K347-K351 PolarHBondContact O-N 3.39Å; K347-K351 VanDerWaalsContact O-N 3.08Å
348	E	75.4	Confident	75.8	Confident	38 Å²	38	49.5 Å²	49.5	18%	0.178	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-42.6	-177.7	-167	165.2	-151.6	0	0	111.7	R208 E344 A345 A346 F350 K351 N352 L369	R208-E348 IonicContact CZ-OE1 2.6Å; R208-E348 IonicContact CZ-OE2 2.73Å; R208-E348 IonicContact NE-OE2 2.92Å; R208-E348 IonicContact NH1-OE1 2.7Å; R208-E348 PolarHBondContact NH1-OE1 3.34Å; R208-E348 IonicContact NH1-OE2 2.72Å; R208-E348 PolarHBondContact NH1-OE2 3.11Å; R208-E348 IonicContact NH2-OE1 2.71Å; R208-E348 IonicContact NH2-OE2 2.7Å; E344-E348 PolarHBondContact O-N 3.2Å; A345-E348 PolarHBondContact O-N 3.22Å; A346-E348 VanDerWaalsContact C-N 3.32Å; E348-F350 VanDerWaalsContact C-N 3.33Å; E348-F350 PolarHBondContact O-N 2.81Å; E348-K351 PolarHBondContact O-N 3.08Å; E348-N352 PolarHBondContact O-N 3.36Å; E348-N352 PolarHBondContact O-OD1 2.88Å; E348-L369 WeakPolarHBondContact OE1-CD1 3.45Å
349	F	79.7	Confident	75.2	Confident	31 Å²	31	50.5 Å²	50.5	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-54.2	-51.5	169.1	178.7	-88.4	0	0	0	110.9	V32 H33 F319 A345 K351 N352 V353	V32-F349 HydrophobicContact CG1-CZ 4.1Å; H33-F349 HydrophobicContact CB-CD1 4.14Å; H33-F349 HydrophobicContact CB-CE1 3.66Å; H33-F349 HydrophobicContact CB-CE2 4.24Å; H33-F349 HydrophobicContact CB-CZ 3.71Å; H33-F349 AromaticContact CD2-CD1 3.55Å; H33-F349 AromaticContact CD2-CD2 3.82Å; H33-F349 AromaticContact CD2-CE1 3.99Å; H33-F349 AromaticContact CD2-CG 3.45Å; H33-F349 VanDerWaalsContact CD2-CG 3.45Å; H33-F349 WeakPolarHBondContact CD2-CG 3.37Å; F319-F349 HydrophobicContact CE2-CD1 4.43Å; F319-F349 HydrophobicContact CE2-CE1 4.4Å; F319-F349 AromaticContact CZ-CD1 3.83Å; F319-F349 HydrophobicContact CZ-CD1 3.83Å; F319-F349 HydrophobicContact CZ-CE1 4.23Å; A345-F349 PolarHBondContact O-N 3.4Å; F349-K351 VanDerWaalsContact C-N 3.27Å; F349-K351 PolarHBondContact O-N 2.87Å; F349-N352 PolarHBondContact O-N 3.23Å; F349-N352 VanDerWaalsContact O-N 3.11Å; F349-V353 HydrophobicContact CD1-CG2 3.9Å; F349-V353 HydrophobicContact CD2-CG2 3.96Å; F349-V353 HydrophobicContact CE1-CB 4.2Å; F349-V353 HydrophobicContact CE1-CG1 4.49Å; F349-V353 HydrophobicContact CE1-CG2 3.59Å; F349-V353 HydrophobicContact CE2-CG2 3.65Å; F349-V353 HydrophobicContact CG-CG2 4.08Å; F349-V353 HydrophobicContact CZ-CB 4.43Å; F349-V353 HydrophobicContact CZ-CG2 3.46Å; F349-V353 VanDerWaalsContact CZ-CG2 3.46Å; F349-V353 WeakPolarHBondContact O-CB 3.36Å; F349-V353 VanDerWaalsContact O-CG2 3.25Å; F349-V353 WeakPolarHBondContact O-CG2 3.1Å; F349-V353 PolarHBondContact O-N 2.8Å
350	F	78.8	Confident	74.3	Confident	13 Å²	13	50.7 Å²	50.7	6%	0.057	25%	0.254	C	S	.	.	H	α-helix	trans	-57.3	-40.7	-179.1	-177.1	-94.8	0	0	0	112.5	L29 L315 W316 F319 A346 K347 E348 T354	L29-F350 HydrophobicContact CD1-CD2 4.16Å; L29-F350 HydrophobicContact CD1-CE2 4.01Å; L315-F350 HydrophobicContact CB-CZ 4.22Å; W316-F350 HydrophobicContact CB-CE1 4.19Å; W316-F350 HydrophobicContact CB-CZ 4.35Å; W316-F350 HydrophobicContact CE3-CB 3.87Å; W316-F350 AromaticContact CE3-CD1 3.85Å; W316-F350 HydrophobicContact CE3-CD1 3.85Å; W316-F350 HydrophobicContact CE3-CD2 4.14Å; W316-F350 HydrophobicContact CE3-CE1 4.46Å; W316-F350 AromaticContact CE3-CG 3.67Å; W316-F350 HydrophobicContact CE3-CG 3.67Å; W316-F350 HydrophobicContact CZ3-CB 3.73Å; W316-F350 HydrophobicContact CZ3-CG 4.07Å; F319-F350 HydrophobicContact CB-CD2 3.91Å; F319-F350 HydrophobicContact CB-CE2 3.9Å; F319-F350 HydrophobicContact CD1-CB 4.06Å; F319-F350 AromaticContact CD1-CD2 3.57Å; F319-F350 HydrophobicContact CD1-CD2 3.57Å; F319-F350 HydrophobicContact CD1-CE2 4.4Å; F319-F350 HydrophobicContact CD1-CG 4.11Å; F319-F350 HydrophobicContact CD2-CD2 4.08Å; F319-F350 HydrophobicContact CE1-CB 3.82Å; F319-F350 HydrophobicContact CE1-CD2 4.03Å; F319-F350 HydrophobicContact CE1-CG 4.34Å; F319-F350 AromaticContact CG-CD2 3.58Å; F319-F350 HydrophobicContact CG-CD2 3.58Å; F319-F350 HydrophobicContact CG-CE2 4.07Å; F319-F350 HydrophobicContact CZ-CB 4.42Å; F319-F350 HydrophobicContact CZ-CD2 4.47Å; A346-F350 WeakPolarHBondContact O-CB 3.38Å; A346-F350 PolarHBondContact O-N 3.16Å; K347-F350 PolarHBondContact O-N 3.39Å; E348-F350 VanDerWaalsContact C-N 3.33Å; E348-F350 PolarHBondContact O-N 2.81Å; F350-T354 HydrophobicContact CD2-CG2 4.27Å; F350-T354 HydrophobicContact CE1-CG2 4.22Å; F350-T354 HydrophobicContact CE2-CG2 3.94Å; F350-T354 HydrophobicContact CZ-CG2 3.9Å; F350-T354 WeakPolarHBondContact O-CB 3.11Å; F350-T354 WeakPolarHBondContact O-CG2 3.42Å; F350-T354 PolarHBondContact O-N 3.34Å; F350-T354 VanDerWaalsContact O-N 3.12Å; F350-T354 PolarHBondContact O-OG1 3.46Å
351	K	76.5	Confident	74.2	Confident	89 Å²	89	51 Å²	51	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-49.7	174.9	-76.5	-179	177	-174.7	0	112	K347 E348 F349 V353 T354 Q355	K347-K351 WeakPolarHBondContact O-CG 3.16Å; K347-K351 PolarHBondContact O-N 3.39Å; K347-K351 VanDerWaalsContact O-N 3.08Å; E348-K351 PolarHBondContact O-N 3.08Å; F349-K351 VanDerWaalsContact C-N 3.27Å; F349-K351 PolarHBondContact O-N 2.87Å; K351-V353 VanDerWaalsContact C-N 3.27Å; K351-V353 PolarHBondContact O-N 3.42Å; K351-T354 PolarHBondContact O-N 2.82Å; K351-Q355 WeakPolarHBondContact O-CG 3.41Å; K351-Q355 PolarHBondContact O-N 2.94Å
352	N	71.6	Confident	74.2	Confident	18 Å²	18	45.1 Å²	45.1	10%	0.096	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-38.7	-179	-75.8	10.4	0	0	0	112	R208 E348 F349	R208-N352 PolarHBondContact NH2-ND2 2.96Å; E348-N352 PolarHBondContact O-N 3.36Å; E348-N352 PolarHBondContact O-OD1 2.88Å; F349-N352 PolarHBondContact O-N 3.23Å; F349-N352 VanDerWaalsContact O-N 3.11Å
353	V	74.3	Confident	74.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-82.8	-20.3	-175.5	-177.4	0	0	0	0	112.2	L29 F46 C47 L48 F349 K351	L29-V353 HydrophobicContact CD2-CB 4.35Å; L29-V353 HydrophobicContact CD2-CG1 3.24Å; L29-V353 HydrophobicContact CG-CG1 4.44Å; F46-V353 HydrophobicContact CD1-CG1 4.37Å; F46-V353 VanDerWaalsContact O-CG1 3.29Å; F46-V353 WeakPolarHBondContact O-CG1 3.43Å; F46-V353 WeakPolarHBondContact O-CG2 3.41Å; C47-V353 CarbonylContact C-O 3.55Å; C47-V353 WeakPolarHBondContact CA-O 3.17Å; L48-V353 PolarHBondContact N-O 2.85Å; F349-V353 HydrophobicContact CD1-CG2 3.9Å; F349-V353 HydrophobicContact CD2-CG2 3.96Å; F349-V353 HydrophobicContact CE1-CB 4.2Å; F349-V353 HydrophobicContact CE1-CG1 4.49Å; F349-V353 HydrophobicContact CE1-CG2 3.59Å; F349-V353 HydrophobicContact CE2-CG2 3.65Å; F349-V353 HydrophobicContact CG-CG2 4.08Å; F349-V353 HydrophobicContact CZ-CB 4.43Å; F349-V353 HydrophobicContact CZ-CG2 3.46Å; F349-V353 VanDerWaalsContact CZ-CG2 3.46Å; F349-V353 WeakPolarHBondContact O-CB 3.36Å; F349-V353 VanDerWaalsContact O-CG2 3.25Å; F349-V353 WeakPolarHBondContact O-CG2 3.1Å; F349-V353 PolarHBondContact O-N 2.8Å; K351-V353 VanDerWaalsContact C-N 3.27Å; K351-V353 PolarHBondContact O-N 3.42Å
354	T	73.4	Confident	74.1	Confident	26 Å²	26	43.3 Å²	43.3	16%	0.16	23%	0.229	C	C	.	.	H	α-helix	trans	-100.2	4.5	-178.9	56.1	0	0	0	0	114.7	L29 I49 F350 K351	L29-T354 HydrophobicContact CD1-CG2 3.64Å; I49-T354 VanDerWaalsContact CG2-O 3.24Å; I49-T354 WeakPolarHBondContact CG2-O 3.15Å; F350-T354 HydrophobicContact CD2-CG2 4.27Å; F350-T354 HydrophobicContact CE1-CG2 4.22Å; F350-T354 HydrophobicContact CE2-CG2 3.94Å; F350-T354 HydrophobicContact CZ-CG2 3.9Å; F350-T354 WeakPolarHBondContact O-CB 3.11Å; F350-T354 WeakPolarHBondContact O-CG2 3.42Å; F350-T354 PolarHBondContact O-N 3.34Å; F350-T354 VanDerWaalsContact O-N 3.12Å; F350-T354 PolarHBondContact O-OG1 3.46Å; K351-T354 PolarHBondContact O-N 2.82Å
355	Q	70.4	Confident	74.3	Confident	34 Å²	34	39.8 Å²	39.8	16%	0.159	21%	0.213	C	C	.	.			trans	-121.5	109.7	178.6	-65.9	-175	-33.2	0	0	109.3	K351	K351-Q355 WeakPolarHBondContact O-CG 3.41Å; K351-Q355 PolarHBondContact O-N 2.94Å
356	N	60.2	Low	74.6	Confident	20 Å²	20	38 Å²	38	11%	0.107	20%	0.198	C	C	.	.	S	Bend	trans	-88.9	-54.3	-177.7	-143.7	-5	0	0	0	111.1	C47 I49 Y59	C47-N356 PolarHBondContact SG-OD1 3.38Å; I49-N356 HydrophobicContact CD1-CB 4.06Å; I49-N356 HydrophobicContact CG2-CB 4.41Å; Y59-N356 WeakPolarHBondContact CD1-ND2 3.28Å; Y59-N356 WeakPolarHBondContact CE1-ND2 3.37Å
357	D	59.3	Low	74.7	Confident	137 Å²	137	38.6 Å²	38.6	73%	0.733	20%	0.202	S	C	*	.	S	Bend	trans	-99.7	-25.8	-177.2	-57.6	-53.1	0	0	0	113.7
358	D	62	Low	74.9	Confident	129 Å²	129	40.1 Å²	40.1	69%	0.69	21%	0.205	S	C	*	.	S	Bend	trans	-96.1	18.9	-175.6	-73.9	-29.9	0	0	0	113.4
359	K	63.9	Low	75.4	Confident	38 Å²	38	38.7 Å²	38.7	17%	0.165	20%	0.199	C	C	.	.			trans	-67.2	129.4	-176.1	-172.4	178.6	159.6	-158.6	0	109.6	E44 S361	E44-K359 IonicContact OE1-NZ 2.62Å; E44-K359 PolarHBondContact OE1-NZ 2.62Å; K359-S361 PolarHBondContact O-N 3.14Å
360	P	66	Low	75.7	Confident	19 Å²	19	37.3 Å²	37.3	12%	0.123	19%	0.193	C	C	.	.			trans	-62.8	133.6	171.9	25.8	-31.5	0	0	0	108.8	D362 V364	P360-D362 PolarHBondContact O-N 2.68Å; P360-V364 HydrophobicContact CB-CB 4.35Å; P360-V364 HydrophobicContact CB-CG1 4.28Å
361	S	76.9	Confident	75.9	Confident	64 Å²	64	40.9 Å²	40.9	45%	0.448	21%	0.21	S	C	.	.			trans	-44.7	141.5	172.6	168.3	0	0	0	0	110.7	K359 A363 V364 S365	K359-S361 PolarHBondContact O-N 3.14Å; S361-A363 PolarHBondContact O-N 2.86Å; S361-A363 PolarHBondContact OG-N 2.83Å; S361-V364 WeakPolarHBondContact O-CA 3.38Å; S361-V364 WeakPolarHBondContact O-CB 3.44Å; S361-V364 PolarHBondContact O-N 3.31Å; S361-S365 PolarHBondContact O-N 3.34Å
362	D	80.6	Confident	76.2	Confident	32 Å²	32	41.9 Å²	41.9	17%	0.171	21%	0.214	C	C	.	.	H	α-helix	trans	-49.9	-35.1	177.1	-77.6	-7.1	0	0	0	111.9	P214 R217 P360 V364 S365 V366	P214-D362 HydrophobicContact CB-CB 3.65Å; P214-D362 WeakPolarHBondContact CB-OD2 3.48Å; P214-D362 HydrophobicContact CG-CB 4.15Å; R217-D362 IonicContact CZ-OD2 3.9Å; R217-D362 IonicContact NH1-OD2 3.61Å; R217-D362 IonicContact NH2-OD2 3.95Å; R217-D362 PolarHBondContact NH2-OD2 3.42Å; P360-D362 PolarHBondContact O-N 2.68Å; D362-V364 PolarHBondContact O-N 3.07Å; D362-S365 PolarHBondContact O-N 3.44Å; D362-V366 WeakPolarHBondContact O-CB 3.46Å; D362-V366 WeakPolarHBondContact O-CG2 3.42Å; D362-V366 PolarHBondContact O-N 3.18Å
363	A	81.1	Confident	76.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.4	-51	173.5	0	0	0	0	0	112.7	L294 Q297 A298 S361 S365 V366 V367	L294-A363 HydrophobicContact CD1-CB 3.8Å; L294-A363 HydrophobicContact CG-CB 4.19Å; L294-A363 VanDerWaalsContact O-CB 3.26Å; L294-A363 WeakPolarHBondContact O-CB 3.17Å; Q297-A363 HydrophobicContact CB-CB 4.07Å; A298-A363 HydrophobicContact CB-CB 3.9Å; S361-A363 PolarHBondContact O-N 2.86Å; S361-A363 PolarHBondContact OG-N 2.83Å; A363-S365 PolarHBondContact O-N 3.07Å; A363-V366 PolarHBondContact O-N 2.99Å; A363-V367 WeakPolarHBondContact O-CB 3.46Å; A363-V367 WeakPolarHBondContact O-CG2 3.16Å; A363-V367 PolarHBondContact O-N 2.83Å
364	V	83	Confident	76.8	Confident	22 Å²	22	45.2 Å²	45.2	13%	0.133	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-39.7	179.2	177.5	0	0	0	0	110.8	A298 A301 P360 S361 D362 R368	A298-V364 HydrophobicContact CB-CG2 4.44Å; A301-V364 HydrophobicContact CB-CG2 4.21Å; P360-V364 HydrophobicContact CB-CB 4.35Å; P360-V364 HydrophobicContact CB-CG1 4.28Å; S361-V364 WeakPolarHBondContact O-CA 3.38Å; S361-V364 WeakPolarHBondContact O-CB 3.44Å; S361-V364 PolarHBondContact O-N 3.31Å; D362-V364 PolarHBondContact O-N 3.07Å; V364-R368 WeakPolarHBondContact O-CB 3.39Å; V364-R368 VanDerWaalsContact O-CG 3.3Å; V364-R368 WeakPolarHBondContact O-CG 3.35Å; V364-R368 PolarHBondContact O-N 3.18Å
365	S	83.8	Confident	76.7	Confident	10 Å²	10	52.1 Å²	52.1	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-44.9	178.5	-64.8	0	0	0	0	111.8	S361 D362 A363 L369	S361-S365 PolarHBondContact O-N 3.34Å; D362-S365 PolarHBondContact O-N 3.44Å; A363-S365 PolarHBondContact O-N 3.07Å; S365-L369 PolarHBondContact O-N 3.26Å; S365-L369 VanDerWaalsContact O-N 3.14Å
366	V	86.4	Confident	76.6	Confident	4 Å²	4	53 Å²	53	2%	0.024	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-44.2	177.1	169.3	0	0	0	0	111.5	L204 A211 P214 F291 L294 D362 A363 R368 L369 L370	L204-V366 HydrophobicContact CD2-CG1 4.03Å; A211-V366 HydrophobicContact CB-CG2 4.24Å; P214-V366 HydrophobicContact CG-CG2 4.49Å; F291-V366 HydrophobicContact CD1-CG1 4.04Å; F291-V366 HydrophobicContact CE1-CG1 4.01Å; L294-V366 HydrophobicContact CD2-CB 3.98Å; L294-V366 HydrophobicContact CD2-CG1 4.08Å; L294-V366 HydrophobicContact CD2-CG2 3.83Å; D362-V366 WeakPolarHBondContact O-CB 3.46Å; D362-V366 WeakPolarHBondContact O-CG2 3.42Å; D362-V366 PolarHBondContact O-N 3.18Å; A363-V366 PolarHBondContact O-N 2.99Å; V366-R368 VanDerWaalsContact C-N 3.34Å; V366-R368 PolarHBondContact O-N 2.83Å; V366-L369 PolarHBondContact O-N 3.07Å; V366-L370 HydrophobicContact CG1-CD1 3.85Å; V366-L370 HydrophobicContact CG1-CG 4.46Å; V366-L370 WeakPolarHBondContact O-CG 3.4Å; V366-L370 PolarHBondContact O-N 3.3Å
367	V	86	Confident	76.6	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.085	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-42.9	177.7	167.3	0	0	0	0	111.7	C295 A298 A363 L369 L370 E371	C295-V367 HydrophobicContact CB-CG2 4.1Å; A298-V367 HydrophobicContact CB-CB 4.22Å; A298-V367 HydrophobicContact CB-CG2 3.59Å; A363-V367 WeakPolarHBondContact O-CB 3.46Å; A363-V367 WeakPolarHBondContact O-CG2 3.16Å; A363-V367 PolarHBondContact O-N 2.83Å; V367-L369 VanDerWaalsContact C-N 3.33Å; V367-L369 PolarHBondContact O-N 3.37Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 PolarHBondContact O-N 2.88Å; V367-E371 HydrophobicContact CG1-CG 4.45Å; V367-E371 WeakPolarHBondContact O-CG 3.46Å; V367-E371 PolarHBondContact O-N 2.88Å
368	R	84.6	Confident	76.5	Confident	104 Å²	104	54.8 Å²	54.8	39%	0.392	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-38.2	176.3	-76.6	174	176.2	171.7	1.9	113.1	V306 V364 V366 K372	V306-R368 VanDerWaalsContact CB-NH2 3.26Å; V364-R368 WeakPolarHBondContact O-CB 3.39Å; V364-R368 VanDerWaalsContact O-CG 3.3Å; V364-R368 WeakPolarHBondContact O-CG 3.35Å; V364-R368 PolarHBondContact O-N 3.18Å; V366-R368 VanDerWaalsContact C-N 3.34Å; V366-R368 PolarHBondContact O-N 2.83Å; R368-K372 WeakPolarHBondContact O-CG 3.48Å; R368-K372 PolarHBondContact O-N 2.92Å; R368-K372 VanDerWaalsContact O-N 3.08Å
369	L	84.2	Confident	75.8	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-42.6	175	-81.8	174.4	0	0	0	111.5	L204 R208 E348 S365 V366 V367 E371 K372 L373	L204-L369 HydrophobicContact CD1-CB 3.94Å; L204-L369 HydrophobicContact CD1-CD1 4.39Å; R208-L369 VanDerWaalsContact CD-CD1 3.45Å; E348-L369 WeakPolarHBondContact OE1-CD1 3.45Å; S365-L369 PolarHBondContact O-N 3.26Å; S365-L369 VanDerWaalsContact O-N 3.14Å; V366-L369 PolarHBondContact O-N 3.07Å; V367-L369 VanDerWaalsContact C-N 3.33Å; V367-L369 PolarHBondContact O-N 3.37Å; L369-E371 PolarHBondContact O-N 3.42Å; L369-K372 PolarHBondContact O-N 2.77Å; L369-L373 WeakPolarHBondContact O-CG 3.36Å; L369-L373 PolarHBondContact O-N 3.47Å
370	L	86	Confident	74.8	Confident	3 Å²	3	56 Å²	56	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-44.4	175.5	-74.3	161.1	0	0	0	111.7	L201 L204 F235 V366 V367 K372 L373 E374	L201-L370 HydrophobicContact CD2-CD2 4.31Å; L204-L370 HydrophobicContact CB-CD2 4.37Å; L204-L370 HydrophobicContact CD2-CD2 3.99Å; L204-L370 HydrophobicContact CD2-CG 4.15Å; F235-L370 HydrophobicContact CE1-CD2 4.19Å; F235-L370 HydrophobicContact CZ-CD1 3.7Å; F235-L370 HydrophobicContact CZ-CD2 4.09Å; V366-L370 HydrophobicContact CG1-CD1 3.85Å; V366-L370 HydrophobicContact CG1-CG 4.46Å; V366-L370 WeakPolarHBondContact O-CG 3.4Å; V366-L370 PolarHBondContact O-N 3.3Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 PolarHBondContact O-N 2.88Å; L370-K372 VanDerWaalsContact C-N 3.35Å; L370-K372 PolarHBondContact O-N 3.31Å; L370-L373 PolarHBondContact O-N 3.35Å; L370-E374 WeakPolarHBondContact O-CG 3.43Å; L370-E374 PolarHBondContact O-N 3.44Å
371	E	84.8	Confident	73.6	Confident	87 Å²	87	61.4 Å²	61.4	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-40.5	176.8	-72.5	172.8	170.4	0	0	112.5	V367 L369 L373 E374 F375	V367-E371 HydrophobicContact CG1-CG 4.45Å; V367-E371 WeakPolarHBondContact O-CG 3.46Å; V367-E371 PolarHBondContact O-N 2.88Å; L369-E371 PolarHBondContact O-N 3.42Å; E371-L373 VanDerWaalsContact C-N 3.34Å; E371-E374 PolarHBondContact O-N 3.5Å; E371-F375 PolarHBondContact O-N 3.27Å
372	K	81.6	Confident	71.9	Confident	111 Å²	111	66.8 Å²	66.8	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-41.5	173.8	-75.6	178.6	174.9	-167.7	0	112	E344 R368 L369 L370 F375 A376	E344-K372 IonicContact OE1-NZ 3.12Å; E344-K372 PolarHBondContact OE1-NZ 3.04Å; R368-K372 WeakPolarHBondContact O-CG 3.48Å; R368-K372 PolarHBondContact O-N 2.92Å; R368-K372 VanDerWaalsContact O-N 3.08Å; L369-K372 PolarHBondContact O-N 2.77Å; L370-K372 VanDerWaalsContact C-N 3.35Å; L370-K372 PolarHBondContact O-N 3.31Å; K372-F375 PolarHBondContact O-N 3.04Å; K372-A376 PolarHBondContact O-N 3.41Å
373	L	81.2	Confident	70.1	Confident	39 Å²	39	68.5 Å²	68.5	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-66.7	-40.7	177.7	-73.1	175.2	0	0	0	111.6	L204 L207 L369 L370 E371 F375 A376 E377	L204-L373 HydrophobicContact CB-CD1 4.08Å; L204-L373 HydrophobicContact CD1-CD1 3.95Å; L207-L373 HydrophobicContact CD2-CD2 4.03Å; L369-L373 WeakPolarHBondContact O-CG 3.36Å; L369-L373 PolarHBondContact O-N 3.47Å; L370-L373 PolarHBondContact O-N 3.35Å; E371-L373 VanDerWaalsContact C-N 3.34Å; L373-F375 VanDerWaalsContact C-N 3.3Å; L373-F375 PolarHBondContact O-N 3.01Å; L373-A376 PolarHBondContact O-N 3.34Å; L373-A376 VanDerWaalsContact O-N 3.12Å; L373-E377 PolarHBondContact O-N 3.11Å
374	E	77.2	Confident	68.3	Low	48 Å²	48	70.8 Å²	70.8	22%	0.224	39%	0.387	C	S	.	.	H	α-helix	trans	-60.3	-41.1	174.4	-74.3	-179.7	163.3	0	0	111.5	K200 R234 L370 E371 A376 N378	K200-E374 IonicContact NZ-OE1 3.2Å; K200-E374 PolarHBondContact NZ-OE1 2.88Å; R234-E374 IonicContact NH2-OE2 2.87Å; L370-E374 WeakPolarHBondContact O-CG 3.43Å; L370-E374 PolarHBondContact O-N 3.44Å; E371-E374 PolarHBondContact O-N 3.5Å; E374-A376 VanDerWaalsContact C-N 3.31Å; E374-A376 PolarHBondContact O-N 3.44Å; E374-N378 WeakPolarHBondContact O-CB 3.45Å; E374-N378 VanDerWaalsContact O-CG 3.24Å; E374-N378 PolarHBondContact O-N 2.8Å; E374-N378 PolarHBondContact O-ND2 3.43Å
375	F	71.5	Confident	66.6	Low	171 Å²	171	75.9 Å²	75.9	75%	0.75	42%	0.418	S	S	*	.	H	α-helix	trans	-65.1	-36	175.4	-162.8	-92.5	0	0	0	112.3	E371 K372 L373	E371-F375 PolarHBondContact O-N 3.27Å; K372-F375 PolarHBondContact O-N 3.04Å; L373-F375 VanDerWaalsContact C-N 3.3Å; L373-F375 PolarHBondContact O-N 3.01Å
376	A	68.1	Low	65	Low	54 Å²	54	80.4 Å²	80.4	45%	0.446	45%	0.445	S	S	.	.	H	α-helix	trans	-76.1	-39.5	179	0	0	0	0	0	113.6	K372 L373 E374 A379 N380	K372-A376 PolarHBondContact O-N 3.41Å; L373-A376 PolarHBondContact O-N 3.34Å; L373-A376 VanDerWaalsContact O-N 3.12Å; E374-A376 VanDerWaalsContact C-N 3.31Å; E374-A376 PolarHBondContact O-N 3.44Å; A376-A379 WeakPolarHBondContact O-CB 3.36Å; A376-A379 PolarHBondContact O-N 2.83Å; A376-A379 VanDerWaalsContact O-N 3.13Å; A376-N380 PolarHBondContact O-N 2.75Å
377	E	61	Low	63.3	Low	57 Å²	57	87 Å²	87	27%	0.266	48%	0.476	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176.1	-88.2	-177.4	167.1	0	0	111.7	L373 A379 N380	L373-E377 PolarHBondContact O-N 3.11Å; E377-A379 PolarHBondContact O-N 2.77Å; E377-A379 VanDerWaalsContact O-N 3.14Å; E377-N380 CarbonylContact O-C 3.32Å; E377-N380 VanDerWaalsContact O-C 3.32Å; E377-N380 PolarHBondContact O-N 3.25Å
378	N	55.7	Low	61.7	Low	137 Å²	137	88.5 Å²	88.5	73%	0.733	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.8	174	-72.2	-29.5	0	0	0	112.8	E374	E374-N378 WeakPolarHBondContact O-CB 3.45Å; E374-N378 VanDerWaalsContact O-CG 3.24Å; E374-N378 PolarHBondContact O-N 2.8Å; E374-N378 PolarHBondContact O-ND2 3.43Å
379	A	48.4	Very low	60.1	Low	81 Å²	81	90.2 Å²	90.2	67%	0.669	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-14.3	174.3	0	0	0	0	0	113.5	A376 E377	A376-A379 WeakPolarHBondContact O-CB 3.36Å; A376-A379 PolarHBondContact O-N 2.83Å; A376-A379 VanDerWaalsContact O-N 3.13Å; E377-A379 PolarHBondContact O-N 2.77Å; E377-A379 VanDerWaalsContact O-N 3.14Å
380	N	42.5	Very low	58.9	Low	110 Å²	110	93.5 Å²	93.5	59%	0.588	52%	0.518	S	S	*	.			trans	-144.2	80.1	-173.3	-142.8	22.5	0	0	0	111.6	A376 E377 E382	A376-N380 PolarHBondContact O-N 2.75Å; E377-N380 CarbonylContact O-C 3.32Å; E377-N380 VanDerWaalsContact O-C 3.32Å; E377-N380 PolarHBondContact O-N 3.25Å; N380-E382 PolarHBondContact O-N 3.03Å
381	V	40	Very low	57.7	Low	133 Å²	133	98.9 Å²	98.9	81%	0.806	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-5.7	-169.8	177.2	0	0	0	0	114.5
382	E	42.1	Very low	57	Low	178 Å²	178	96 Å²	96	83%	0.832	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-4.8	-172.4	-67.2	-174.5	164.8	0	0	115.8	N380 A384	N380-E382 PolarHBondContact O-N 3.03Å; E382-A384 PolarHBondContact O-N 2.92Å
383	A	43.1	Very low	57	Low	68 Å²	68	99 Å²	99	56%	0.562	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-85	-4.8	-169	0	0	0	0	0	116.3
384	A	43.1	Very low	57.2	Low	48 Å²	48	100.8 Å²	100.8	40%	0.397	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-92.7	5	-163	0	0	0	0	0	116.9	V199 E382	V199-A384 HydrophobicContact CG1-CB 4.01Å; E382-A384 PolarHBondContact O-N 2.92Å
385	T	48	Very low	57.9	Low	129 Å²	129	101.3 Å²	101.3	79%	0.791	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-114.6	16.2	-176.9	47.6	0	0	0	0	115	Q387	T385-Q387 VanDerWaalsContact C-N 3.29Å; T385-Q387 PolarHBondContact O-N 3.27Å
386	V	49	Very low	58.8	Low	105 Å²	105	98.1 Å²	98.1	64%	0.636	57%	0.567	S	S	*	*			trans	-78.2	87.6	171.4	-170.5	0	0	0	0	108	D388	V386-D388 PolarHBondContact O-N 2.91Å
387	Q	51.2	Low	59.8	Low	141 Å²	141	97.4 Å²	97.4	66%	0.659	56%	0.556	S	S	*	*			trans	-48.8	114.5	148.2	-83	-177.1	-19.1	0	0	105.3	T385 N389	T385-Q387 VanDerWaalsContact C-N 3.29Å; T385-Q387 PolarHBondContact O-N 3.27Å; Q387-N389 VanDerWaalsContact C-N 3.34Å; Q387-N389 PolarHBondContact O-N 3.48Å
388	D	53	Low	61.1	Low	46 Å²	46	101 Å²	101	25%	0.246	57%	0.573	C	S	.	*			trans	-59.4	107	171.3	-104	21.8	0	0	0	105.3	K206 R243 V386 D390	K206-D388 IonicContact NZ-OD1 2.71Å; K206-D388 PolarHBondContact NZ-OD1 3.42Å; R243-D388 IonicContact CZ-OD2 2.8Å; R243-D388 VanDerWaalsContact CZ-OD2 3.23Å; R243-D388 IonicContact NH1-OD1 3.56Å; R243-D388 PolarHBondContact NH1-OD1 2.94Å; R243-D388 IonicContact NH1-OD2 3.27Å; R243-D388 PolarHBondContact NH1-OD2 3.3Å; R243-D388 IonicContact NH2-OD2 3.42Å; V386-D388 PolarHBondContact O-N 2.91Å; D388-D390 HydrophobicContact CB-CB 4.41Å; D388-D390 PolarHBondContact O-N 3.49Å
389	N	50.1	Low	62.8	Low	141 Å²	141	98.9 Å²	98.9	75%	0.754	56%	0.555	S	S	*	*			trans	-69.5	29.7	168.6	-74.1	-23.7	0	0	0	110.7	Q387 S391	Q387-N389 VanDerWaalsContact C-N 3.34Å; Q387-N389 PolarHBondContact O-N 3.48Å; N389-S391 PolarHBondContact O-N 3.44Å; N389-S391 PolarHBondContact O-OG 2.92Å
390	D	58.8	Low	64.6	Low	77 Å²	77	96.6 Å²	96.6	41%	0.412	53%	0.531	S	S	.	.			trans	-66.8	109.1	171.1	-170	7.8	0	0	0	106.3	Y194 D388 G392	Y194-D390 PolarHBondContact OH-O 2.87Å; D388-D390 HydrophobicContact CB-CB 4.41Å; D388-D390 PolarHBondContact O-N 3.49Å; D390-G392 PolarHBondContact O-N 2.99Å; D390-G392 PolarHBondContact OD1-N 2.64Å; D390-G392 VanDerWaalsContact OD1-N 3.17Å
391	S	62.1	Low	66.5	Low	116 Å²	116	97.1 Å²	97.1	81%	0.811	53%	0.534	S	S	*	.			trans	-85.2	4.3	-180	-26.6	0	0	0	0	111	N389	N389-S391 PolarHBondContact O-N 3.44Å; N389-S391 PolarHBondContact O-OG 2.92Å
392	G	69.6	Low	68.3	Low	25 Å²	25	94.4 Å²	94.4	26%	0.258	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-62.2	135.8	-178.4	0	0	0	0	0	111.8	Y194 D390	Y194-G392 WeakPolarHBondContact CE2-O 3.48Å; Y194-G392 PolarHBondContact OH-O 3.03Å; D390-G392 PolarHBondContact O-N 2.99Å; D390-G392 PolarHBondContact OD1-N 2.64Å; D390-G392 VanDerWaalsContact OD1-N 3.17Å
393	E	80.7	Confident	69.8	Low	174 Å²	174	92.2 Å²	92.2	81%	0.813	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-60.8	149.2	173.8	-65.6	179.8	168.1	0	0	110.3	K244	K244-E393 PolarHBondContact NZ-O 2.73Å
394	E	86.3	Confident	71	Confident	77 Å²	77	97.1 Å²	97.1	36%	0.36	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-79.6	153.1	169.5	57.4	-175.3	-168.3	0	0	110.3	Y194	Y194-E394 HydrophobicContact CD2-CB 3.98Å; Y194-E394 HydrophobicContact CE2-CB 4.25Å
395	D	91.6	Very high	72.4	Confident	60 Å²	60	101.3 Å²	101.3	32%	0.321	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-72.5	144.2	179	-63.9	-32.3	0	0	0	110.2	H191 S192	H191-D395 WeakPolarHBondContact CA-OD2 3.47Å; H191-D395 PolarHBondContact CE1-O 2.88Å; S192-D395 PolarHBondContact N-OD2 2.95Å; S192-D395 PolarHBondContact O-N 3.47Å
396	N	90.3	Very high	73.7	Confident	103 Å²	103	98.5 Å²	98.5	55%	0.551	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-74.3	145.9	179.8	-175.2	3.4	0	0	0	111.2	H191 E398 W399	H191-N396 PolarHBondContact CE1-O 3.27Å; N396-E398 WeakPolarHBondContact ND2-CB 3.31Å; N396-E398 PolarHBondContact ND2-OE2 2.7Å; N396-E398 PolarHBondContact OD1-N 3.29Å; N396-W399 VanDerWaalsContact O-CD1 3.24Å
397	D	90.2	Very high	74.6	Confident	39 Å²	39	97 Å²	97	21%	0.209	49%	0.489	C	S	.	.			trans	-91.5	-2.3	179.5	-66.3	-8.4	0	0	0	113.5	H191 Y252 K279 W399 L400	H191-D397 IonicContact CE1-OD1 3.96Å; H191-D397 PolarHBondContact CE1-OD1 2.92Å; H191-D397 VanDerWaalsContact CE1-OD1 3.23Å; H191-D397 IonicContact NE2-OD1 3.42Å; H191-D397 PolarHBondContact NE2-OD1 3.15Å; Y252-D397 VanDerWaalsContact CE1-OD1 3.26Å; Y252-D397 WeakPolarHBondContact CE1-OD1 3.32Å; Y252-D397 PolarHBondContact OH-OD1 2.72Å; Y252-D397 PolarHBondContact OH-OD2 3.47Å; K279-D397 WeakPolarHBondContact CE-OD2 3.28Å; K279-D397 IonicContact NZ-OD1 3.99Å; K279-D397 PolarHBondContact NZ-OD1 2.92Å; K279-D397 IonicContact NZ-OD2 3.13Å; K279-D397 PolarHBondContact NZ-OD2 3.13Å; D397-W399 PolarHBondContact O-N 3.2Å; D397-L400 HydrophobicContact CB-CD1 4.32Å; D397-L400 VanDerWaalsContact O-CB 3.31Å; D397-L400 WeakPolarHBondContact O-CB 3.47Å; D397-L400 PolarHBondContact O-N 2.91Å
398	E	88.4	Confident	75.4	Confident	134 Å²	134	93.5 Å²	93.5	63%	0.626	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-52.7	-31.3	-175.2	-172.8	169.8	-167.2	0	0	113.6	N396 L400 N401	N396-E398 WeakPolarHBondContact ND2-CB 3.31Å; N396-E398 PolarHBondContact ND2-OE2 2.7Å; N396-E398 PolarHBondContact OD1-N 3.29Å; E398-L400 PolarHBondContact O-N 3.04Å; E398-N401 PolarHBondContact O-N 3.47Å
399	W	89.9	Confident	76.4	Confident	91 Å²	91	96.8 Å²	96.8	35%	0.345	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-63.9	-17.9	176.5	72.3	-89.2	0	0	0	114.4	H191 K249 Y252 A253 N396 D397 N401	H191-W399 AromaticContact CE1-NE1 3.78Å; H191-W399 AromaticContact ND1-NE1 3.47Å; H191-W399 PolarHBondContact ND1-NE1 2.86Å; K249-W399 HydrophobicContact CB-CH2 3.44Å; K249-W399 VanDerWaalsContact CB-CH2 3.44Å; K249-W399 HydrophobicContact CB-CZ2 3.58Å; K249-W399 HydrophobicContact CB-CZ3 4.07Å; K249-W399 HydrophobicContact CD-CD2 4.19Å; K249-W399 HydrophobicContact CD-CE3 4.35Å; K249-W399 HydrophobicContact CD-CH2 4.4Å; K249-W399 HydrophobicContact CD-CZ2 4.24Å; K249-W399 HydrophobicContact CD-CZ3 4.46Å; K249-W399 HydrophobicContact CG-CD2 4.41Å; K249-W399 HydrophobicContact CG-CH2 3.93Å; K249-W399 HydrophobicContact CG-CZ2 3.59Å; K249-W399 HydrophobicContact CG-CZ3 4.46Å; K249-W399 VanDerWaalsContact O-CH2 3.23Å; K249-W399 WeakPolarHBondContact O-CH2 3.26Å; Y252-W399 HydrophobicContact CD1-CZ2 4.1Å; A253-W399 HydrophobicContact CB-CH2 3.92Å; N396-W399 VanDerWaalsContact O-CD1 3.24Å; D397-W399 PolarHBondContact O-N 3.2Å; W399-N401 VanDerWaalsContact C-N 3.32Å
400	L	86.4	Confident	77.3	Confident	34 Å²	34	95.5 Å²	95.5	18%	0.178	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-75.3	-22.7	172.4	-68.4	173.7	0	0	0	112.4	Y252 A253 A256 L257 D397 E398 V402	Y252-L400 HydrophobicContact CD1-CD1 4.18Å; Y252-L400 HydrophobicContact CE1-CD1 3.73Å; A253-L400 HydrophobicContact CB-CD2 3.59Å; A256-L400 HydrophobicContact CB-CD1 3.98Å; L257-L400 HydrophobicContact CD1-CD2 4.34Å; D397-L400 HydrophobicContact CB-CD1 4.32Å; D397-L400 VanDerWaalsContact O-CB 3.31Å; D397-L400 WeakPolarHBondContact O-CB 3.47Å; D397-L400 PolarHBondContact O-N 2.91Å; E398-L400 PolarHBondContact O-N 3.04Å; L400-V402 PolarHBondContact O-N 3.4Å
401	N	83.6	Confident	77.4	Confident	120 Å²	120	97.9 Å²	97.9	64%	0.642	49%	0.487	S	S	*	.			trans	-97.8	75.6	-175.4	-62.6	-41.2	0	0	0	110	E398 W399 K403	E398-N401 PolarHBondContact O-N 3.47Å; W399-N401 VanDerWaalsContact C-N 3.32Å; N401-K403 PolarHBondContact O-N 2.8Å
402	V	76.4	Confident	77.6	Confident	76 Å²	76	99.3 Å²	99.3	46%	0.461	48%	0.479	S	S	.	.			trans	-78.7	118.4	175.7	-167.1	0	0	0	0	109.1	L400 D406 L407	L400-V402 PolarHBondContact O-N 3.4Å; V402-D406 HydrophobicContact CG1-CB 3.98Å; V402-L407 HydrophobicContact CG1-CD2 3.73Å; V402-L407 HydrophobicContact CG1-CG 3.71Å
403	K	74.9	Confident	77.3	Confident	132 Å²	132	103.9 Å²	103.9	57%	0.574	49%	0.493	S	S	*	.			trans	-78.1	157.8	174.8	-64.5	177.2	-178	173.1	0	110.3	N401 E405 D406 L407	N401-K403 PolarHBondContact O-N 2.8Å; K403-E405 PolarHBondContact O-N 3.07Å; K403-D406 PolarHBondContact N-OD2 3.22Å; K403-D406 PolarHBondContact O-N 3.29Å; K403-D406 VanDerWaalsContact O-N 3.12Å; K403-L407 PolarHBondContact O-N 3.42Å; K403-L407 VanDerWaalsContact O-N 3.09Å
404	Y	68.6	Low	76	Confident	172 Å²	172	101.6 Å²	101.6	68%	0.675	48%	0.483	S	S	*	.	H	α-helix	trans	-57.9	-35	176.7	-175.5	-97.2	0	0	0	112.5	L407 N408	Y404-L407 PolarHBondContact O-N 3.17Å; Y404-N408 VanDerWaalsContact CE1-ND2 3.3Å; Y404-N408 WeakPolarHBondContact CE1-ND2 3.29Å; Y404-N408 PolarHBondContact O-N 3.15Å; Y404-N408 VanDerWaalsContact O-N 3.09Å
405	E	72.6	Confident	74.2	Confident	136 Å²	136	101.7 Å²	101.7	64%	0.636	49%	0.489	S	S	*	.	H	α-helix	trans	-62.9	-44.7	175.8	-65.6	128.3	-165.7	0	0	112	K403 L407 N408 E409	K403-E405 PolarHBondContact O-N 3.07Å; E405-L407 VanDerWaalsContact C-N 3.33Å; E405-L407 PolarHBondContact O-N 2.92Å; E405-N408 PolarHBondContact O-N 3.25Å; E405-E409 PolarHBondContact O-N 3.05Å
406	D	74.6	Confident	72	Confident	70 Å²	70	104.4 Å²	104.4	37%	0.374	51%	0.507	S	S	.	.	H	α-helix	trans	-65.2	-38.3	178.4	-55.7	-36.8	0	0	0	111	V402 K403 E409 M410	V402-D406 HydrophobicContact CG1-CB 3.98Å; K403-D406 PolarHBondContact N-OD2 3.22Å; K403-D406 PolarHBondContact O-N 3.29Å; K403-D406 VanDerWaalsContact O-N 3.12Å; D406-E409 PolarHBondContact O-N 2.92Å; D406-M410 WeakPolarHBondContact O-CG 3.42Å; D406-M410 PolarHBondContact O-N 3.44Å
407	L	68.2	Low	69.8	Low	72 Å²	72	103.9 Å²	103.9	38%	0.377	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-45.8	173.9	-73.2	174.1	0	0	0	111.5	V402 K403 Y404 E405 E409 M410 F411	V402-L407 HydrophobicContact CG1-CD2 3.73Å; V402-L407 HydrophobicContact CG1-CG 3.71Å; K403-L407 PolarHBondContact O-N 3.42Å; K403-L407 VanDerWaalsContact O-N 3.09Å; Y404-L407 PolarHBondContact O-N 3.17Å; E405-L407 VanDerWaalsContact C-N 3.33Å; E405-L407 PolarHBondContact O-N 2.92Å; L407-E409 VanDerWaalsContact C-N 3.3Å; L407-E409 PolarHBondContact O-N 2.96Å; L407-M410 WeakPolarHBondContact O-CB 3.5Å; L407-M410 PolarHBondContact O-N 3.46Å; L407-F411 VanDerWaalsContact O-CD2 3.26Å; L407-F411 WeakPolarHBondContact O-CD2 3.32Å; L407-F411 PolarHBondContact O-N 2.99Å
408	N	67.4	Low	67.5	Low	69 Å²	69	108.1 Å²	108.1	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-64	-35.9	177.7	-88.2	-10.9	0	0	0	112.2	Y404 E405 K412	Y404-N408 VanDerWaalsContact CE1-ND2 3.3Å; Y404-N408 WeakPolarHBondContact CE1-ND2 3.29Å; Y404-N408 PolarHBondContact O-N 3.15Å; Y404-N408 VanDerWaalsContact O-N 3.09Å; E405-N408 PolarHBondContact O-N 3.25Å; N408-K412 WeakPolarHBondContact O-CB 3.46Å; N408-K412 WeakPolarHBondContact O-CG 3.41Å; N408-K412 PolarHBondContact O-N 3.32Å
409	E	74.7	Confident	65.2	Low	115 Å²	115	110.1 Å²	110.1	54%	0.537	54%	0.538	S	S	.	.	H	α-helix	trans	-68	-40.7	174.2	-163.1	172.4	-176.4	0	0	111.7	E405 D406 L407 K412 Q413	E405-E409 PolarHBondContact O-N 3.05Å; D406-E409 PolarHBondContact O-N 2.92Å; L407-E409 VanDerWaalsContact C-N 3.3Å; L407-E409 PolarHBondContact O-N 2.96Å; E409-K412 PolarHBondContact O-N 2.88Å; E409-Q413 WeakPolarHBondContact O-CG 3.4Å; E409-Q413 PolarHBondContact O-N 2.91Å
410	M	68.7	Low	62.8	Low	113 Å²	113	111 Å²	111	56%	0.557	56%	0.556	S	S	*	*	H	α-helix	trans	-61.1	-44.2	173.6	-72.9	179.4	66.5	0	0	112.2	D406 L407 K412 Q413 Q414	D406-M410 WeakPolarHBondContact O-CG 3.42Å; D406-M410 PolarHBondContact O-N 3.44Å; L407-M410 WeakPolarHBondContact O-CB 3.5Å; L407-M410 PolarHBondContact O-N 3.46Å; M410-K412 PolarHBondContact O-N 3.11Å; M410-Q413 PolarHBondContact O-N 3.08Å; M410-Q414 PolarHBondContact O-N 3.28Å; M410-Q414 VanDerWaalsContact O-N 3.11Å
411	F	60.6	Low	60.7	Low	127 Å²	127	117.8 Å²	117.8	56%	0.557	58%	0.584	S	S	*	*	H	α-helix	trans	-61.9	-42.1	174.4	-87.1	-71	0	0	0	111.7	L407 Q413 Q414 T415	L407-F411 VanDerWaalsContact O-CD2 3.26Å; L407-F411 WeakPolarHBondContact O-CD2 3.32Å; L407-F411 PolarHBondContact O-N 2.99Å; F411-Q413 PolarHBondContact O-N 3.22Å; F411-Q414 PolarHBondContact O-N 2.97Å; F411-T415 WeakPolarHBondContact O-CB 3.44Å; F411-T415 WeakPolarHBondContact O-CG2 3.41Å; F411-T415 PolarHBondContact O-N 3.45Å; F411-T415 PolarHBondContact O-OG1 3.45Å; F411-T415 VanDerWaalsContact O-OG1 3.13Å
412	K	65.1	Low	59	Low	146 Å²	146	114.5 Å²	114.5	64%	0.635	57%	0.568	S	S	*	*	H	α-helix	trans	-61.8	-42.1	176.1	-78.9	178.3	-178.3	-179.5	0	112.4	N408 E409 M410 T415 T416	N408-K412 WeakPolarHBondContact O-CB 3.46Å; N408-K412 WeakPolarHBondContact O-CG 3.41Å; N408-K412 PolarHBondContact O-N 3.32Å; E409-K412 PolarHBondContact O-N 2.88Å; M410-K412 PolarHBondContact O-N 3.11Å; K412-T415 WeakPolarHBondContact CA-OG1 3.26Å; K412-T415 PolarHBondContact O-N 3.47Å; K412-T415 PolarHBondContact O-OG1 3.46Å; K412-T415 VanDerWaalsContact O-OG1 3.1Å; K412-T416 PolarHBondContact O-N 2.69Å; K412-T416 PolarHBondContact O-OG1 2.73Å
413	Q	63.9	Low	57.6	Low	121 Å²	121	113.7 Å²	113.7	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-64.2	-41.1	178.6	-72.5	177.6	14.9	0	0	111.9	E409 M410 F411 T416	E409-Q413 WeakPolarHBondContact O-CG 3.4Å; E409-Q413 PolarHBondContact O-N 2.91Å; M410-Q413 PolarHBondContact O-N 3.08Å; F411-Q413 PolarHBondContact O-N 3.22Å; Q413-T416 PolarHBondContact O-OG1 3.44Å; Q413-T416 VanDerWaalsContact O-OG1 3.05Å
414	Q	54.5	Low	56.4	Low	127 Å²	127	113.2 Å²	113.2	59%	0.593	57%	0.568	S	S	*	*	H	α-helix	trans	-64	-48.6	172.8	-81.1	-178.3	-25.5	0	0	111	M410 F411 T416 S417 F418	M410-Q414 PolarHBondContact O-N 3.28Å; M410-Q414 VanDerWaalsContact O-N 3.11Å; F411-Q414 PolarHBondContact O-N 2.97Å; Q414-T416 PolarHBondContact O-N 3.03Å; Q414-S417 WeakPolarHBondContact O-CB 3.12Å; Q414-S417 PolarHBondContact O-N 2.72Å; Q414-S417 VanDerWaalsContact O-N 3.09Å; Q414-F418 WeakPolarHBondContact O-CD2 3.24Å
415	T	48.7	Very low	55.6	Low	78 Å²	78	111.6 Å²	111.6	48%	0.479	57%	0.567	S	S	.	*	H	α-helix	trans	-68.7	-28.1	-176.3	62.2	0	0	0	0	114	F411 K412 S417 F418	F411-T415 WeakPolarHBondContact O-CB 3.44Å; F411-T415 WeakPolarHBondContact O-CG2 3.41Å; F411-T415 PolarHBondContact O-N 3.45Å; F411-T415 PolarHBondContact O-OG1 3.45Å; F411-T415 VanDerWaalsContact O-OG1 3.13Å; K412-T415 WeakPolarHBondContact CA-OG1 3.26Å; K412-T415 PolarHBondContact O-N 3.47Å; K412-T415 PolarHBondContact O-OG1 3.46Å; K412-T415 VanDerWaalsContact O-OG1 3.1Å; T415-S417 PolarHBondContact O-N 3.23Å; T415-F418 CarbonylContact O-C 3.56Å; T415-F418 WeakPolarHBondContact O-CA 3.45Å; T415-F418 WeakPolarHBondContact O-CB 3.19Å; T415-F418 PolarHBondContact O-N 2.9Å
416	T	44.2	Very low	54.6	Low	117 Å²	117	111 Å²	111	72%	0.718	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-16.6	171.9	35.2	0	0	0	0	114.2	K412 Q413 Q414	K412-T416 PolarHBondContact O-N 2.69Å; K412-T416 PolarHBondContact O-OG1 2.73Å; Q413-T416 PolarHBondContact O-OG1 3.44Å; Q413-T416 VanDerWaalsContact O-OG1 3.05Å; Q414-T416 PolarHBondContact O-N 3.03Å
417	S	43.3	Very low	53.5	Low	93 Å²	93	114.5 Å²	114.5	65%	0.65	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-17.9	169	-54.9	0	0	0	0	112.5	Q414 T415 E419	Q414-S417 WeakPolarHBondContact O-CB 3.12Å; Q414-S417 PolarHBondContact O-N 2.72Å; Q414-S417 VanDerWaalsContact O-N 3.09Å; T415-S417 PolarHBondContact O-N 3.23Å; S417-E419 PolarHBondContact O-N 2.92Å
418	F	43.3	Very low	53	Low	127 Å²	127	119.8 Å²	119.8	56%	0.557	59%	0.585	S	S	*	*			trans	-86.9	74.9	173.1	-70.1	-94.3	0	0	0	110.4	E106 Q414 T415 P420	E106-F418 WeakPolarHBondContact OE1-CE1 3.28Å; Q414-F418 WeakPolarHBondContact O-CD2 3.24Å; T415-F418 CarbonylContact O-C 3.56Å; T415-F418 WeakPolarHBondContact O-CA 3.45Å; T415-F418 WeakPolarHBondContact O-CB 3.19Å; T415-F418 PolarHBondContact O-N 2.9Å; F418-P420 WeakPolarHBondContact O-CD 3.45Å
419	E	40.3	Very low	52.6	Low	177 Å²	177	123.1 Å²	123.1	83%	0.827	60%	0.597	S	S	*	*			trans	-61.9	124.2	149.7	-90.1	-163.3	168.9	0	0	106.5	S417 F421	S417-E419 PolarHBondContact O-N 2.92Å; E419-F421 VanDerWaalsContact C-N 3.34Å; E419-F421 PolarHBondContact O-N 2.83Å
420	P	38.7	Very low	51.5	Low	110 Å²	110	120.2 Å²	120.2	71%	0.714	59%	0.587	S	S	*	*			trans	-63.2	100.7	179	23.6	-30.3	0	0	0	108.1	F418 V422	F418-P420 WeakPolarHBondContact O-CD 3.45Å; P420-V422 PolarHBondContact O-N 2.88Å
421	F	43.4	Very low	50.8	Low	176 Å²	176	117.8 Å²	117.8	77%	0.772	58%	0.58	S	S	*	*			trans	-67.3	87.1	171.5	-178.6	-98.7	0	0	0	107.2	E419 P423	E419-F421 VanDerWaalsContact C-N 3.34Å; E419-F421 PolarHBondContact O-N 2.83Å; F421-P423 HydrophobicContact CD1-CG 4.02Å; F421-P423 HydrophobicContact CE1-CB 3.99Å; F421-P423 HydrophobicContact CE1-CG 3.85Å; F421-P423 WeakPolarHBondContact O-CD 3.21Å
422	V	46.6	Very low	50.7	Low	51 Å²	51	117.6 Å²	117.6	31%	0.309	58%	0.579	S	S	.	*			trans	-77.8	108.1	166.8	-171.9	0	0	0	0	105.7	P420 N424 F426 R427	P420-V422 PolarHBondContact O-N 2.88Å; V422-N424 PolarHBondContact O-N 3.43Å; V422-F426 HydrophobicContact CG1-CB 4.25Å; V422-F426 HydrophobicContact CG1-CD1 3.53Å; V422-F426 HydrophobicContact CG1-CE1 4.35Å; V422-F426 HydrophobicContact CG1-CG 4.31Å; V422-R427 HydrophobicContact CB-CG 4.33Å; V422-R427 HydrophobicContact CG1-CG 3.67Å
423	P	47.5	Very low	50.2	Low	58 Å²	58	116.9 Å²	116.9	38%	0.377	58%	0.576	S	S	.	*			trans	-55.9	136.2	-176.8	-22.9	33.9	0	0	0	109.2	F421 E425 F426 R427	F421-P423 HydrophobicContact CD1-CG 4.02Å; F421-P423 HydrophobicContact CE1-CB 3.99Å; F421-P423 HydrophobicContact CE1-CG 3.85Å; F421-P423 WeakPolarHBondContact O-CD 3.21Å; P423-E425 PolarHBondContact O-N 2.98Å; P423-F426 HydrophobicContact CB-CB 4.43Å; P423-F426 WeakPolarHBondContact O-CA 3.06Å; P423-F426 WeakPolarHBondContact O-CB 3.31Å; P423-F426 PolarHBondContact O-N 3.44Å; P423-R427 PolarHBondContact O-N 3.21Å
424	N	49.1	Very low	49.8	Very low	123 Å²	123	115.7 Å²	115.7	66%	0.658	57%	0.573	S	S	*	*	H	α-helix	trans	-55.2	-23.7	177.1	-91.9	-24	0	0	0	112.4	V422 R428	V422-N424 PolarHBondContact O-N 3.43Å; N424-R428 VanDerWaalsContact O-CB 3.31Å; N424-R428 WeakPolarHBondContact O-CB 3.48Å; N424-R428 PolarHBondContact O-N 3.34Å
425	E	51.7	Low	49.7	Very low	137 Å²	137	115.9 Å²	115.9	64%	0.64	57%	0.574	S	S	*	*	H	α-helix	trans	-68.8	-38.4	169.2	-79.3	-155.9	159.6	0	0	114	P423 R428 K429	P423-E425 PolarHBondContact O-N 2.98Å; E425-R428 PolarHBondContact O-N 3.34Å; E425-K429 VanDerWaalsContact O-CB 3.28Å; E425-K429 WeakPolarHBondContact O-CB 3.48Å; E425-K429 VanDerWaalsContact O-CG 3.3Å; E425-K429 WeakPolarHBondContact O-CG 3.28Å; E425-K429 PolarHBondContact O-N 2.66Å
426	F	51.4	Low	49.7	Very low	123 Å²	123	118.2 Å²	118.2	54%	0.539	58%	0.579	S	S	.	*	H	α-helix	trans	-67.3	-46.4	174.2	-174.4	-95.7	0	0	0	110.2	V422 P423 R428 K429 V430	V422-F426 HydrophobicContact CG1-CB 4.25Å; V422-F426 HydrophobicContact CG1-CD1 3.53Å; V422-F426 HydrophobicContact CG1-CE1 4.35Å; V422-F426 HydrophobicContact CG1-CG 4.31Å; P423-F426 HydrophobicContact CB-CB 4.43Å; P423-F426 WeakPolarHBondContact O-CA 3.06Å; P423-F426 WeakPolarHBondContact O-CB 3.31Å; P423-F426 PolarHBondContact O-N 3.44Å; F426-R428 VanDerWaalsContact C-N 3.33Å; F426-R428 PolarHBondContact O-N 2.83Å; F426-K429 PolarHBondContact O-N 2.96Å; F426-V430 HydrophobicContact CD1-CG2 3.9Å; F426-V430 HydrophobicContact CD2-CG2 4.4Å; F426-V430 HydrophobicContact CE1-CG2 3.62Å; F426-V430 HydrophobicContact CE2-CG2 4.13Å; F426-V430 HydrophobicContact CG-CG2 4.31Å; F426-V430 HydrophobicContact CZ-CG2 3.74Å; F426-V430 WeakPolarHBondContact O-CB 3.4Å; F426-V430 VanDerWaalsContact O-CG2 3.28Å; F426-V430 WeakPolarHBondContact O-CG2 3.43Å; F426-V430 PolarHBondContact O-N 3.23Å
427	R	52.2	Low	49.7	Very low	145 Å²	145	119.4 Å²	119.4	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-56	-46.5	172	-74	-175.5	176.6	177.9	0.9	111.5	V422 P423 S431	V422-R427 HydrophobicContact CB-CG 4.33Å; V422-R427 HydrophobicContact CG1-CG 3.67Å; P423-R427 PolarHBondContact O-N 3.21Å; R427-S431 WeakPolarHBondContact O-CB 3.39Å; R427-S431 PolarHBondContact O-N 3.29Å; R427-S431 PolarHBondContact O-OG 3.3Å
428	R	58.7	Low	49.7	Very low	182 Å²	182	119.6 Å²	119.6	69%	0.687	58%	0.578	S	S	*	*	H	α-helix	trans	-63.4	-42.5	175.6	-92.5	-179.7	61.6	105.5	-2.2	113.1	N424 E425 F426 K432	N424-R428 VanDerWaalsContact O-CB 3.31Å; N424-R428 WeakPolarHBondContact O-CB 3.48Å; N424-R428 PolarHBondContact O-N 3.34Å; E425-R428 PolarHBondContact O-N 3.34Å; F426-R428 VanDerWaalsContact C-N 3.33Å; F426-R428 PolarHBondContact O-N 2.83Å; R428-K432 VanDerWaalsContact O-CB 3.3Å; R428-K432 WeakPolarHBondContact O-CB 3.31Å; R428-K432 PolarHBondContact O-N 2.97Å
429	K	58.7	Low	49.2	Very low	140 Å²	140	118.3 Å²	118.3	61%	0.609	59%	0.585	S	S	*	*	H	α-helix	trans	-68.6	-41.1	-179.5	-81	177.7	-178.6	172.7	0	111.3	E425 F426 K432 F433	E425-K429 VanDerWaalsContact O-CB 3.28Å; E425-K429 WeakPolarHBondContact O-CB 3.48Å; E425-K429 VanDerWaalsContact O-CG 3.3Å; E425-K429 WeakPolarHBondContact O-CG 3.28Å; E425-K429 PolarHBondContact O-N 2.66Å; F426-K429 PolarHBondContact O-N 2.96Å; K429-K432 PolarHBondContact O-N 3.14Å; K429-F433 VanDerWaalsContact O-CB 3.25Å; K429-F433 WeakPolarHBondContact O-CB 3.48Å; K429-F433 PolarHBondContact O-N 3.08Å
430	V	51.7	Low	48.9	Very low	54 Å²	54	114.5 Å²	114.5	33%	0.327	58%	0.578	S	S	.	*	H	α-helix	trans	-65.9	-44.9	174.7	173.2	0	0	0	0	110.5	F426 K432 F433 I434	F426-V430 HydrophobicContact CD1-CG2 3.9Å; F426-V430 HydrophobicContact CD2-CG2 4.4Å; F426-V430 HydrophobicContact CE1-CG2 3.62Å; F426-V430 HydrophobicContact CE2-CG2 4.13Å; F426-V430 HydrophobicContact CG-CG2 4.31Å; F426-V430 HydrophobicContact CZ-CG2 3.74Å; F426-V430 WeakPolarHBondContact O-CB 3.4Å; F426-V430 VanDerWaalsContact O-CG2 3.28Å; F426-V430 WeakPolarHBondContact O-CG2 3.43Å; F426-V430 PolarHBondContact O-N 3.23Å; V430-K432 VanDerWaalsContact C-N 3.34Å; V430-K432 PolarHBondContact O-N 3.45Å; V430-F433 PolarHBondContact O-N 3.49Å; V430-I434 HydrophobicContact CG1-CD1 3.73Å; V430-I434 HydrophobicContact CG1-CG1 4.47Å; V430-I434 WeakPolarHBondContact O-CB 3.43Å; V430-I434 VanDerWaalsContact O-CG1 3.25Å; V430-I434 WeakPolarHBondContact O-CG1 3.5Å; V430-I434 PolarHBondContact O-N 2.96Å
431	S	53	Low	49	Very low	61 Å²	61	115.9 Å²	115.9	43%	0.427	58%	0.578	S	S	.	*	H	α-helix	trans	-61.7	-40.6	173	-62.8	0	0	0	0	112.4	R427 E435	R427-S431 WeakPolarHBondContact O-CB 3.39Å; R427-S431 PolarHBondContact O-N 3.29Å; R427-S431 PolarHBondContact O-OG 3.3Å; S431-E435 WeakPolarHBondContact O-CB 3.36Å; S431-E435 VanDerWaalsContact O-CG 3.25Å; S431-E435 WeakPolarHBondContact O-CG 3.49Å; S431-E435 PolarHBondContact O-N 3.37Å
432	K	59.5	Low	48.6	Very low	123 Å²	123	112.8 Å²	112.8	54%	0.535	59%	0.585	S	S	.	*	H	α-helix	trans	-66.3	-37.2	175.4	-127.8	-178.6	-179.9	-166.7	0	112.4	R428 K429 V430 Q436	R428-K432 VanDerWaalsContact O-CB 3.3Å; R428-K432 WeakPolarHBondContact O-CB 3.31Å; R428-K432 PolarHBondContact O-N 2.97Å; K429-K432 PolarHBondContact O-N 3.14Å; V430-K432 VanDerWaalsContact C-N 3.34Å; V430-K432 PolarHBondContact O-N 3.45Å; K432-Q436 WeakPolarHBondContact O-CB 3.49Å; K432-Q436 PolarHBondContact O-N 3.01Å
433	F	54.6	Low	47.9	Very low	131 Å²	131	113.9 Å²	113.9	58%	0.575	61%	0.606	S	S	*	*	H	α-helix	trans	-67.4	-45.3	179.1	-167.3	-93.9	0	0	0	110.6	K429 V430 Q436 E437	K429-F433 VanDerWaalsContact O-CB 3.25Å; K429-F433 WeakPolarHBondContact O-CB 3.48Å; K429-F433 PolarHBondContact O-N 3.08Å; V430-F433 PolarHBondContact O-N 3.49Å; F433-Q436 PolarHBondContact O-N 2.97Å; F433-E437 HydrophobicContact CE1-CG 4.43Å; F433-E437 PolarHBondContact O-N 3.5Å
434	I	55.4	Low	47.1	Very low	97 Å²	97	116.4 Å²	116.4	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-64.6	-41.3	176.2	-66	168.4	0	0	0	111.5	V430 Q436 S438	V430-I434 HydrophobicContact CG1-CD1 3.73Å; V430-I434 HydrophobicContact CG1-CG1 4.47Å; V430-I434 WeakPolarHBondContact O-CB 3.43Å; V430-I434 VanDerWaalsContact O-CG1 3.25Å; V430-I434 WeakPolarHBondContact O-CG1 3.5Å; V430-I434 PolarHBondContact O-N 2.96Å; I434-Q436 VanDerWaalsContact C-N 3.33Å; I434-S438 PolarHBondContact O-N 3.38Å; I434-S438 PolarHBondContact O-OG 3.37Å
435	E	51	Low	46.3	Very low	130 Å²	130	116.3 Å²	116.3	61%	0.607	63%	0.628	S	S	*	*	H	α-helix	trans	-69.5	-29.8	175.9	-74.7	172.5	-177.1	0	0	112.9	S431 S439	S431-E435 WeakPolarHBondContact O-CB 3.36Å; S431-E435 VanDerWaalsContact O-CG 3.25Å; S431-E435 WeakPolarHBondContact O-CG 3.49Å; S431-E435 PolarHBondContact O-N 3.37Å; E435-S439 PolarHBondContact O-OG 3.23Å
436	Q	49.4	Very low	45.4	Very low	127 Å²	127	115.6 Å²	115.6	59%	0.593	64%	0.635	S	S	*	*	H	α-helix	trans	-84.7	-28.9	-176.2	-168.2	156.2	-14.8	0	0	113.1	K432 F433 I434 S438	K432-Q436 WeakPolarHBondContact O-CB 3.49Å; K432-Q436 PolarHBondContact O-N 3.01Å; F433-Q436 PolarHBondContact O-N 2.97Å; I434-Q436 VanDerWaalsContact C-N 3.33Å; Q436-S438 VanDerWaalsContact C-N 3.31Å
437	E	44.8	Very low	44.7	Very low	142 Å²	142	114.9 Å²	114.9	66%	0.664	65%	0.645	S	S	*	*	H	α-helix	trans	-75.7	-20	167.1	-75.6	-168.4	156.7	0	0	113.1	F433 S439	F433-E437 HydrophobicContact CE1-CG 4.43Å; F433-E437 PolarHBondContact O-N 3.5Å; E437-S439 VanDerWaalsContact C-N 3.32Å; E437-S439 PolarHBondContact O-N 3.4Å
438	S	41.6	Very low	43.7	Very low	98 Å²	98	116.5 Å²	116.5	69%	0.685	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-4.1	176.9	-56.7	0	0	0	0	114.2	I434 Q436	I434-S438 PolarHBondContact O-N 3.38Å; I434-S438 PolarHBondContact O-OG 3.37Å; Q436-S438 VanDerWaalsContact C-N 3.31Å
439	S	34.3	Very low	42.5	Very low	99 Å²	99	117.6 Å²	117.6	69%	0.692	67%	0.669	S	S	*	*	S	Bend	trans	-149.9	20.3	-171	62.2	0	0	0	0	117.2	E435 E437	E435-S439 PolarHBondContact O-OG 3.23Å; E437-S439 VanDerWaalsContact C-N 3.32Å; E437-S439 PolarHBondContact O-N 3.4Å
440	S	33.3	Very low	41.4	Very low	97 Å²	97	116.3 Å²	116.3	68%	0.678	68%	0.678	S	S	*	*			trans	-162.5	73.4	174.2	173.8	0	0	0	0	113.6
441	I	40.5	Very low	40.5	Very low	139 Å²	139	126.2 Å²	126.2	71%	0.713	71%	0.709	S	S	*	*			trans	-130.4	102.8	149.5	-157.6	154	0	0	0	109.7	G443	I441-G443 PolarHBondContact O-N 2.93Å; I441-G443 VanDerWaalsContact O-N 3.11Å
442	A	34.5	Very low	39.5	Very low	112 Å²	112	126.4 Å²	126.4	93%	0.926	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	99.2	168.2	0	0	0	0	0	107.5
443	G	32.2	Very low	38.3	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.8	-9.6	172.7	0	0	0	0	0	118.5	I441	I441-G443 PolarHBondContact O-N 2.93Å; I441-G443 VanDerWaalsContact O-N 3.11Å
444	V	31.7	Very low	37.6	Very low	111 Å²	111	129 Å²	129	67%	0.673	75%	0.746	S	S	*	*			trans	-122.8	95.3	-179.8	-172.7	0	0	0	0	110.2	P446	V444-P446 WeakPolarHBondContact O-CD 3.43Å
445	C	32.6	Very low	37	Very low	122 Å²	122	130.7 Å²	130.7	82%	0.824	75%	0.754	S	S	*	*			trans	-68.8	120.5	159.8	-76.6	0	0	0	0	107.9	S447	C445-S447 PolarHBondContact O-N 2.81Å
446	P	32.9	Very low	37.4	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	74%	0.743	S	S	*	*			trans	-72	104.1	169.9	29	-28.9	0	0	0	107.5	V444 E448	V444-P446 WeakPolarHBondContact O-CD 3.43Å; P446-E448 PolarHBondContact O-N 3.14Å
447	S	36	Very low	37.5	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	75%	0.745	S	S	*	*			trans	-64.7	125.2	166	-175.1	0	0	0	0	108.1	C445 K449	C445-S447 PolarHBondContact O-N 2.81Å; S447-K449 PolarHBondContact O-N 2.86Å
448	E	31.7	Very low	38.1	Very low	180 Å²	180	126.6 Å²	126.6	84%	0.841	74%	0.737	S	S	*	*	S	Bend	trans	-58	94.4	174.8	-64.3	175.7	159	0	0	109.8	P446	P446-E448 PolarHBondContact O-N 3.14Å
449	K	32.8	Very low	39.1	Very low	205 Å²	205	125.2 Å²	125.2	89%	0.891	72%	0.724	S	S	*	*			trans	159.6	72	152.1	-85.1	155.7	-168.8	-178.4	0	111.6	S447	S447-K449 PolarHBondContact O-N 2.86Å
450	S	34.9	Very low	40.2	Very low	113 Å²	113	126.2 Å²	126.2	79%	0.79	72%	0.717	S	S	*	*	S	Bend	trans	-162.6	133.4	150.5	44.7	0	0	0	0	108.8	G452	S450-G452 PolarHBondContact O-N 2.96Å
451	R	33.7	Very low	41.4	Very low	262 Å²	262	126.4 Å²	126.4	99%	0.989	71%	0.707	S	S	*	*			trans	-66.2	91.1	180	-81	173.9	165.2	162.3	-6.5	109.3
452	G	32.7	Very low	42.3	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	70%	0.698	S	S	*	*			trans	-80.5	126.9	172.4	0	0	0	0	0	111.3	S450 N454	S450-G452 PolarHBondContact O-N 2.96Å; G452-N454 PolarHBondContact O-N 3.45Å
453	L	34.3	Very low	43.6	Very low	165 Å²	165	124.2 Å²	124.2	86%	0.864	68%	0.675	S	S	*	*			trans	-64.7	113.4	175.6	-71.4	156.3	0	0	0	110.1	I455	L453-I455 PolarHBondContact O-N 3.22Å; L453-I455 VanDerWaalsContact O-N 3.14Å
454	N	38.6	Very low	44.6	Very low	144 Å²	144	124.9 Å²	124.9	77%	0.77	66%	0.66	S	S	*	*			trans	-74.3	96.9	168.1	-82.2	-27.6	0	0	0	108.9	G452 T456	G452-N454 PolarHBondContact O-N 3.45Å; N454-T456 VanDerWaalsContact C-N 3.28Å; N454-T456 HydrophobicContact CB-CG2 4.38Å; N454-T456 PolarHBondContact O-N 2.91Å
455	I	43.4	Very low	45.7	Very low	131 Å²	131	128.3 Å²	128.3	67%	0.672	66%	0.661	S	S	*	*			trans	-75.2	87.9	167.6	-57.5	172.7	0	0	0	106.9	L453 F460	L453-I455 PolarHBondContact O-N 3.22Å; L453-I455 VanDerWaalsContact O-N 3.14Å; I455-F460 HydrophobicContact CG2-CB 4.16Å
456	T	58.9	Low	47	Very low	61 Å²	61	131.3 Å²	131.3	37%	0.374	66%	0.655	S	S	.	*			trans	-76.7	157.7	170.7	73	0	0	0	0	109.9	N454 E458 V459 F460	N454-T456 VanDerWaalsContact C-N 3.28Å; N454-T456 HydrophobicContact CB-CG2 4.38Å; N454-T456 PolarHBondContact O-N 2.91Å; T456-E458 WeakPolarHBondContact CB-OE2 3.36Å; T456-E458 PolarHBondContact O-N 3.37Å; T456-E458 VanDerWaalsContact O-N 3.1Å; T456-E458 PolarHBondContact OG1-OE2 2.98Å; T456-V459 PolarHBondContact O-N 3.02Å; T456-F460 PolarHBondContact O-N 2.92Å; T456-F460 VanDerWaalsContact O-N 3.16Å
457	K	51.2	Low	47.9	Very low	144 Å²	144	132.7 Å²	132.7	63%	0.626	65%	0.652	S	S	*	*	H	α-helix	trans	-49.5	-37.9	176.9	-178.5	-175	171	-168.8	0	112	E461	K457-E461 WeakPolarHBondContact CE-OE1 3.46Å; K457-E461 IonicContact NZ-OE1 3.88Å; K457-E461 WeakPolarHBondContact O-CB 3.37Å; K457-E461 WeakPolarHBondContact O-CG 3.36Å; K457-E461 PolarHBondContact O-N 2.7Å
458	E	59	Low	48.6	Very low	109 Å²	109	133.5 Å²	133.5	51%	0.509	65%	0.647	S	S	.	*	H	α-helix	trans	-72.2	-27.4	-178.9	-53.2	79.3	-163	0	0	113.2	T456 R462	T456-E458 WeakPolarHBondContact CB-OE2 3.36Å; T456-E458 PolarHBondContact O-N 3.37Å; T456-E458 VanDerWaalsContact O-N 3.1Å; T456-E458 PolarHBondContact OG1-OE2 2.98Å; E458-R462 WeakPolarHBondContact O-CB 3.38Å; E458-R462 PolarHBondContact O-N 2.97Å; E458-R462 VanDerWaalsContact O-N 3.16Å; E458-R462 PolarHBondContact O-NH1 3.32Å
459	V	62.7	Low	49	Very low	69 Å²	69	130 Å²	130	42%	0.418	63%	0.634	S	S	.	*	H	α-helix	trans	-77	-41.6	176.3	175.8	0	0	0	0	110	T456 R462 S463	T456-V459 PolarHBondContact O-N 3.02Å; V459-R462 PolarHBondContact O-N 3.5Å; V459-S463 PolarHBondContact O-N 3.31Å; V459-S463 PolarHBondContact O-OG 3.39Å
460	F	56.4	Low	49.3	Very low	120 Å²	120	128.7 Å²	128.7	53%	0.526	64%	0.636	S	S	.	*	H	α-helix	trans	-68.3	-44	176.2	-174.8	-101.2	0	0	0	112.6	I455 T456 R462 S463 M464	I455-F460 HydrophobicContact CG2-CB 4.16Å; T456-F460 PolarHBondContact O-N 2.92Å; T456-F460 VanDerWaalsContact O-N 3.16Å; F460-R462 VanDerWaalsContact C-N 3.3Å; F460-R462 PolarHBondContact O-N 2.83Å; F460-S463 PolarHBondContact O-N 2.89Å; F460-M464 HydrophobicContact CD1-CG 4.43Å; F460-M464 HydrophobicContact CE1-CG 3.98Å; F460-M464 HydrophobicContact CE2-CG 4.4Å; F460-M464 HydrophobicContact CZ-CG 3.96Å; F460-M464 WeakPolarHBondContact O-CB 3.42Å; F460-M464 PolarHBondContact O-N 2.89Å
461	E	57.8	Low	49.6	Very low	100 Å²	100	126.8 Å²	126.8	47%	0.467	63%	0.627	S	S	.	*	H	α-helix	trans	-63	-36.2	174.5	-79.2	-179.6	171.4	0	0	112	K457 R465	K457-E461 WeakPolarHBondContact CE-OE1 3.46Å; K457-E461 IonicContact NZ-OE1 3.88Å; K457-E461 WeakPolarHBondContact O-CB 3.37Å; K457-E461 WeakPolarHBondContact O-CG 3.36Å; K457-E461 PolarHBondContact O-N 2.7Å; E461-R465 WeakPolarHBondContact O-CB 3.3Å; E461-R465 PolarHBondContact O-N 3.44Å
462	R	59.9	Low	49.8	Very low	143 Å²	143	123.6 Å²	123.6	54%	0.54	62%	0.623	S	S	.	*	H	α-helix	trans	-70.1	-40.9	176.3	-177.7	179.1	-87.6	100.5	-9.6	112	E458 V459 F460 R465 R466	E458-R462 WeakPolarHBondContact O-CB 3.38Å; E458-R462 PolarHBondContact O-N 2.97Å; E458-R462 VanDerWaalsContact O-N 3.16Å; E458-R462 PolarHBondContact O-NH1 3.32Å; V459-R462 PolarHBondContact O-N 3.5Å; F460-R462 VanDerWaalsContact C-N 3.3Å; F460-R462 PolarHBondContact O-N 2.83Å; R462-R465 PolarHBondContact O-N 3.03Å; R462-R466 WeakPolarHBondContact O-CB 3.39Å; R462-R466 WeakPolarHBondContact O-CG 3.38Å; R462-R466 PolarHBondContact O-N 2.97Å
463	S	62.2	Low	50.2	Low	63 Å²	63	129.1 Å²	129.1	44%	0.441	63%	0.632	S	S	.	*	H	α-helix	trans	-68.4	-38.4	176.1	-67.9	0	0	0	0	112.6	V459 F460 R466 M467	V459-S463 PolarHBondContact O-N 3.31Å; V459-S463 PolarHBondContact O-OG 3.39Å; F460-S463 PolarHBondContact O-N 2.89Å; S463-R466 PolarHBondContact O-N 3.19Å; S463-M467 WeakPolarHBondContact O-CB 3.36Å; S463-M467 PolarHBondContact O-N 3.14Å
464	M	53.4	Low	50.2	Low	87 Å²	87	128.6 Å²	128.6	43%	0.429	63%	0.63	S	S	.	*	H	α-helix	trans	-66.6	-37.8	173.7	-81.4	-76.6	-75.3	0	0	112.2	F460 M467 I468	F460-M464 HydrophobicContact CD1-CG 4.43Å; F460-M464 HydrophobicContact CE1-CG 3.98Å; F460-M464 HydrophobicContact CE2-CG 4.4Å; F460-M464 HydrophobicContact CZ-CG 3.96Å; F460-M464 WeakPolarHBondContact O-CB 3.42Å; F460-M464 PolarHBondContact O-N 2.89Å; M464-M467 PolarHBondContact O-N 3.27Å; M464-I468 HydrophobicContact CE-CD1 4.39Å; M464-I468 WeakPolarHBondContact O-CB 3.41Å; M464-I468 WeakPolarHBondContact O-CD1 3.47Å; M464-I468 VanDerWaalsContact O-CG1 3.28Å; M464-I468 WeakPolarHBondContact O-CG1 3.45Å; M464-I468 PolarHBondContact O-N 3.38Å
465	R	55	Low	50.4	Low	183 Å²	183	129.6 Å²	129.6	69%	0.691	64%	0.635	S	S	*	*	H	α-helix	trans	-64	-45.5	171.2	-90.1	-177	177.6	159.3	-0.3	112.2	E461 R462 M467 I468 D469	E461-R465 WeakPolarHBondContact O-CB 3.3Å; E461-R465 PolarHBondContact O-N 3.44Å; R462-R465 PolarHBondContact O-N 3.03Å; R465-M467 PolarHBondContact O-N 3.13Å; R465-I468 PolarHBondContact O-N 3.29Å; R465-D469 PolarHBondContact O-N 3.42Å
466	R	59.7	Low	49.9	Very low	185 Å²	185	130.5 Å²	130.5	70%	0.698	64%	0.641	S	S	*	*	H	α-helix	trans	-61.8	-29	176.6	-77	179.8	-179.7	-171.9	-3.7	113.8	R462 S463	R462-R466 WeakPolarHBondContact O-CB 3.39Å; R462-R466 WeakPolarHBondContact O-CG 3.38Å; R462-R466 PolarHBondContact O-N 2.97Å; S463-R466 PolarHBondContact O-N 3.19Å
467	M	52.8	Low	49	Very low	150 Å²	150	135.5 Å²	135.5	74%	0.739	67%	0.666	S	S	*	*	H	α-helix	trans	-83.1	-22.9	178.9	-164.4	-176.6	-68.3	0	0	112.6	S463 M464 R465	S463-M467 WeakPolarHBondContact O-CB 3.36Å; S463-M467 PolarHBondContact O-N 3.14Å; M464-M467 PolarHBondContact O-N 3.27Å; R465-M467 PolarHBondContact O-N 3.13Å
468	I	48.9	Very low	48.3	Very low	124 Å²	124	135.5 Å²	135.5	64%	0.636	67%	0.673	S	S	*	*	H	α-helix	trans	-95.5	-34.8	-178.7	-67.7	170.6	0	0	0	111.4	M464 R465 L470	M464-I468 HydrophobicContact CE-CD1 4.39Å; M464-I468 WeakPolarHBondContact O-CB 3.41Å; M464-I468 WeakPolarHBondContact O-CD1 3.47Å; M464-I468 VanDerWaalsContact O-CG1 3.28Å; M464-I468 WeakPolarHBondContact O-CG1 3.45Å; M464-I468 PolarHBondContact O-N 3.38Å; R465-I468 PolarHBondContact O-N 3.29Å; I468-L470 PolarHBondContact O-N 3.39Å
469	D	41.4	Very low	47.3	Very low	106 Å²	106	138.7 Å²	138.7	57%	0.567	69%	0.693	S	S	*	*			trans	-89.9	87.5	173.3	-72.5	-32.9	0	0	0	109.7	R465 A471	R465-D469 PolarHBondContact O-N 3.42Å; D469-A471 PolarHBondContact O-N 3.5Å
470	L	38.7	Very low	45.9	Very low	178 Å²	178	143.7 Å²	143.7	93%	0.932	71%	0.712	S	S	*	*			trans	-68.3	54.7	161.1	-77.4	164.3	0	0	0	110.4	I468	I468-L470 PolarHBondContact O-N 3.39Å
471	A	40	Very low	45	Very low	74 Å²	74	142.4 Å²	142.4	61%	0.612	72%	0.724	S	S	*	*			trans	-106.5	108.9	171.3	0	0	0	0	0	108	D469 E473	D469-A471 PolarHBondContact O-N 3.5Å; A471-E473 PolarHBondContact O-N 3.31Å
472	E	39.6	Very low	43.9	Very low	195 Å²	195	142.3 Å²	142.3	91%	0.911	74%	0.74	S	S	*	*			trans	-56.4	117.3	163.1	-64.6	172.1	159.7	0	0	108.4
473	E	39.5	Very low	42.7	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	75%	0.75	S	S	*	*			trans	-138.5	135	157.6	-73.7	-168.3	170.1	0	0	109.6	A471	A471-E473 PolarHBondContact O-N 3.31Å
474	D	35.7	Very low	41.5	Very low	154 Å²	154	145 Å²	145	82%	0.824	77%	0.768	S	S	*	*			trans	-63.8	130.4	-175.1	-54.8	-68.2	0	0	0	112.3
475	D	41.7	Very low	40.8	Very low	165 Å²	165	145.4 Å²	145.4	88%	0.882	78%	0.78	S	S	*	*			trans	-111.8	98.8	161	-85.5	-31	0	0	0	108
476	D	34	Very low	39.6	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	79%	0.787	S	S	*	*			trans	-59.6	120.2	159.9	-74	-46.9	0	0	0	109.6
477	D	40.4	Very low	38.5	Very low	167 Å²	167	140.5 Å²	140.5	89%	0.893	79%	0.79	S	S	*	*			trans	-146.1	111.3	152.5	-95.2	-32.9	0	0	0	109
478	D	34.5	Very low	37.6	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	80%	0.796	S	S	*	*			trans	-56.6	138.2	176.7	-69.9	-52.4	0	0	0	113.1
479	D	39.5	Very low	36.9	Very low	175 Å²	175	144.6 Å²	144.6	94%	0.936	81%	0.807	S	S	*	*			trans	-157.6	123.5	132.3	-98.2	-30.4	0	0	0	112
480	E	33.1	Very low	36.4	Very low	174 Å²	174	146.2 Å²	146.2	81%	0.813	81%	0.811	S	S	*	*			trans	-67.8	142.5	-173.8	-71.6	-89.3	-173.2	0	0	115.2
481	A	37.3	Very low	36.1	Very low	94 Å²	94	146.6 Å²	146.6	78%	0.777	80%	0.801	S	S	*	*				177.5	107.9	121.5	0	0	0	0	0	114.1
482	A	35.1	Very low	35.7	Very low	97 Å²	97	150.2 Å²	150.2	80%	0.802	81%	0.81	S	S	*	*			trans	59.9	115.3	135	0	0	0	0	0	121.2
483	S	35.1	Very low	35.6	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	81%	0.807	S	S	*	*				163.1	119.3	90.2	-170.9	0	0	0	0	112.7
484	D	35.5	Very low	35.1	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	80%	0.804	S	S	*	*			trans	60	110.2	144.8	-80.8	-6.7	0	0	0	123.6
485	S	38.5	Very low	35	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	80%	0.802	S	S	*	*				91.1	107.1	109.5	-164.9	0	0	0	0	120.4
486	D	31.4	Very low	34.7	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	80%	0.798	S	S	*	*			trans	46.6	121	134.8	-63.1	-11.9	0	0	0	121.6
487	S	35.7	Very low	34.6	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	80%	0.804	S	S	*	*				158.8	131.2	100.2	-175.6	0	0	0	0	111.4
488	M	34.2	Very low	34.6	Very low	175 Å²	175	140.7 Å²	140.7	86%	0.862	79%	0.792	S	S	*	*			trans	-55.3	141	158.9	-64.9	-161.5	-161.7	0	0	110.9
489	Q	33.7	Very low	34.8	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	80%	0.797	S	S	*	*				-168.5	138.2	129	-104.2	163.7	47	0	0	112.9
490	E	30.2	Very low	34.8	Very low	140 Å²	140	140.4 Å²	140.4	65%	0.654	79%	0.786	S	S	*	*			trans	-64.8	156.1	168.9	-167.5	-179.5	-170.2	0	0	111.9
491	Y	32.8	Very low	35.1	Very low	185 Å²	185	140.2 Å²	140.2	73%	0.725	79%	0.785	S	S	*	*			trans	134.9	110.8	142.1	-64.9	-60.3	0	0	0	114.2
492	D	33.1	Very low	35.1	Very low	150 Å²	150	145.7 Å²	145.7	80%	0.802	79%	0.785	S	S	*	*				64.6	113.6	126.5	-144.2	18.4	0	0	0	119.2
493	T	35.8	Very low	35.1	Very low	139 Å²	139	147.8 Å²	147.8	85%	0.853	78%	0.78	S	S	*	*			trans	-162.8	142.1	135.1	-162.8	0	0	0	0	112.6
494	E	29.6	Very low	35.2	Very low	164 Å²	164	148.7 Å²	148.7	77%	0.766	78%	0.776	S	S	*	*			trans	-72.5	152.6	179.3	-50.1	-174.2	169.3	0	0	113.2
495	S	33.3	Very low	35.3	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	77%	0.768	S	S	*	*			trans	19.5	105.3	143.3	164.2	0	0	0	0	118.3
496	T	36.2	Very low	35.2	Very low	131 Å²	131	144.5 Å²	144.5	80%	0.804	76%	0.76	S	S	*	*			trans	-156.3	130.9	136.2	43.1	0	0	0	0	110.8	S498	T496-S498 PolarHBondContact O-N 3.08Å
497	D	32.5	Very low	35.5	Very low	172 Å²	172	142 Å²	142	92%	0.92	75%	0.747	S	S	*	*			trans	-47.8	127.7	168.2	-73.4	-44.3	0	0	0	112.6
498	S	38.9	Very low	35.7	Very low	92 Å²	92	140.9 Å²	140.9	64%	0.643	74%	0.743	S	S	*	*			trans	-156.5	125.2	154.2	53.3	0	0	0	0	112.6	T496 E500	T496-S498 PolarHBondContact O-N 3.08Å; S498-E500 VanDerWaalsContact C-N 3.26Å; S498-E500 PolarHBondContact O-N 3.03Å
499	D	38.4	Very low	36	Very low	162 Å²	162	136.9 Å²	136.9	87%	0.866	74%	0.739	S	S	*	*			trans	-56.4	59.5	176.6	-69.4	-58.5	0	0	0	115.6
500	E	39.9	Very low	36.4	Very low	151 Å²	151	131.9 Å²	131.9	71%	0.706	72%	0.724	S	S	*	*			trans	-107.2	-12.9	177.4	-73	-164.8	152.4	0	0	114.6	S498 R502	S498-E500 VanDerWaalsContact C-N 3.26Å; S498-E500 PolarHBondContact O-N 3.03Å; E500-R502 VanDerWaalsContact C-N 3.27Å; E500-R502 PolarHBondContact O-N 3.35Å
501	H	39.2	Very low	37.1	Very low	171 Å²	171	130.5 Å²	130.5	79%	0.792	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-2.8	177.5	-116.9	-71.6	0	0	0	115
502	R	38.8	Very low	38.1	Very low	209 Å²	209	128.4 Å²	128.4	79%	0.789	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-10.7	179.4	-163	173.2	146.9	129.6	-0.2	113.6	E500	E500-R502 VanDerWaalsContact C-N 3.27Å; E500-R502 PolarHBondContact O-N 3.35Å
503	M	34.6	Very low	39.7	Very low	140 Å²	140	124.7 Å²	124.7	69%	0.69	70%	0.702	S	S	*	*	S	Bend	trans	-91.2	-15.8	179.3	-78.1	-90.5	174.8	0	0	114	T506	M503-T506 PolarHBondContact O-OG1 3.3Å; M503-T506 VanDerWaalsContact O-OG1 3.11Å
504	L	35.9	Very low	41.4	Very low	128 Å²	128	127.2 Å²	127.2	67%	0.67	70%	0.701	S	S	*	*	S	Bend	trans	-87.5	-26.5	178.6	-76.2	162.1	0	0	0	113.1
505	A	38.9	Very low	43.6	Very low	79 Å²	79	125.2 Å²	125.2	65%	0.653	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-19.9	174.9	0	0	0	0	0	113.3
506	T	36.4	Very low	45.5	Very low	83 Å²	83	123.9 Å²	123.9	51%	0.509	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84	-10.7	179.7	47.5	0	0	0	0	114.1	M503	M503-T506 PolarHBondContact O-OG1 3.3Å; M503-T506 VanDerWaalsContact O-OG1 3.11Å
507	N	36.7	Very low	47.3	Very low	105 Å²	105	121.8 Å²	121.8	56%	0.561	66%	0.659	S	S	*	*	S	Bend	trans	-99.5	-8.9	-179.4	-74.3	-15.2	0	0	0	114.3	A509 S510	N507-A509 VanDerWaalsContact C-N 3.33Å; N507-S510 PolarHBondContact O-OG 3.22Å
508	A	41.3	Very low	49.5	Very low	83 Å²	83	116.5 Å²	116.5	69%	0.686	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-18.5	174.8	0	0	0	0	0	113.2
509	A	40.2	Very low	51.4	Low	92 Å²	92	118.4 Å²	118.4	76%	0.76	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-6.9	178.5	0	0	0	0	0	113.8	N507	N507-A509 VanDerWaalsContact C-N 3.33Å
510	S	41.1	Very low	53.3	Low	81 Å²	81	113.8 Å²	113.8	57%	0.566	60%	0.604	S	S	*	*	S	Bend	trans	-114.3	20	-171	70.6	0	0	0	0	115.5	N507	N507-S510 PolarHBondContact O-OG 3.22Å
511	T	45	Very low	55.3	Low	111 Å²	111	108.4 Å²	108.4	68%	0.681	59%	0.585	S	S	*	*			trans	-147.9	51.4	177.7	-32.8	0	0	0	0	113.1	S513	T511-S513 PolarHBondContact O-N 3.09Å
512	W	55	Low	57.3	Low	140 Å²	140	105.7 Å²	105.7	53%	0.53	57%	0.572	S	S	.	*			trans	-68	119.6	148.8	-65.6	-6.6	0	0	0	107	K514 L516 L517 M520	W512-K514 PolarHBondContact O-N 3.36Å; W512-L516 HydrophobicContact CB-CD2 4.4Å; W512-L516 HydrophobicContact CG-CD2 4.38Å; W512-L517 HydrophobicContact CB-CD1 4.2Å; W512-L517 HydrophobicContact CB-CG 3.98Å; W512-L517 HydrophobicContact CE3-CD2 3.63Å; W512-L517 HydrophobicContact CE3-CG 4.19Å; W512-L517 HydrophobicContact CZ3-CD2 4.26Å; W512-M520 HydrophobicContact CE3-CE 4.38Å; W512-M520 HydrophobicContact CE3-SD 3.92Å; W512-M520 HydrophobicContact CH2-CE 4.12Å; W512-M520 HydrophobicContact CZ3-CE 3.74Å; W512-M520 HydrophobicContact CZ3-SD 3.91Å
513	S	66	Low	59.3	Low	73 Å²	73	101.3 Å²	101.3	51%	0.51	56%	0.562	S	S	.	*			trans	-48	135.9	173.7	-53.9	0	0	0	0	108.6	T511 E515 L516 L517	T511-S513 PolarHBondContact O-N 3.09Å; S513-E515 PolarHBondContact O-N 3.22Å; S513-L516 WeakPolarHBondContact O-CA 3.37Å; S513-L516 WeakPolarHBondContact O-CB 3.5Å; S513-L516 PolarHBondContact O-N 3.42Å; S513-L517 PolarHBondContact O-N 2.83Å; S513-L517 VanDerWaalsContact O-N 3.08Å
514	K	71.7	Confident	61.5	Low	191 Å²	191	96.1 Å²	96.1	83%	0.83	54%	0.538	S	S	*	.	H	α-helix	trans	-50.3	-31.2	176.5	-72.3	-178.3	178.6	178.3	0	112.1	W512 S518	W512-K514 PolarHBondContact O-N 3.36Å; K514-S518 PolarHBondContact O-N 3.21Å; K514-S518 PolarHBondContact O-OG 3.34Å
515	E	74.9	Confident	63.6	Low	122 Å²	122	97.6 Å²	97.6	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-66.6	-41.2	174.2	-170	169.3	-158.5	0	0	113.5	S513 S518 Y519	S513-E515 PolarHBondContact O-N 3.22Å; E515-S518 WeakPolarHBondContact CA-OG 3.44Å; E515-S518 PolarHBondContact O-N 2.95Å; E515-S518 PolarHBondContact O-OG 3.19Å; E515-Y519 HydrophobicContact CG-CD2 4.1Å; E515-Y519 HydrophobicContact CG-CE2 3.6Å; E515-Y519 WeakPolarHBondContact O-CD2 3.46Å; E515-Y519 PolarHBondContact O-N 3.14Å
516	L	73.7	Confident	65.7	Low	85 Å²	85	100.2 Å²	100.2	45%	0.445	53%	0.533	S	S	.	.	H	α-helix	trans	-67.6	-41.8	174.8	-176	65.5	0	0	0	111.2	W512 S513 S518 Y519 M520	W512-L516 HydrophobicContact CB-CD2 4.4Å; W512-L516 HydrophobicContact CG-CD2 4.38Å; S513-L516 WeakPolarHBondContact O-CA 3.37Å; S513-L516 WeakPolarHBondContact O-CB 3.5Å; S513-L516 PolarHBondContact O-N 3.42Å; L516-S518 VanDerWaalsContact C-N 3.3Å; L516-S518 PolarHBondContact O-N 3.41Å; L516-Y519 PolarHBondContact O-N 3.04Å; L516-M520 HydrophobicContact CG-SD 4.39Å; L516-M520 WeakPolarHBondContact O-CG 3.41Å; L516-M520 PolarHBondContact O-N 3.46Å
517	L	74.6	Confident	67.8	Low	88 Å²	88	98.8 Å²	98.8	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-37.7	173.8	-82.6	163.8	0	0	0	112.2	W512 S513 A521	W512-L517 HydrophobicContact CB-CD1 4.2Å; W512-L517 HydrophobicContact CB-CG 3.98Å; W512-L517 HydrophobicContact CE3-CD2 3.63Å; W512-L517 HydrophobicContact CE3-CG 4.19Å; W512-L517 HydrophobicContact CZ3-CD2 4.26Å; S513-L517 PolarHBondContact O-N 2.83Å; S513-L517 VanDerWaalsContact O-N 3.08Å; L517-A521 PolarHBondContact O-N 3.5Å; L517-A521 VanDerWaalsContact O-N 3.09Å
518	S	77.6	Confident	69.8	Low	61 Å²	61	95.3 Å²	95.3	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-68.4	-40	174.4	54.1	0	0	0	0	112.6	K514 E515 L516 A521 E522	K514-S518 PolarHBondContact O-N 3.21Å; K514-S518 PolarHBondContact O-OG 3.34Å; E515-S518 WeakPolarHBondContact CA-OG 3.44Å; E515-S518 PolarHBondContact O-N 2.95Å; E515-S518 PolarHBondContact O-OG 3.19Å; L516-S518 VanDerWaalsContact C-N 3.3Å; L516-S518 PolarHBondContact O-N 3.41Å; S518-A521 PolarHBondContact O-N 3.28Å; S518-E522 WeakPolarHBondContact O-CB 3.27Å; S518-E522 PolarHBondContact O-N 3.05Å
519	Y	79.5	Confident	71.5	Confident	132 Å²	132	98.5 Å²	98.5	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-37.9	176.4	-74.6	-50.7	0	0	0	112.6	E515 L516 E522 M523	E515-Y519 HydrophobicContact CG-CD2 4.1Å; E515-Y519 HydrophobicContact CG-CE2 3.6Å; E515-Y519 WeakPolarHBondContact O-CD2 3.46Å; E515-Y519 PolarHBondContact O-N 3.14Å; L516-Y519 PolarHBondContact O-N 3.04Å; Y519-E522 PolarHBondContact O-N 2.94Å; Y519-M523 VanDerWaalsContact O-CB 3.32Å; Y519-M523 WeakPolarHBondContact O-CB 3.32Å; Y519-M523 PolarHBondContact O-N 2.97Å
520	M	79.3	Confident	73.5	Confident	65 Å²	65	96.5 Å²	96.5	32%	0.32	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-44.2	174	-70.3	175.5	70.9	0	0	111.4	W512 L516 E522 M523 D524	W512-M520 HydrophobicContact CE3-CE 4.38Å; W512-M520 HydrophobicContact CE3-SD 3.92Å; W512-M520 HydrophobicContact CH2-CE 4.12Å; W512-M520 HydrophobicContact CZ3-CE 3.74Å; W512-M520 HydrophobicContact CZ3-SD 3.91Å; L516-M520 HydrophobicContact CG-SD 4.39Å; L516-M520 WeakPolarHBondContact O-CG 3.41Å; L516-M520 PolarHBondContact O-N 3.46Å; M520-E522 PolarHBondContact O-N 3.45Å; M520-M523 PolarHBondContact O-N 3.04Å; M520-D524 WeakPolarHBondContact O-CB 3.49Å; M520-D524 PolarHBondContact O-N 2.87Å
521	A	80.5	Confident	75.3	Confident	38 Å²	38	98.3 Å²	98.3	31%	0.314	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-37.7	177.3	0	0	0	0	0	112.7	L517 S518 R525 F564	L517-A521 PolarHBondContact O-N 3.5Å; L517-A521 VanDerWaalsContact O-N 3.09Å; S518-A521 PolarHBondContact O-N 3.28Å; A521-R525 WeakPolarHBondContact O-CB 3.43Å; A521-R525 PolarHBondContact O-N 2.96Å; A521-F564 HydrophobicContact CB-CE1 4.3Å; A521-F564 VanDerWaalsContact O-CZ 3.31Å; A521-F564 WeakPolarHBondContact O-CZ 3.29Å
522	E	81.3	Confident	76.8	Confident	113 Å²	113	96.7 Å²	96.7	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-67.5	-43.1	175.8	-168.9	171.8	-163.8	0	0	111.3	S518 Y519 M520 R525 E526	S518-E522 WeakPolarHBondContact O-CB 3.27Å; S518-E522 PolarHBondContact O-N 3.05Å; Y519-E522 PolarHBondContact O-N 2.94Å; M520-E522 PolarHBondContact O-N 3.45Å; E522-R525 WeakPolarHBondContact O-CB 3.26Å; E522-R525 PolarHBondContact O-N 3.48Å; E522-E526 WeakPolarHBondContact O-CG 3.21Å; E522-E526 PolarHBondContact O-N 2.86Å
523	M	81.2	Confident	77.7	Confident	117 Å²	117	90.2 Å²	90.2	58%	0.576	46%	0.461	S	S	*	.	H	α-helix	trans	-61.5	-46.7	174.7	-174.3	-177.8	-60.6	0	0	112.1	Y519 M520 R525 E526 L527	Y519-M523 VanDerWaalsContact O-CB 3.32Å; Y519-M523 WeakPolarHBondContact O-CB 3.32Å; Y519-M523 PolarHBondContact O-N 2.97Å; M520-M523 PolarHBondContact O-N 3.04Å; M523-R525 PolarHBondContact O-N 3.36Å; M523-E526 PolarHBondContact O-N 3.36Å; M523-L527 HydrophobicContact CG-CD1 3.86Å; M523-L527 HydrophobicContact CG-CG 4.38Å; M523-L527 WeakPolarHBondContact O-CB 3.42Å; M523-L527 VanDerWaalsContact O-CG 3.32Å; M523-L527 WeakPolarHBondContact O-CG 3.44Å; M523-L527 PolarHBondContact O-N 2.76Å
524	D	80.9	Confident	78.2	Confident	32 Å²	32	94 Å²	94	17%	0.171	47%	0.471	C	S	.	.	H	α-helix	trans	-60	-35	176.1	-84	-1.7	0	0	0	111.6	M520 L528 F564 V567	M520-D524 WeakPolarHBondContact O-CB 3.49Å; M520-D524 PolarHBondContact O-N 2.87Å; D524-L528 WeakPolarHBondContact O-CB 3.3Å; D524-L528 PolarHBondContact O-N 3.25Å; D524-L528 VanDerWaalsContact O-N 3.14Å; D524-F564 HydrophobicContact CB-CE2 3.76Å; D524-F564 HydrophobicContact CB-CZ 3.63Å; D524-V567 PolarHBondContact OD2-N 3.35Å; D524-V567 VanDerWaalsContact OD2-N 3.07Å
525	R	80.8	Confident	78.4	Confident	159 Å²	159	88.4 Å²	88.4	60%	0.6	46%	0.456	S	S	*	.	H	α-helix	trans	-70.8	-37	176.9	178.6	-178.2	152.2	160.7	-1.5	112.7	A521 E522 M523 L528 F564	A521-R525 WeakPolarHBondContact O-CB 3.43Å; A521-R525 PolarHBondContact O-N 2.96Å; E522-R525 WeakPolarHBondContact O-CB 3.26Å; E522-R525 PolarHBondContact O-N 3.48Å; M523-R525 PolarHBondContact O-N 3.36Å; R525-L528 WeakPolarHBondContact O-CB 3.21Å; R525-F564 HydrophobicContact CB-CD2 4.4Å; R525-F564 HydrophobicContact CB-CE2 4.03Å; R525-F564 HydrophobicContact CB-CZ 4.35Å
526	E	82.6	Confident	78.6	Confident	133 Å²	133	86.5 Å²	86.5	62%	0.621	45%	0.446	S	S	*	.	H	α-helix	trans	-74	-35.6	176.2	-69.3	-63.5	145.3	0	0	111.9	E522 M523 L528	E522-E526 WeakPolarHBondContact O-CG 3.21Å; E522-E526 PolarHBondContact O-N 2.86Å; M523-E526 PolarHBondContact O-N 3.36Å; E526-L528 VanDerWaalsContact C-N 3.31Å; E526-L528 PolarHBondContact O-N 2.97Å
527	L	80.4	Confident	78.9	Confident	53 Å²	53	84.5 Å²	84.5	28%	0.277	44%	0.435	S	S	.	.	H	α-helix	trans	-78.7	-14.3	179.8	-68.3	176.3	0	0	0	113.7	M523 N529 T530 G533	M523-L527 HydrophobicContact CG-CD1 3.86Å; M523-L527 HydrophobicContact CG-CG 4.38Å; M523-L527 WeakPolarHBondContact O-CB 3.42Å; M523-L527 VanDerWaalsContact O-CG 3.32Å; M523-L527 WeakPolarHBondContact O-CG 3.44Å; M523-L527 PolarHBondContact O-N 2.76Å; L527-N529 PolarHBondContact O-N 3.48Å; L527-T530 HydrophobicContact CD2-CG2 4.4Å; L527-T530 WeakPolarHBondContact O-CB 3.17Å; L527-T530 PolarHBondContact O-N 3.46Å; L527-T530 PolarHBondContact O-OG1 3.22Å; L527-G533 WeakPolarHBondContact O-CA 3.36Å
528	L	77.7	Confident	79.1	Confident	33 Å²	33	83.1 Å²	83.1	17%	0.173	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-35.5	-172.9	-134.2	172.7	0	0	0	114	D524 R525 E526 F564	D524-L528 WeakPolarHBondContact O-CB 3.3Å; D524-L528 PolarHBondContact O-N 3.25Å; D524-L528 VanDerWaalsContact O-N 3.14Å; R525-L528 WeakPolarHBondContact O-CB 3.21Å; E526-L528 VanDerWaalsContact C-N 3.31Å; E526-L528 PolarHBondContact O-N 2.97Å; L528-F564 HydrophobicContact CD1-CD2 3.52Å; L528-F564 HydrophobicContact CD1-CE2 4.15Å; L528-F564 HydrophobicContact CG-CD2 4.37Å
529	N	77.5	Confident	78.9	Confident	149 Å²	149	82.3 Å²	82.3	80%	0.797	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	15.1	-179.1	-64.4	-21.4	0	0	0	113.5	L527	L527-N529 PolarHBondContact O-N 3.48Å
530	T	82.5	Confident	78	Confident	50 Å²	50	83.8 Å²	83.8	31%	0.307	43%	0.426	S	S	.	.	S	Bend	trans	-104.4	153.8	177.9	71.5	0	0	0	0	110.4	L527 V532 G533 E534	L527-T530 HydrophobicContact CD2-CG2 4.4Å; L527-T530 WeakPolarHBondContact O-CB 3.17Å; L527-T530 PolarHBondContact O-N 3.46Å; L527-T530 PolarHBondContact O-OG1 3.22Å; T530-V532 PolarHBondContact O-N 2.93Å; T530-V532 VanDerWaalsContact O-N 3.12Å; T530-G533 PolarHBondContact O-N 3.11Å; T530-G533 PolarHBondContact OG1-N 3Å; T530-G533 VanDerWaalsContact OG1-N 3.13Å; T530-E534 PolarHBondContact O-N 3.49Å
531	T	77.9	Confident	76.6	Confident	120 Å²	120	87.5 Å²	87.5	74%	0.736	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.7	172.8	42.7	0	0	0	0	112.9
532	V	76.6	Confident	75.1	Confident	77 Å²	77	95 Å²	95	47%	0.467	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-41.9	174.5	176.6	0	0	0	0	110.4	T530 E534 S535 F536	T530-V532 PolarHBondContact O-N 2.93Å; T530-V532 VanDerWaalsContact O-N 3.12Å; V532-E534 VanDerWaalsContact C-N 3.35Å; V532-E534 PolarHBondContact O-N 3.43Å; V532-S535 PolarHBondContact O-N 3.41Å; V532-S535 PolarHBondContact O-OG 2.93Å; V532-F536 HydrophobicContact CG1-CE2 3.91Å; V532-F536 WeakPolarHBondContact O-CD2 3.48Å; V532-F536 VanDerWaalsContact O-CE2 3.29Å; V532-F536 WeakPolarHBondContact O-CE2 3.26Å
533	G	74.5	Confident	73.1	Confident	4 Å²	4	93 Å²	93	4%	0.041	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-66.6	-31.2	178.1	0	0	0	0	0	114.5	L527 T530 S535 F536	L527-G533 WeakPolarHBondContact O-CA 3.36Å; T530-G533 PolarHBondContact O-N 3.11Å; T530-G533 PolarHBondContact OG1-N 3Å; T530-G533 VanDerWaalsContact OG1-N 3.13Å; G533-S535 PolarHBondContact O-N 3.47Å; G533-F536 PolarHBondContact O-N 3.48Å
534	E	76.3	Confident	71	Confident	152 Å²	152	93 Å²	93	71%	0.71	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.8	175.1	-68.8	178.9	168.5	0	0	113.1	T530 V532 F536	T530-E534 PolarHBondContact O-N 3.49Å; V532-E534 VanDerWaalsContact C-N 3.35Å; V532-E534 PolarHBondContact O-N 3.43Å; E534-F536 VanDerWaalsContact C-N 3.29Å; E534-F536 PolarHBondContact O-N 2.86Å
535	S	75.3	Confident	68.9	Low	73 Å²	73	100 Å²	100	51%	0.51	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-79.5	-6.2	-179.6	71.2	0	0	0	0	114.7	V532 G533	V532-S535 PolarHBondContact O-N 3.41Å; V532-S535 PolarHBondContact O-OG 2.93Å; G533-S535 PolarHBondContact O-N 3.47Å
536	F	80.3	Confident	66.8	Low	82 Å²	82	100.2 Å²	100.2	36%	0.36	53%	0.528	S	S	.	.	S	Bend	trans	-103.3	138.5	-176.7	-69	-81.2	0	0	0	112.7	V532 G533 E534 V567 T572	V532-F536 HydrophobicContact CG1-CE2 3.91Å; V532-F536 WeakPolarHBondContact O-CD2 3.48Å; V532-F536 VanDerWaalsContact O-CE2 3.29Å; V532-F536 WeakPolarHBondContact O-CE2 3.26Å; G533-F536 PolarHBondContact O-N 3.48Å; E534-F536 VanDerWaalsContact C-N 3.29Å; E534-F536 PolarHBondContact O-N 2.86Å; F536-V567 HydrophobicContact CB-CB 4.28Å; F536-V567 HydrophobicContact CB-CG1 3.65Å; F536-V567 HydrophobicContact CB-CG2 3.59Å; F536-V567 HydrophobicContact CD1-CG1 3.77Å; F536-V567 HydrophobicContact CG-CG1 4Å; F536-V567 HydrophobicContact CG-CG2 4.14Å; F536-T572 HydrophobicContact CD1-CG2 3.61Å; F536-T572 HydrophobicContact CE1-CG2 4.18Å; F536-T572 HydrophobicContact CG-CG2 4.45Å
537	I	79	Confident	64.5	Low	44 Å²	44	98.7 Å²	98.7	23%	0.226	54%	0.539	C	S	.	.			trans	-83.6	136	-179.8	-60.2	176.4	0	0	0	110.3	N568 K571 T572 S575	I537-N568 PolarHBondContact O-N 3.23Å; I537-K571 HydrophobicContact CB-CB 4.23Å; I537-K571 HydrophobicContact CD1-CB 4.47Å; I537-K571 HydrophobicContact CG2-CB 3.98Å; I537-K571 HydrophobicContact CG2-CD 4.12Å; I537-T572 PolarHBondContact N-OG1 3.14Å; I537-S575 VanDerWaalsContact CD1-CB 3.43Å
538	R	80.1	Confident	62.2	Low	59 Å²	59	104.9 Å²	104.9	22%	0.223	57%	0.566	C	S	.	*	B	Isolated β-bridge	trans	-120	153.2	176.9	-64.9	172.2	-177.1	166.3	7.3	110.8	E540 Q565 V567	R538-E540 PolarHBondContact O-N 3.37Å; R538-Q565 HydrophobicContact CB-CB 4.37Å; R538-Q565 VanDerWaalsContact CD-O 3.24Å; R538-Q565 WeakPolarHBondContact CD-O 3.34Å; R538-Q565 PolarHBondContact NE-O 2.87Å; R538-V567 HydrophobicContact CG-CG2 4.35Å
539	D	72.5	Confident	60	Low	43 Å²	43	114.7 Å²	114.7	23%	0.23	60%	0.601	C	S	.	*			trans	-85	110.1	-178.9	-76.6	-36	0	0	0	112.3	N541 Q565 N568 K571	D539-N541 PolarHBondContact O-N 2.89Å; D539-Q565 PolarHBondContact O-NE2 3.39Å; D539-Q565 PolarHBondContact O-OE1 3.1Å; D539-N568 PolarHBondContact OD1-ND2 3.48Å; D539-N568 VanDerWaalsContact OD1-ND2 3.14Å; D539-N568 PolarHBondContact OD2-ND2 3.07Å; D539-K571 WeakPolarHBondContact OD1-CE 3.45Å; D539-K571 IonicContact OD1-NZ 3.2Å; D539-K571 PolarHBondContact OD1-NZ 3.21Å
540	E	60.4	Low	58	Low	164 Å²	164	117.3 Å²	117.3	77%	0.766	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-5.7	-175.7	-64	-166.1	146	0	0	116.1	R538	R538-E540 PolarHBondContact O-N 3.37Å
541	N	50.8	Low	55.5	Low	142 Å²	142	122.4 Å²	122.4	76%	0.759	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.1	48.9	-163.6	-101.4	-23	0	0	0	116.8	D539	D539-N541 PolarHBondContact O-N 2.89Å
542	R	47.7	Very low	53.3	Low	196 Å²	196	123.2 Å²	123.2	74%	0.74	63%	0.63	S	S	*	*			trans	-102.6	3.7	163.6	-81.1	-174.1	177.3	-179.9	2.4	115.3	T544	R542-T544 PolarHBondContact O-N 2.95Å
543	G	40.2	Very low	51.4	Low	70 Å²	70	126.1 Å²	126.1	72%	0.722	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	9	-173.4	0	0	0	0	0	118.1
544	T	37.2	Very low	49.4	Very low	117 Å²	117	134.5 Å²	134.5	72%	0.718	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	11.9	-171.2	43.2	0	0	0	0	116.9	R542	R542-T544 PolarHBondContact O-N 2.95Å
545	Q	37.3	Very low	47.2	Very low	179 Å²	179	135.3 Å²	135.3	84%	0.836	69%	0.685	S	S	*	*	S	Bend	trans	-122	-3.1	-179.6	-72.8	-170.8	-5.5	0	0	117.5
546	D	35.9	Very low	45.1	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	70%	0.698	S	S	*	*	S	Bend	trans	-117.1	23.8	-179.6	-79.3	-39.3	0	0	0	114.9
547	A	34.8	Very low	42.9	Very low	102 Å²	102	142.2 Å²	142.2	84%	0.843	72%	0.719	S	S	*	*			trans	-86.2	2.7	177.3	0	0	0	0	0	115
548	E	31.5	Very low	40.9	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	75%	0.749	S	S	*	*	S	Bend	trans	-124.9	73.8	177.7	-73.1	-170	167.8	0	0	111.7
549	R	31.5	Very low	38.8	Very low	238 Å²	238	152 Å²	152	90%	0.898	78%	0.775	S	S	*	*	S	Bend	trans	171.8	93	147.7	-94.5	153.5	-174	-158.6	3.8	111.4
550	K	36.3	Very low	37.3	Very low	205 Å²	205	159 Å²	159	89%	0.891	81%	0.806	S	S	*	*				163.1	104.9	125	-90	171	179.4	-179.2	0	110.3
551	N	29.6	Very low	36.7	Very low	157 Å²	157	155.6 Å²	155.6	84%	0.84	79%	0.793	S	S	*	*			trans	-79.6	124	152.2	-74.5	-29.3	0	0	0	107.8
552	N	32.7	Very low	36.8	Very low	136 Å²	136	156.3 Å²	156.3	73%	0.727	80%	0.797	S	S	*	*				154.2	129.5	129.7	-82.9	3.6	0	0	0	112.5
553	D	35.9	Very low	37.4	Very low	139 Å²	139	151.3 Å²	151.3	74%	0.743	79%	0.793	S	S	*	*			trans	84	93.7	148.4	-51	-20.1	0	0	0	119.9
554	E	32.2	Very low	38.6	Very low	179 Å²	179	151.1 Å²	151.1	84%	0.836	77%	0.772	S	S	*	*				55.5	128.3	127.7	-71.2	-175.2	172.1	0	0	123.2
555	E	30.7	Very low	40.3	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.794	75%	0.75	S	S	*	*			trans	95.1	108.2	153.8	-66.2	-172.7	178.9	0	0	121.3
556	N	30.3	Very low	41.9	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	73%	0.73	S	S	*	*			trans	67.1	115.1	148	-72.8	-39	0	0	0	121
557	I	35.4	Very low	44	Very low	155 Å²	155	136 Å²	136	80%	0.795	70%	0.695	S	S	*	*				174.1	139.9	114.7	-81.6	151.7	0	0	0	109.1	L559	I557-L559 PolarHBondContact O-N 3.44Å
558	D	35.8	Very low	46.2	Very low	160 Å²	160	132.7 Å²	132.7	86%	0.856	66%	0.663	S	S	*	*			trans	-42.4	120.4	-177.2	-66	-48.4	0	0	0	115.3
559	L	36.3	Very low	48.4	Very low	149 Å²	149	127.9 Å²	127.9	78%	0.78	65%	0.646	S	S	*	*			trans	-101.5	79.4	172.5	-68.9	171.6	0	0	0	110.3	I557	I557-L559 PolarHBondContact O-N 3.44Å
560	E	40.9	Very low	50.5	Low	189 Å²	189	122.4 Å²	122.4	88%	0.883	64%	0.635	S	S	*	*			trans	-113.1	68.7	159	-78.7	-168.9	170	0	0	109.3
561	N	47.7	Very low	52.4	Low	93 Å²	93	115.4 Å²	115.4	50%	0.497	60%	0.604	S	S	.	*			trans	-178.1	66.4	148	-119.5	-8	0	0	0	111.4	S563	N561-S563 PolarHBondContact O-N 3.39Å
562	D	53.8	Low	54.8	Low	157 Å²	157	108.2 Å²	108.2	84%	0.84	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	24.7	-178.8	-128.6	7.2	0	0	0	113.4
563	S	59.9	Low	57	Low	92 Å²	92	106.4 Å²	106.4	64%	0.643	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	21.3	178.5	72.1	0	0	0	0	114.3	N561 Q565	N561-S563 PolarHBondContact O-N 3.39Å; S563-Q565 PolarHBondContact O-N 3.23Å
564	F	65.9	Low	59.1	Low	66 Å²	66	101.9 Å²	101.9	29%	0.289	53%	0.533	S	S	.	.			trans	-74.4	120.8	173.9	178.1	-108	0	0	0	111	A521 D524 R525 L528	A521-F564 HydrophobicContact CB-CE1 4.3Å; A521-F564 VanDerWaalsContact O-CZ 3.31Å; A521-F564 WeakPolarHBondContact O-CZ 3.29Å; D524-F564 HydrophobicContact CB-CE2 3.76Å; D524-F564 HydrophobicContact CB-CZ 3.63Å; R525-F564 HydrophobicContact CB-CD2 4.4Å; R525-F564 HydrophobicContact CB-CE2 4.03Å; R525-F564 HydrophobicContact CB-CZ 4.35Å; L528-F564 HydrophobicContact CD1-CD2 3.52Å; L528-F564 HydrophobicContact CD1-CE2 4.15Å; L528-F564 HydrophobicContact CG-CD2 4.37Å
565	Q	71.4	Confident	61.3	Low	54 Å²	54	94.2 Å²	94.2	25%	0.252	50%	0.5	S	S	.	.			trans	-121.3	131.6	168.9	-71.3	174.4	-17.4	0	0	108.4	R538 D539 S563	R538-Q565 HydrophobicContact CB-CB 4.37Å; R538-Q565 VanDerWaalsContact CD-O 3.24Å; R538-Q565 WeakPolarHBondContact CD-O 3.34Å; R538-Q565 PolarHBondContact NE-O 2.87Å; D539-Q565 PolarHBondContact O-NE2 3.39Å; D539-Q565 PolarHBondContact O-OE1 3.1Å; S563-Q565 PolarHBondContact O-N 3.23Å
566	P	72.6	Confident	63.7	Low	66 Å²	66	89.5 Å²	89.5	43%	0.429	48%	0.48	S	S	.	.			trans	-64.6	152.7	178.5	27.1	-33.5	0	0	0	111
567	V	78.1	Confident	66	Low	22 Å²	22	85 Å²	85	13%	0.133	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-63.6	135.2	177.9	169.5	0	0	0	0	110.9	D524 F536 R538 V569	D524-V567 PolarHBondContact OD2-N 3.35Å; D524-V567 VanDerWaalsContact OD2-N 3.07Å; F536-V567 HydrophobicContact CB-CB 4.28Å; F536-V567 HydrophobicContact CB-CG1 3.65Å; F536-V567 HydrophobicContact CB-CG2 3.59Å; F536-V567 HydrophobicContact CD1-CG1 3.77Å; F536-V567 HydrophobicContact CG-CG1 4Å; F536-V567 HydrophobicContact CG-CG2 4.14Å; R538-V567 HydrophobicContact CG-CG2 4.35Å; V567-V569 PolarHBondContact O-N 3.47Å
568	N	81.5	Confident	68	Low	32 Å²	32	79.1 Å²	79.1	17%	0.171	42%	0.424	C	S	.	.			trans	-86.1	97.8	168.4	-170.8	-41.5	0	0	0	108.7	I537 D539 D570 K571 T572	I537-N568 PolarHBondContact O-N 3.23Å; D539-N568 PolarHBondContact OD1-ND2 3.48Å; D539-N568 VanDerWaalsContact OD1-ND2 3.14Å; D539-N568 PolarHBondContact OD2-ND2 3.07Å; N568-D570 VanDerWaalsContact C-N 3.3Å; N568-D570 PolarHBondContact O-N 2.92Å; N568-D570 PolarHBondContact OD1-N 3.18Å; N568-K571 HydrophobicContact CB-CB 4.1Å; N568-K571 HydrophobicContact CB-CD 4.23Å; N568-K571 HydrophobicContact CB-CG 4.32Å; N568-K571 PolarHBondContact O-N 2.92Å; N568-K571 PolarHBondContact OD1-N 3.34Å; N568-T572 PolarHBondContact O-N 3.22Å; N568-T572 PolarHBondContact O-OG1 3.4Å
569	V	77.2	Confident	70.2	Confident	82 Å²	82	76.5 Å²	76.5	50%	0.497	41%	0.407	S	S	.	.	H	α-helix	trans	-59.7	-41.4	-177.1	-178.5	0	0	0	0	111.3	V567 T572 L573	V567-V569 PolarHBondContact O-N 3.47Å; V569-T572 PolarHBondContact O-N 3.18Å; V569-L573 WeakPolarHBondContact O-CB 3.42Å; V569-L573 PolarHBondContact O-N 2.94Å
570	D	75.9	Confident	72.3	Confident	123 Å²	123	72 Å²	72	66%	0.658	39%	0.388	S	S	*	.	H	α-helix	trans	-66.6	-46.4	-177.9	-63.1	-29	0	0	0	111.2	N568 T572 L573 V574	N568-D570 VanDerWaalsContact C-N 3.3Å; N568-D570 PolarHBondContact O-N 2.92Å; N568-D570 PolarHBondContact OD1-N 3.18Å; D570-T572 VanDerWaalsContact C-N 3.32Å; D570-T572 PolarHBondContact O-N 2.93Å; D570-L573 PolarHBondContact O-N 3.33Å; D570-V574 WeakPolarHBondContact O-CG2 3.47Å; D570-V574 PolarHBondContact O-N 3.49Å
571	K	77	Confident	74	Confident	58 Å²	58	64.8 Å²	64.8	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-41.7	175.5	-74.6	-175.7	176.2	175.7	0	111.7	I537 D539 N568 V574 S575 L621	I537-K571 HydrophobicContact CB-CB 4.23Å; I537-K571 HydrophobicContact CD1-CB 4.47Å; I537-K571 HydrophobicContact CG2-CB 3.98Å; I537-K571 HydrophobicContact CG2-CD 4.12Å; D539-K571 WeakPolarHBondContact OD1-CE 3.45Å; D539-K571 IonicContact OD1-NZ 3.2Å; D539-K571 PolarHBondContact OD1-NZ 3.21Å; N568-K571 HydrophobicContact CB-CB 4.1Å; N568-K571 HydrophobicContact CB-CD 4.23Å; N568-K571 HydrophobicContact CB-CG 4.32Å; N568-K571 PolarHBondContact O-N 2.92Å; N568-K571 PolarHBondContact OD1-N 3.34Å; K571-V574 PolarHBondContact O-N 2.96Å; K571-S575 WeakPolarHBondContact O-CB 3.49Å; K571-S575 PolarHBondContact O-N 3.14Å; K571-L621 HydrophobicContact CB-CD2 4.4Å; K571-L621 HydrophobicContact CG-CD2 4.25Å
572	T	79.1	Confident	75.4	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-65.2	-41	178.6	-53.5	0	0	0	0	111.6	F536 I537 N568 V569 D570 S575 N576	F536-T572 HydrophobicContact CD1-CG2 3.61Å; F536-T572 HydrophobicContact CE1-CG2 4.18Å; F536-T572 HydrophobicContact CG-CG2 4.45Å; I537-T572 PolarHBondContact N-OG1 3.14Å; N568-T572 PolarHBondContact O-N 3.22Å; N568-T572 PolarHBondContact O-OG1 3.4Å; V569-T572 PolarHBondContact O-N 3.18Å; D570-T572 VanDerWaalsContact C-N 3.32Å; D570-T572 PolarHBondContact O-N 2.93Å; T572-S575 PolarHBondContact O-N 2.72Å; T572-N576 WeakPolarHBondContact O-CB 3.44Å; T572-N576 PolarHBondContact O-N 3.18Å; T572-N576 PolarHBondContact O-ND2 2.84Å
573	L	78.5	Confident	76.6	Confident	98 Å²	98	63.4 Å²	63.4	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-46.8	175.9	-176.5	72	0	0	0	111.5	V569 D570 N576 M577	V569-L573 WeakPolarHBondContact O-CB 3.42Å; V569-L573 PolarHBondContact O-N 2.94Å; D570-L573 PolarHBondContact O-N 3.33Å; L573-N576 PolarHBondContact O-N 3.26Å; L573-M577 WeakPolarHBondContact O-CB 3.49Å; L573-M577 WeakPolarHBondContact O-CG 3.14Å; L573-M577 PolarHBondContact O-N 3.44Å
574	V	80.2	Confident	77.4	Confident	44 Å²	44	62 Å²	62	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-65.4	-43.1	179.9	173.1	0	0	0	0	111.2	D570 K571 M577 L578 I624	D570-V574 WeakPolarHBondContact O-CG2 3.47Å; D570-V574 PolarHBondContact O-N 3.49Å; K571-V574 PolarHBondContact O-N 2.96Å; V574-M577 PolarHBondContact O-N 3.07Å; V574-L578 HydrophobicContact CG1-CD1 3.93Å; V574-L578 HydrophobicContact CG1-CG 4.43Å; V574-L578 WeakPolarHBondContact O-CB 3.39Å; V574-L578 WeakPolarHBondContact O-CG 3.37Å; V574-L578 PolarHBondContact O-N 3.12Å; V574-I624 HydrophobicContact CG1-CD1 4.36Å
575	S	80	Confident	77.6	Confident	19 Å²	19	61.9 Å²	61.9	13%	0.133	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-48.5	176	175.1	0	0	0	0	111.4	I537 K571 T572 M577 L578 Q579	I537-S575 VanDerWaalsContact CD1-CB 3.43Å; K571-S575 WeakPolarHBondContact O-CB 3.49Å; K571-S575 PolarHBondContact O-N 3.14Å; T572-S575 PolarHBondContact O-N 2.72Å; S575-M577 VanDerWaalsContact C-N 3.34Å; S575-M577 PolarHBondContact O-N 3.46Å; S575-L578 PolarHBondContact O-N 3.05Å; S575-Q579 WeakPolarHBondContact O-CB 3.4Å; S575-Q579 PolarHBondContact O-N 3.42Å
576	N	80.3	Confident	77.4	Confident	71 Å²	71	60.9 Å²	60.9	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-37.1	177.6	-73.9	-27.2	0	0	0	112.9	T572 L573 S580	T572-N576 WeakPolarHBondContact O-CB 3.44Å; T572-N576 PolarHBondContact O-N 3.18Å; T572-N576 PolarHBondContact O-ND2 2.84Å; L573-N576 PolarHBondContact O-N 3.26Å; N576-S580 VanDerWaalsContact O-CB 3.31Å; N576-S580 WeakPolarHBondContact O-CB 3.23Å; N576-S580 PolarHBondContact O-N 3.45Å; N576-S580 PolarHBondContact O-OG 3.16Å
577	M	78.4	Confident	77.3	Confident	49 Å²	49	63.8 Å²	63.8	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-43.3	174.5	-82	-169.4	173	0	0	112.2	L573 V574 S575 S580 Y581 L594	L573-M577 WeakPolarHBondContact O-CB 3.49Å; L573-M577 WeakPolarHBondContact O-CG 3.14Å; L573-M577 PolarHBondContact O-N 3.44Å; V574-M577 PolarHBondContact O-N 3.07Å; S575-M577 VanDerWaalsContact C-N 3.34Å; S575-M577 PolarHBondContact O-N 3.46Å; M577-S580 PolarHBondContact O-N 2.7Å; M577-Y581 PolarHBondContact O-N 2.69Å; M577-L594 HydrophobicContact CE-CD1 4.45Å
578	L	78.2	Confident	77	Confident	31 Å²	31	69.4 Å²	69.4	16%	0.162	39%	0.39	C	S	.	.	H	α-helix	trans	-67.6	-41.2	177.1	-76.1	171.7	0	0	0	111.8	V574 S575 S580 Y581 R582	V574-L578 HydrophobicContact CG1-CD1 3.93Å; V574-L578 HydrophobicContact CG1-CG 4.43Å; V574-L578 WeakPolarHBondContact O-CB 3.39Å; V574-L578 WeakPolarHBondContact O-CG 3.37Å; V574-L578 PolarHBondContact O-N 3.12Å; S575-L578 PolarHBondContact O-N 3.05Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 2.93Å; L578-Y581 WeakPolarHBondContact O-CB 3.16Å; L578-Y581 PolarHBondContact O-N 3.19Å; L578-R582 WeakPolarHBondContact O-CB 3.43Å; L578-R582 WeakPolarHBondContact O-CG 3.43Å; L578-R582 PolarHBondContact O-N 3.05Å
579	Q	81.3	Confident	76.8	Confident	105 Å²	105	68.6 Å²	68.6	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-45.4	173.8	-170.2	178.6	13.2	0	0	110.5	S575 Y581 R582 T583	S575-Q579 WeakPolarHBondContact O-CB 3.4Å; S575-Q579 PolarHBondContact O-N 3.42Å; Q579-Y581 VanDerWaalsContact C-N 3.3Å; Q579-Y581 PolarHBondContact O-N 3.43Å; Q579-R582 PolarHBondContact O-N 2.88Å; Q579-R582 VanDerWaalsContact O-N 3.14Å; Q579-T583 PolarHBondContact O-N 3.14Å; Q579-T583 PolarHBondContact O-OG1 3.16Å
580	S	80.5	Confident	76.9	Confident	54 Å²	54	69.3 Å²	69.3	38%	0.378	40%	0.396	S	S	.	.	H	α-helix	trans	-60	-39.1	175.5	-62.3	0	0	0	0	112.5	N576 M577 L578 Q584	N576-S580 VanDerWaalsContact O-CB 3.31Å; N576-S580 WeakPolarHBondContact O-CB 3.23Å; N576-S580 PolarHBondContact O-N 3.45Å; N576-S580 PolarHBondContact O-OG 3.16Å; M577-S580 PolarHBondContact O-N 2.7Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 2.93Å; S580-Q584 VanDerWaalsContact O-CG 3.28Å; S580-Q584 WeakPolarHBondContact O-CG 3.39Å; S580-Q584 PolarHBondContact O-N 2.76Å
581	Y	77.4	Confident	77	Confident	39 Å²	39	63.9 Å²	63.9	15%	0.153	37%	0.368	C	S	.	.	H	α-helix	trans	-66.4	-41.2	174.1	-178.1	-98.9	0	0	0	112.2	M577 L578 Q579 Q584 G586 A592 L595 P602	M577-Y581 PolarHBondContact O-N 2.69Å; L578-Y581 WeakPolarHBondContact O-CB 3.16Å; L578-Y581 PolarHBondContact O-N 3.19Å; Q579-Y581 VanDerWaalsContact C-N 3.3Å; Q579-Y581 PolarHBondContact O-N 3.43Å; Y581-Q584 PolarHBondContact O-N 2.7Å; Y581-G586 PolarHBondContact O-N 3.44Å; Y581-G586 PolarHBondContact OH-O 3.02Å; Y581-A592 HydrophobicContact CD2-CB 3.75Å; Y581-A592 HydrophobicContact CE2-CB 3.57Å; Y581-L595 HydrophobicContact CD2-CD1 4.21Å; Y581-L595 HydrophobicContact CG-CD1 4.19Å; Y581-P602 HydrophobicContact CD1-CB 4.29Å; Y581-P602 HydrophobicContact CD1-CG 3.88Å; Y581-P602 HydrophobicContact CD2-CG 4.44Å; Y581-P602 HydrophobicContact CE1-CB 3.93Å; Y581-P602 HydrophobicContact CE1-CG 3.37Å; Y581-P602 HydrophobicContact CE2-CG 3.99Å; Y581-P602 HydrophobicContact CG-CG 4.39Å; Y581-P602 VanDerWaalsContact CZ-CG 3.43Å
582	R	77.2	Confident	77	Confident	100 Å²	100	61.8 Å²	61.8	38%	0.377	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-42.5	176.4	-77.3	178.2	167.9	169.1	-9.1	112.3	L578 Q579 Q584 G585 S616 E617	L578-R582 WeakPolarHBondContact O-CB 3.43Å; L578-R582 WeakPolarHBondContact O-CG 3.43Å; L578-R582 PolarHBondContact O-N 3.05Å; Q579-R582 PolarHBondContact O-N 2.88Å; Q579-R582 VanDerWaalsContact O-N 3.14Å; R582-Q584 PolarHBondContact O-N 2.95Å; R582-G585 PolarHBondContact O-N 3.24Å; R582-S616 PolarHBondContact NH2-OG 3.16Å; R582-S616 VanDerWaalsContact NH2-OG 3.14Å; R582-E617 IonicContact CZ-OE1 3Å; R582-E617 IonicContact NH1-OE1 3.85Å; R582-E617 PolarHBondContact NH1-OE1 3.05Å
583	T	79	Confident	76.9	Confident	120 Å²	120	65.6 Å²	65.6	74%	0.736	39%	0.385	S	S	*	.	H	α-helix	trans	-63.1	-28.6	175.7	-50.6	0	0	0	0	111.8	Q579 G585	Q579-T583 PolarHBondContact O-N 3.14Å; Q579-T583 PolarHBondContact O-OG1 3.16Å; T583-G585 PolarHBondContact O-N 2.86Å
584	Q	75.3	Confident	76.8	Confident	62 Å²	62	65.2 Å²	65.2	29%	0.29	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	6.9	172.3	-70.2	167.2	25	0	0	113.4	S580 Y581 R582 G586 E587 G589	S580-Q584 VanDerWaalsContact O-CG 3.28Å; S580-Q584 WeakPolarHBondContact O-CG 3.39Å; S580-Q584 PolarHBondContact O-N 2.76Å; Y581-Q584 PolarHBondContact O-N 2.7Å; R582-Q584 PolarHBondContact O-N 2.95Å; Q584-G586 PolarHBondContact O-N 3.17Å; Q584-E587 WeakPolarHBondContact O-CB 3.11Å; Q584-E587 PolarHBondContact O-N 2.92Å; Q584-E587 VanDerWaalsContact O-N 3.1Å; Q584-G589 VanDerWaalsContact OE1-CA 3.28Å
585	G	71.1	Confident	76.7	Confident	64 Å²	64	63.6 Å²	63.6	66%	0.66	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	17.4	177	0	0	0	0	0	114.6	R582 T583 E587	R582-G585 PolarHBondContact O-N 3.24Å; T583-G585 PolarHBondContact O-N 2.86Å; G585-E587 PolarHBondContact O-N 3.15Å
586	G	65.6	Low	76.4	Confident	34 Å²	34	68.5 Å²	68.5	35%	0.351	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	13.7	-172	0	0	0	0	0	114.1	Y581 Q584	Y581-G586 PolarHBondContact O-N 3.44Å; Y581-G586 PolarHBondContact OH-O 3.02Å; Q584-G586 PolarHBondContact O-N 3.17Å
587	E	70.6	Confident	76.1	Confident	127 Å²	127	68.6 Å²	68.6	59%	0.593	40%	0.401	S	S	*	.	S	Bend	trans	-84.4	166.7	176.5	-60.5	-169.3	163	0	0	111.5	Q584 G585 G589	Q584-E587 WeakPolarHBondContact O-CB 3.11Å; Q584-E587 PolarHBondContact O-N 2.92Å; Q584-E587 VanDerWaalsContact O-N 3.1Å; G585-E587 PolarHBondContact O-N 3.15Å; E587-G589 PolarHBondContact O-N 3.49Å
588	T	73	Confident	75.9	Confident	140 Å²	140	71 Å²	71	86%	0.859	42%	0.415	S	S	*	.	S	Bend	trans	-70.2	100.3	-177.2	-5.5	0	0	0	0	109.9
589	G	77.4	Confident	75.6	Confident	15 Å²	15	77.9 Å²	77.9	16%	0.155	45%	0.445	C	S	.	.	S	Bend	trans	-134	-170	175	0	0	0	0	0	113.5	Q584 E587 A591 A592 T593	Q584-G589 VanDerWaalsContact OE1-CA 3.28Å; E587-G589 PolarHBondContact O-N 3.49Å; G589-A591 VanDerWaalsContact C-N 3.31Å; G589-A591 PolarHBondContact O-N 3.13Å; G589-A592 WeakPolarHBondContact O-CB 3.46Å; G589-A592 PolarHBondContact O-N 3.45Å; G589-T593 WeakPolarHBondContact O-CB 3.44Å; G589-T593 PolarHBondContact O-N 3.42Å; G589-T593 PolarHBondContact O-OG1 3.33Å
590	P	79.7	Confident	75	Confident	97 Å²	97	77 Å²	77	63%	0.63	44%	0.443	S	S	*	.	H	α-helix	trans	-58.5	-40.8	-177	-24.5	33	0	0	0	113.1	T593 L594	P590-T593 PolarHBondContact O-N 3.32Å; P590-L594 WeakPolarHBondContact O-CG 3.48Å; P590-L594 PolarHBondContact O-N 3.25Å; P590-L594 VanDerWaalsContact O-N 3.08Å
591	A	76.4	Confident	74.3	Confident	9 Å²	9	84.5 Å²	84.5	7%	0.074	46%	0.463	C	S	.	.	H	α-helix	trans	-68.9	-42	178.1	0	0	0	0	0	111.3	G589 T593 L594 L595	G589-A591 VanDerWaalsContact C-N 3.31Å; G589-A591 PolarHBondContact O-N 3.13Å; A591-T593 VanDerWaalsContact C-N 3.32Å; A591-T593 PolarHBondContact O-N 3.28Å; A591-L594 PolarHBondContact O-N 2.79Å; A591-L595 WeakPolarHBondContact O-CG 3.48Å; A591-L595 PolarHBondContact O-N 3.31Å
592	A	76.8	Confident	73.6	Confident	13 Å²	13	83.9 Å²	83.9	11%	0.107	46%	0.464	C	S	.	.	H	α-helix	trans	-61.1	-41.4	175.1	0	0	0	0	0	112	Y581 G589 L595 M596	Y581-A592 HydrophobicContact CD2-CB 3.75Å; Y581-A592 HydrophobicContact CE2-CB 3.57Å; G589-A592 WeakPolarHBondContact O-CB 3.46Å; G589-A592 PolarHBondContact O-N 3.45Å; A592-L595 PolarHBondContact O-N 3.19Å; A592-M596 VanDerWaalsContact O-CB 3.26Å; A592-M596 WeakPolarHBondContact O-CB 3.27Å; A592-M596 PolarHBondContact O-N 3.29Å
593	T	77.6	Confident	72.6	Confident	86 Å²	86	83.1 Å²	83.1	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-42.2	179.9	-54.2	0	0	0	0	111.3	G589 P590 A591 M596 S597	G589-T593 WeakPolarHBondContact O-CB 3.44Å; G589-T593 PolarHBondContact O-N 3.42Å; G589-T593 PolarHBondContact O-OG1 3.33Å; P590-T593 PolarHBondContact O-N 3.32Å; A591-T593 VanDerWaalsContact C-N 3.32Å; A591-T593 PolarHBondContact O-N 3.28Å; T593-M596 PolarHBondContact O-N 3.32Å; T593-S597 PolarHBondContact O-N 3.14Å
594	L	77.3	Confident	71.4	Confident	91 Å²	91	85 Å²	85	48%	0.476	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-46.4	176	-72.1	172.1	0	0	0	112	M577 P590 A591 M596 S597 L598	M577-L594 HydrophobicContact CE-CD1 4.45Å; P590-L594 WeakPolarHBondContact O-CG 3.48Å; P590-L594 PolarHBondContact O-N 3.25Å; P590-L594 VanDerWaalsContact O-N 3.08Å; A591-L594 PolarHBondContact O-N 2.79Å; L594-M596 VanDerWaalsContact C-N 3.29Å; L594-M596 PolarHBondContact O-N 2.53Å; L594-S597 PolarHBondContact O-N 2.69Å; L594-S597 VanDerWaalsContact O-N 3.14Å; L594-S597 PolarHBondContact O-OG 3.26Å; L594-L598 WeakPolarHBondContact O-CG 3.31Å; L594-L598 PolarHBondContact O-N 3.19Å
595	L	77.6	Confident	70	Confident	9 Å²	9	88.4 Å²	88.4	5%	0.047	49%	0.494	C	S	.	.	H	α-helix	trans	-59.8	-40.8	175.7	-72.4	173.6	0	0	0	111.7	Y581 A591 A592 S597 L598 H599 I600 P602	Y581-L595 HydrophobicContact CD2-CD1 4.21Å; Y581-L595 HydrophobicContact CG-CD1 4.19Å; A591-L595 WeakPolarHBondContact O-CG 3.48Å; A591-L595 PolarHBondContact O-N 3.31Å; A592-L595 PolarHBondContact O-N 3.19Å; L595-S597 VanDerWaalsContact C-N 3.35Å; L595-S597 PolarHBondContact O-N 2.89Å; L595-L598 CarbonylContact O-C 3.47Å; L595-L598 PolarHBondContact O-N 2.81Å; L595-H599 PolarHBondContact O-N 3.2Å; L595-I600 CarbonylContact C-O 3.39Å; L595-I600 HydrophobicContact CD2-CB 4.35Å; L595-I600 HydrophobicContact CD2-CG2 4.29Å; L595-I600 PolarHBondContact O-N 3.05Å; L595-I600 VanDerWaalsContact O-O 3.12Å; L595-P602 HydrophobicContact CD1-CG 4.32Å
596	M	72.7	Confident	68.4	Low	122 Å²	122	90.8 Å²	90.8	60%	0.601	50%	0.497	S	S	*	.	H	α-helix	trans	-65	-37.8	176.5	-160.8	177.1	-157	0	0	112.1	A592 T593 L594 L598 H599	A592-M596 VanDerWaalsContact O-CB 3.26Å; A592-M596 WeakPolarHBondContact O-CB 3.27Å; A592-M596 PolarHBondContact O-N 3.29Å; T593-M596 PolarHBondContact O-N 3.32Å; L594-M596 VanDerWaalsContact C-N 3.29Å; L594-M596 PolarHBondContact O-N 2.53Å; M596-L598 VanDerWaalsContact C-N 3.29Å; M596-L598 PolarHBondContact O-N 2.83Å; M596-H599 PolarHBondContact O-N 3.01Å
597	S	75.5	Confident	66.9	Low	74 Å²	74	100.6 Å²	100.6	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-32.4	174.1	78	0	0	0	0	112.6	T593 L594 L595 H599	T593-S597 PolarHBondContact O-N 3.14Å; L594-S597 PolarHBondContact O-N 2.69Å; L594-S597 VanDerWaalsContact O-N 3.14Å; L594-S597 PolarHBondContact O-OG 3.26Å; L595-S597 VanDerWaalsContact C-N 3.35Å; L595-S597 PolarHBondContact O-N 2.89Å; S597-H599 PolarHBondContact O-N 3.09Å; S597-H599 PolarHBondContact O-ND1 2.73Å
598	L	74	Confident	65.1	Low	100 Å²	100	98.6 Å²	98.6	52%	0.524	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.6	173.3	-64.7	173.7	0	0	0	112.9	L594 L595 M596 I600	L594-L598 WeakPolarHBondContact O-CG 3.31Å; L594-L598 PolarHBondContact O-N 3.19Å; L595-L598 CarbonylContact O-C 3.47Å; L595-L598 PolarHBondContact O-N 2.81Å; M596-L598 VanDerWaalsContact C-N 3.29Å; M596-L598 PolarHBondContact O-N 2.83Å; L598-I600 HydrophobicContact CB-CD1 4.08Å; L598-I600 HydrophobicContact CB-CG1 4.25Å; L598-I600 PolarHBondContact O-N 3.2Å
599	H	71.7	Confident	63.3	Low	174 Å²	174	100.7 Å²	100.7	81%	0.806	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	20.9	-176.8	-60	73	0	0	0	114.2	L595 M596 S597	L595-H599 PolarHBondContact O-N 3.2Å; M596-H599 PolarHBondContact O-N 3.01Å; S597-H599 PolarHBondContact O-N 3.09Å; S597-H599 PolarHBondContact O-ND1 2.73Å
600	I	69.3	Low	61.2	Low	87 Å²	87	107.1 Å²	107.1	45%	0.446	57%	0.565	S	S	.	*			trans	-96	115.1	176.7	-60.3	169.8	0	0	0	107.5	L595 L598 P602	L595-I600 CarbonylContact C-O 3.39Å; L595-I600 HydrophobicContact CD2-CB 4.35Å; L595-I600 HydrophobicContact CD2-CG2 4.29Å; L595-I600 PolarHBondContact O-N 3.05Å; L595-I600 VanDerWaalsContact O-O 3.12Å; L598-I600 HydrophobicContact CB-CD1 4.08Å; L598-I600 HydrophobicContact CB-CG1 4.25Å; L598-I600 PolarHBondContact O-N 3.2Å; I600-P602 WeakPolarHBondContact O-CD 3.48Å
601	R	65.6	Low	59.2	Low	212 Å²	212	106.3 Å²	106.3	80%	0.8	56%	0.562	S	S	*	*			trans	-101	108.7	170.5	-75.8	-173.6	-177.2	166.6	2	109.2
602	P	61.8	Low	57.5	Low	26 Å²	26	113.2 Å²	113.2	17%	0.169	60%	0.597	C	S	.	*			trans	-62.6	147.8	171.7	24.6	-30.4	0	0	0	110.3	Y581 L595 I600	Y581-P602 HydrophobicContact CD1-CB 4.29Å; Y581-P602 HydrophobicContact CD1-CG 3.88Å; Y581-P602 HydrophobicContact CD2-CG 4.44Å; Y581-P602 HydrophobicContact CE1-CB 3.93Å; Y581-P602 HydrophobicContact CE1-CG 3.37Å; Y581-P602 HydrophobicContact CE2-CG 3.99Å; Y581-P602 HydrophobicContact CG-CG 4.39Å; Y581-P602 VanDerWaalsContact CZ-CG 3.43Å; L595-P602 HydrophobicContact CD1-CG 4.32Å; I600-P602 WeakPolarHBondContact O-CD 3.48Å
603	P	56.7	Low	56.1	Low	84 Å²	84	117.8 Å²	117.8	55%	0.545	62%	0.62	S	S	.	*			trans	-64.8	137.6	-178.7	24.7	-31.8	0	0	0	111.7	E605	P603-E605 PolarHBondContact O-N 3.38Å
604	D	52.7	Low	54.8	Low	159 Å²	159	121.5 Å²	121.5	85%	0.85	63%	0.631	S	S	*	*			trans	-67.7	95.8	172.6	-73.3	-34.9	0	0	0	109.5
605	E	47.3	Very low	53.5	Low	134 Å²	134	123 Å²	123	63%	0.626	64%	0.636	S	S	*	*			trans	-79.3	130.3	169.8	-82.6	-176.7	167.8	0	0	110.5	P603 R607	P603-E605 PolarHBondContact O-N 3.38Å; E605-R607 PolarHBondContact O-N 3.49Å
606	P	36.4	Very low	52.4	Low	114 Å²	114	124 Å²	124	74%	0.74	64%	0.644	S	S	*	*			trans	-67.5	130.7	179.1	26.5	-30.8	0	0	0	109.7	A608	P606-A608 PolarHBondContact O-N 3.48Å
607	R	35	Very low	51.4	Low	240 Å²	240	121.1 Å²	121.1	91%	0.906	63%	0.629	S	S	*	*	S	Bend	trans	-40.4	93.8	174.4	-72.8	178.3	174.6	172.4	-3.9	112	E605	E605-R607 PolarHBondContact O-N 3.49Å
608	A	32.2	Very low	50.4	Low	85 Å²	85	123.3 Å²	123.3	70%	0.702	63%	0.631	S	S	*	*			trans	-145.1	117.7	171.6	0	0	0	0	0	108.5	P606	P606-A608 PolarHBondContact O-N 3.48Å
609	Q	35.3	Very low	49.6	Very low	184 Å²	184	126.7 Å²	126.7	86%	0.86	64%	0.636	S	S	*	*			trans	20	121.8	160.1	-62.3	-176.5	-28	0	0	118.2	S611	Q609-S611 PolarHBondContact O-N 3.45Å
610	V	34.3	Very low	48.7	Very low	149 Å²	149	121.2 Å²	121.2	90%	0.903	61%	0.613	S	S	*	*			trans	-38.1	96.9	161.1	-177.4	0	0	0	0	110.6
611	S	37.2	Very low	48	Very low	81 Å²	81	118.7 Å²	118.7	57%	0.566	60%	0.6	S	S	*	*			trans	-134.7	120.2	159	57	0	0	0	0	107.1	Q609 D613	Q609-S611 PolarHBondContact O-N 3.45Å; S611-D613 VanDerWaalsContact C-N 3.31Å; S611-D613 PolarHBondContact O-N 2.99Å
612	D	41	Very low	47.6	Very low	153 Å²	153	114.2 Å²	114.2	82%	0.818	59%	0.592	S	S	*	*			trans	-65.4	84.4	178.7	-63.1	-42.4	0	0	0	110.1	E614	D612-E614 PolarHBondContact O-N 3.1Å
613	D	46.6	Very low	47	Very low	110 Å²	110	116.9 Å²	116.9	59%	0.588	61%	0.611	S	S	*	*			trans	-92.1	87.6	173.4	-76	-13	0	0	0	109.6	S611 E615 S616	S611-D613 VanDerWaalsContact C-N 3.31Å; S611-D613 PolarHBondContact O-N 2.99Å; D613-E615 PolarHBondContact O-N 3.09Å; D613-E615 VanDerWaalsContact O-N 3.09Å; D613-S616 PolarHBondContact O-N 3.44Å; D613-S616 PolarHBondContact O-OG 3.2Å
614	E	50.1	Low	46.6	Very low	163 Å²	163	118.2 Å²	118.2	76%	0.762	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	-26.5	173.1	-69.9	178.7	162.9	0	0	112.7	D612 S616 E617	D612-E614 PolarHBondContact O-N 3.1Å; E614-S616 PolarHBondContact O-N 3.49Å; E614-E617 PolarHBondContact O-N 3.13Å
615	E	50.2	Low	45.8	Very low	122 Å²	122	117.7 Å²	117.7	57%	0.57	62%	0.622	S	S	*	*	H	α-helix	trans	-66.9	-19.9	-177.5	-138.9	-166.8	146.5	0	0	113.8	D613 R619	D613-E615 PolarHBondContact O-N 3.09Å; D613-E615 VanDerWaalsContact O-N 3.09Å; E615-R619 WeakPolarHBondContact O-CG 3.31Å; E615-R619 IonicContact OE1-CZ 3.23Å; E615-R619 IonicContact OE1-NH2 3.56Å; E615-R619 PolarHBondContact OE1-NH2 2.85Å
616	S	54.8	Low	45.7	Very low	31 Å²	31	116.9 Å²	116.9	22%	0.217	62%	0.622	C	S	.	*	H	α-helix	trans	-79.8	-32.6	177.8	63.2	0	0	0	0	112.8	R582 D613 E614 L620	R582-S616 PolarHBondContact NH2-OG 3.16Å; R582-S616 VanDerWaalsContact NH2-OG 3.14Å; D613-S616 PolarHBondContact O-N 3.44Å; D613-S616 PolarHBondContact O-OG 3.2Å; E614-S616 PolarHBondContact O-N 3.49Å; S616-L620 PolarHBondContact O-N 2.93Å
617	E	51.5	Low	46.2	Very low	62 Å²	62	117.1 Å²	117.1	29%	0.29	62%	0.615	S	S	.	*	H	α-helix	trans	-73	-42.5	178.7	-70.2	-166.8	163.6	0	0	111.8	R582 E614 R619 L620 L621	R582-E617 IonicContact CZ-OE1 3Å; R582-E617 IonicContact NH1-OE1 3.85Å; R582-E617 PolarHBondContact NH1-OE1 3.05Å; E614-E617 PolarHBondContact O-N 3.13Å; E617-R619 VanDerWaalsContact C-N 3.28Å; E617-R619 PolarHBondContact O-N 3.06Å; E617-L620 PolarHBondContact O-N 3.42Å; E617-L621 WeakPolarHBondContact O-CB 3.48Å; E617-L621 WeakPolarHBondContact O-CG 3.32Å; E617-L621 PolarHBondContact O-N 2.76Å
618	E	55.2	Low	46.8	Very low	119 Å²	119	110.2 Å²	110.2	56%	0.556	60%	0.599	S	S	*	*	H	α-helix	trans	-61	-36	176.6	-77.3	-168.1	152.4	0	0	112.7	N622	E618-N622 VanDerWaalsContact O-CB 3.31Å; E618-N622 WeakPolarHBondContact O-CB 3.25Å; E618-N622 VanDerWaalsContact O-CG 3.26Å; E618-N622 PolarHBondContact O-N 3.48Å; E618-N622 PolarHBondContact O-ND2 3.21Å; E618-N622 VanDerWaalsContact O-ND2 3.09Å
619	R	55.9	Low	47.7	Very low	171 Å²	171	111.7 Å²	111.7	65%	0.645	59%	0.593	S	S	*	*	H	α-helix	trans	-69.4	-35.2	179.2	-73.4	-178.3	-172.6	175.9	9.2	112.8	E615 E617 S623	E615-R619 WeakPolarHBondContact O-CG 3.31Å; E615-R619 IonicContact OE1-CZ 3.23Å; E615-R619 IonicContact OE1-NH2 3.56Å; E615-R619 PolarHBondContact OE1-NH2 2.85Å; E617-R619 VanDerWaalsContact C-N 3.28Å; E617-R619 PolarHBondContact O-N 3.06Å; R619-S623 PolarHBondContact O-N 2.95Å
620	L	53.3	Low	48.5	Very low	60 Å²	60	107.2 Å²	107.2	31%	0.314	58%	0.576	S	S	.	*	H	α-helix	trans	-76	-41.7	175.8	-80.8	162.8	0	0	0	111.4	S616 E617 N622 S623 I624	S616-L620 PolarHBondContact O-N 2.93Å; E617-L620 PolarHBondContact O-N 3.42Å; L620-N622 VanDerWaalsContact C-N 3.29Å; L620-N622 PolarHBondContact O-N 3.06Å; L620-S623 PolarHBondContact O-N 3.38Å; L620-S623 PolarHBondContact O-OG 3.29Å; L620-I624 PolarHBondContact O-N 3.39Å
621	L	54.8	Low	49.4	Very low	34 Å²	34	104.4 Å²	104.4	18%	0.178	56%	0.555	C	S	.	*	H	α-helix	trans	-61	-36.9	175.6	-72.9	168.4	0	0	0	112.2	K571 E617 S623	K571-L621 HydrophobicContact CB-CD2 4.4Å; K571-L621 HydrophobicContact CG-CD2 4.25Å; E617-L621 WeakPolarHBondContact O-CB 3.48Å; E617-L621 WeakPolarHBondContact O-CG 3.32Å; E617-L621 PolarHBondContact O-N 2.76Å; L621-S623 VanDerWaalsContact C-N 3.29Å; L621-S623 PolarHBondContact O-N 2.87Å
622	N	56.8	Low	50.3	Low	117 Å²	117	106.1 Å²	106.1	63%	0.626	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-13.3	175.4	-74.8	-31.7	0	0	0	114.3	E618 L620	E618-N622 VanDerWaalsContact O-CB 3.31Å; E618-N622 WeakPolarHBondContact O-CB 3.25Å; E618-N622 VanDerWaalsContact O-CG 3.26Å; E618-N622 PolarHBondContact O-N 3.48Å; E618-N622 PolarHBondContact O-ND2 3.21Å; E618-N622 VanDerWaalsContact O-ND2 3.09Å; L620-N622 VanDerWaalsContact C-N 3.29Å; L620-N622 PolarHBondContact O-N 3.06Å
623	S	50.2	Low	51	Low	82 Å²	82	102.5 Å²	102.5	57%	0.573	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-12.7	177.3	74.5	0	0	0	0	114	R619 L620 L621	R619-S623 PolarHBondContact O-N 2.95Å; L620-S623 PolarHBondContact O-N 3.38Å; L620-S623 PolarHBondContact O-OG 3.29Å; L621-S623 VanDerWaalsContact C-N 3.29Å; L621-S623 PolarHBondContact O-N 2.87Å
624	I	46.9	Very low	51.4	Low	112 Å²	112	101.8 Å²	101.8	57%	0.574	53%	0.529	S	S	*	.			trans	-100	-10.4	-179.4	-62.6	171.9	0	0	0	111.4	V574 L620	V574-I624 HydrophobicContact CG1-CD1 4.36Å; L620-I624 PolarHBondContact O-N 3.39Å
625	S	36.7	Very low	51.5	Low	149 Å²	149	96.3 Å²	96.3	100%	1.042	51%	0.508	S	S	*	.			trans	-85.4	0	169	-164.9	0	0	0	0	111.9

Retrieved 625 of 625 residues in 400.7 ms (Link to these results)

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