A0A087X9W0_POEFO Loading...

SLIT-ROBO Rho GTPase-activating protein 3

AlphaFold DB , UniProt , Accession A0A087X9W0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,103 aa.

						>A0A087X9W0_POEFO|A0A087X9W0
MSSTKTKKDKEIIAEYETQVKEIRNQLVEQFKCLEQQSESRIQLLQDLQEFFRRKAEIELEYSRSLEKLAERFSSKIRSSREHQQFKKDQHLLSSVNCWYLLLNQTRRESRDHATLSDIYTNNVIVRLAQISEDVIRLFKKSKEIGIQMHEELVKVTNELYTVMKTYHMYHTESISAESKLKDAEKQEEKQFSKSGDLNVNLLRHEDRQPRRSSARKIEKMKEKRQAKYSENKLKCTKARNDYLLNLAATNAVVAKYYIHDVSDMIDCCDLGYHASLARTFRTYLSAEYNLETSRHEGLDIIENAVDNLDSRSDKHKIMDMHNQVFCPPMRFEYLPHMGDEVCQVSAQQPVQTELLMRYHQLQSRLATLKIENEEVRKTLDATMQTLQDMLTVEDFDVSDAFQHSRSTESIKSVASESYMSKLNIAKRRSNQQETETFYFSKFKEYLNGSNLIIKLQAKHDLLKQTLGEGERAECGTTRPPTLPPKPQKMRKPRPRSMFNHKLFNGNMETFIKDSGQPIPLVVESCVRYINLYGLQQQGIFRVPGSQVEVNDIKNSFERGEDPLIDDQNDHDINSVAGVLKLYFRGLENPLFPKERFLDFISTIKLESEAERAHHIQQIVVTLPRTVIIVMRYLFAFLNHLSQYSDENMMDPYNLAICFGPTLMPIPDGQDPVACQAHVNEVIKTIIINHEVIFPNQRELDGPVYEKCMTGGEEYCDSPHSEPGTIDEADNGTEPHTSDEEVEQIEAIAKFDYTGRSPRELSFKKGASLLLYHRASEDWWEGRHNGVDGLIPHQYIVVQDLDDAFSDNLSQKADSEASSGPLLEGSSKNDIPSPCEQPADYNFGGVMGRVRLRSDGAAVPRRRSGGTETHSPTRVPDTPPRAAACPSSPHKISISKARMESPEKRRLGTFGSAGSINYPDRKAYPEGHPLRPVPGATRHSSLGDHKTLETEALAEDIEKTMSTALHELRELERQNTVKQAPDVVLDTLELMKNPASSEPGSPLHTIMIRDPDAAMRRSSSSTSEMMTTFKPALSARLAGAQLRPPAMRPARSAPTQHRSSSSSSSGVGSPAVTPTEKLFPSNSSASGSNVNVSGDAGDKTGGM
					

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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	32.6	Very low	57.5	Low	246 Å²	246	131 Å²	131	100%	1.212	69%	0.688	S	S	*	*				0	132	0	-70	176.2	172.1	0	0	107.9
2	S	34.6	Very low	59.8	Low	111 Å²	111	124.3 Å²	124.3	78%	0.776	65%	0.652	S	S	*	*			trans	-79.8	152.3	168.7	-172.9	0	0	0	0	109.9	T4	S2-T4 PolarHBondContact O-N 3.39Å
3	S	36.7	Very low	61.9	Low	111 Å²	111	116.3 Å²	116.3	78%	0.776	61%	0.61	S	S	*	*			trans	-69.2	101.7	170.6	-175	0	0	0	0	108.8	K5	S3-K5 PolarHBondContact O-N 3.34Å
4	T	47.6	Very low	63.7	Low	129 Å²	129	111.4 Å²	111.4	79%	0.791	59%	0.594	S	S	*	*			trans	-67	95.8	176.4	48.5	0	0	0	0	109.2	S2 T6	S2-T4 PolarHBondContact O-N 3.39Å; T4-T6 PolarHBondContact O-N 3.06Å
5	K	50.3	Low	65.5	Low	145 Å²	145	109.9 Å²	109.9	63%	0.63	58%	0.582	S	S	*	*			trans	-44.6	126.2	171.7	-79.7	-176.3	166.2	-168	0	109.7	S3 K7 E11	S3-K5 PolarHBondContact O-N 3.34Å; K5-K7 HydrophobicContact CB-CG 3.99Å; K5-K7 PolarHBondContact O-N 3.45Å; K5-E11 IonicContact NZ-OE1 2.62Å; K5-E11 PolarHBondContact NZ-OE1 2.94Å
6	T	58.8	Low	67.2	Low	141 Å²	141	104.7 Å²	104.7	87%	0.865	55%	0.552	S	S	*	*			trans	-73	69	166.4	19.6	0	0	0	0	109.7	T4 K8	T4-T6 PolarHBondContact O-N 3.06Å; T6-K8 PolarHBondContact O-N 3.36Å
7	K	69.1	Low	68.7	Low	81 Å²	81	104 Å²	104	35%	0.352	55%	0.546	S	S	.	.			trans	-57.3	135.1	177.6	-60.4	-161.7	-170.7	-168.8	0	109.5	K5 E11 I12 E15	K5-K7 HydrophobicContact CB-CG 3.99Å; K5-K7 PolarHBondContact O-N 3.45Å; K7-E11 VanDerWaalsContact CA-OE2 3.31Å; K7-E11 WeakPolarHBondContact CA-OE2 3.29Å; K7-E11 HydrophobicContact CB-CB 4.37Å; K7-E11 HydrophobicContact CB-CG 4.42Å; K7-E11 HydrophobicContact CD-CG 4.19Å; K7-E11 HydrophobicContact CG-CG 4.39Å; K7-I12 HydrophobicContact CB-CD1 4.08Å; K7-I12 HydrophobicContact CB-CG1 3.73Å; K7-I12 HydrophobicContact CD-CG1 4.16Å; K7-E15 IonicContact NZ-OE1 2.87Å; K7-E15 PolarHBondContact NZ-OE1 3.24Å; K7-E15 IonicContact NZ-OE2 2.62Å; K7-E15 PolarHBondContact NZ-OE2 2.74Å
8	K	70.9	Confident	70.1	Confident	165 Å²	165	102.3 Å²	102.3	72%	0.717	54%	0.54	S	S	*	.			trans	-88.7	156.7	174.5	-67.7	177.9	-178.4	173.4	0	109.4	T6 K10 E11 I12	T6-K8 PolarHBondContact O-N 3.36Å; K8-K10 PolarHBondContact O-N 3Å; K8-E11 WeakPolarHBondContact O-CB 3.5Å; K8-E11 PolarHBondContact O-N 3Å; K8-I12 PolarHBondContact O-N 2.85Å
9	D	71.3	Confident	71.3	Confident	67 Å²	67	102.6 Å²	102.6	36%	0.358	54%	0.539	S	S	.	.	H	α-helix	trans	-37.8	-50.5	177.8	-178.5	36.7	0	0	0	113.5	E11 I12 I13 H168	D9-E11 PolarHBondContact O-N 3.42Å; D9-I12 PolarHBondContact O-N 3.47Å; D9-I13 WeakPolarHBondContact O-CB 3.38Å; D9-I13 WeakPolarHBondContact O-CG1 3.45Å; D9-I13 PolarHBondContact O-N 3.29Å; D9-I13 WeakPolarHBondContact OD1-CD1 3.46Å; D9-H168 WeakPolarHBondContact OD1-CB 3.38Å; D9-H168 IonicContact OD1-CE1 2.67Å; D9-H168 IonicContact OD1-CG 3.92Å; D9-H168 IonicContact OD1-ND1 3.85Å; D9-H168 PolarHBondContact OD1-ND1 3.2Å
10	K	77.1	Confident	72.5	Confident	179 Å²	179	98.1 Å²	98.1	78%	0.778	52%	0.515	S	S	*	.	H	α-helix	trans	-62.1	-31.2	177.7	-63.1	-168.7	175.6	-167.7	0	115.8	K8 A14	K8-K10 PolarHBondContact O-N 3Å; K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.48Å; K10-A14 PolarHBondContact O-N 3.45Å; K10-A14 VanDerWaalsContact O-N 3.15Å
11	E	83.7	Confident	73.5	Confident	66 Å²	66	100 Å²	100	31%	0.308	52%	0.519	S	S	.	.	H	α-helix	trans	-73.3	-45.2	179	-171.3	179	176.3	0	0	109.7	K5 K7 K8 D9 A14 E15	K5-E11 IonicContact NZ-OE1 2.62Å; K5-E11 PolarHBondContact NZ-OE1 2.94Å; K7-E11 VanDerWaalsContact CA-OE2 3.31Å; K7-E11 WeakPolarHBondContact CA-OE2 3.29Å; K7-E11 HydrophobicContact CB-CB 4.37Å; K7-E11 HydrophobicContact CB-CG 4.42Å; K7-E11 HydrophobicContact CD-CG 4.19Å; K7-E11 HydrophobicContact CG-CG 4.39Å; K8-E11 WeakPolarHBondContact O-CB 3.5Å; K8-E11 PolarHBondContact O-N 3Å; D9-E11 PolarHBondContact O-N 3.42Å; E11-A14 PolarHBondContact O-N 3.5Å; E11-E15 WeakPolarHBondContact O-CG 3.26Å; E11-E15 PolarHBondContact O-N 3.23Å; E11-E15 VanDerWaalsContact O-N 3.07Å
12	I	84.6	Confident	76.5	Confident	50 Å²	50	93.6 Å²	93.6	26%	0.256	49%	0.486	S	S	.	.	H	α-helix	trans	-66.9	-42.7	178.4	-53.6	174.3	0	0	0	110.8	K7 K8 D9 E15 Y16 M164	K7-I12 HydrophobicContact CB-CD1 4.08Å; K7-I12 HydrophobicContact CB-CG1 3.73Å; K7-I12 HydrophobicContact CD-CG1 4.16Å; K8-I12 PolarHBondContact O-N 2.85Å; D9-I12 PolarHBondContact O-N 3.47Å; I12-E15 PolarHBondContact O-N 3.16Å; I12-Y16 WeakPolarHBondContact O-CB 3.35Å; I12-Y16 PolarHBondContact O-N 3.04Å; I12-M164 HydrophobicContact CG2-SD 3.92Å
13	I	87.3	Confident	79.3	Confident	21 Å²	21	89.5 Å²	89.5	11%	0.108	46%	0.456	C	S	.	.	H	α-helix	trans	-61.4	-45	176.3	-76	175.1	0	0	0	111.2	D9 Y16 E17 Y161 M164	D9-I13 WeakPolarHBondContact O-CB 3.38Å; D9-I13 WeakPolarHBondContact O-CG1 3.45Å; D9-I13 PolarHBondContact O-N 3.29Å; D9-I13 WeakPolarHBondContact OD1-CD1 3.46Å; I13-Y16 PolarHBondContact O-N 3.2Å; I13-E17 HydrophobicContact CG2-CG 4.27Å; I13-E17 VanDerWaalsContact CG2-OE1 3.22Å; I13-E17 WeakPolarHBondContact CG2-OE1 3.49Å; I13-E17 WeakPolarHBondContact O-CB 3.37Å; I13-E17 WeakPolarHBondContact O-CG 3.4Å; I13-E17 PolarHBondContact O-N 3.4Å; I13-Y161 HydrophobicContact CG2-CE2 4.01Å; I13-M164 HydrophobicContact CG1-CE 4.21Å
14	A	87.7	Confident	82	Confident	47 Å²	47	88.9 Å²	88.9	39%	0.388	44%	0.436	S	S	.	.	H	α-helix	trans	-67.6	-37.5	-180	0	0	0	0	0	113.1	K10 E11 T18	K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.48Å; K10-A14 PolarHBondContact O-N 3.45Å; K10-A14 VanDerWaalsContact O-N 3.15Å; E11-A14 PolarHBondContact O-N 3.5Å; A14-T18 WeakPolarHBondContact O-CB 3.47Å; A14-T18 PolarHBondContact O-N 2.84Å; A14-T18 PolarHBondContact O-OG1 3Å
15	E	90.2	Very high	84.3	Confident	89 Å²	89	87.1 Å²	87.1	42%	0.416	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-44.7	172.2	-73	172.9	166.2	0	0	111.2	K7 E11 I12 T18 Q19	K7-E15 IonicContact NZ-OE1 2.87Å; K7-E15 PolarHBondContact NZ-OE1 3.24Å; K7-E15 IonicContact NZ-OE2 2.62Å; K7-E15 PolarHBondContact NZ-OE2 2.74Å; E11-E15 WeakPolarHBondContact O-CG 3.26Å; E11-E15 PolarHBondContact O-N 3.23Å; E11-E15 VanDerWaalsContact O-N 3.07Å; I12-E15 PolarHBondContact O-N 3.16Å; E15-T18 WeakPolarHBondContact O-CB 3.36Å; E15-T18 PolarHBondContact O-N 3.46Å; E15-Q19 PolarHBondContact O-N 2.87Å
16	Y	92.8	Very high	86.5	Confident	27 Å²	27	84.7 Å²	84.7	11%	0.106	41%	0.413	C	S	.	.	H	α-helix	trans	-67.1	-44.9	178.5	-175.9	-94.1	0	0	0	113.1	I12 I13 T18 Q19 V20 T157 L160 Y161 M164	I12-Y16 WeakPolarHBondContact O-CB 3.35Å; I12-Y16 PolarHBondContact O-N 3.04Å; I13-Y16 PolarHBondContact O-N 3.2Å; Y16-T18 PolarHBondContact O-N 3.1Å; Y16-Q19 PolarHBondContact O-N 2.93Å; Y16-V20 HydrophobicContact CD1-CG2 4.03Å; Y16-V20 HydrophobicContact CE1-CG2 3.43Å; Y16-V20 VanDerWaalsContact CE1-CG2 3.43Å; Y16-V20 HydrophobicContact CE2-CG2 4.19Å; Y16-V20 VanDerWaalsContact CZ-CG2 3.5Å; Y16-V20 WeakPolarHBondContact O-CG2 3.5Å; Y16-V20 PolarHBondContact O-N 3.44Å; Y16-T157 WeakPolarHBondContact OH-CA 3.29Å; Y16-T157 WeakPolarHBondContact OH-CB 3.44Å; Y16-T157 PolarHBondContact OH-O 3.28Å; Y16-L160 HydrophobicContact CE2-CD2 3.82Å; Y16-L160 HydrophobicContact CE2-CG 4.38Å; Y16-Y161 AromaticContact CD1-CD2 3.87Å; Y16-Y161 HydrophobicContact CD1-CD2 3.87Å; Y16-Y161 HydrophobicContact CE1-CD2 4.09Å; Y16-M164 HydrophobicContact CD1-CE 4.04Å; Y16-M164 HydrophobicContact CD2-CE 4.49Å; Y16-M164 HydrophobicContact CG-CE 3.87Å
17	E	92.1	Very high	88.2	Confident	93 Å²	93	78.2 Å²	78.2	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-31.6	175.5	-74.2	173.1	-178.1	0	0	111.6	I13 K21 Y161	I13-E17 HydrophobicContact CG2-CG 4.27Å; I13-E17 VanDerWaalsContact CG2-OE1 3.22Å; I13-E17 WeakPolarHBondContact CG2-OE1 3.49Å; I13-E17 WeakPolarHBondContact O-CB 3.37Å; I13-E17 WeakPolarHBondContact O-CG 3.4Å; I13-E17 PolarHBondContact O-N 3.4Å; E17-K21 WeakPolarHBondContact O-CB 3.28Å; E17-K21 PolarHBondContact O-N 3.18Å; E17-K21 VanDerWaalsContact O-N 3.12Å; E17-Y161 HydrophobicContact CG-CE2 3.82Å; E17-Y161 WeakPolarHBondContact OE1-CE2 3.33Å; E17-Y161 VanDerWaalsContact OE1-CZ 3.3Å; E17-Y161 PolarHBondContact OE1-OH 3.11Å
18	T	94.6	Very high	89.4	Confident	73 Å²	73	78.1 Å²	78.1	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-67.6	-49.6	172.3	-55.8	0	0	0	0	111.2	A14 E15 Y16 V20 K21 E22	A14-T18 WeakPolarHBondContact O-CB 3.47Å; A14-T18 PolarHBondContact O-N 2.84Å; A14-T18 PolarHBondContact O-OG1 3Å; E15-T18 WeakPolarHBondContact O-CB 3.36Å; E15-T18 PolarHBondContact O-N 3.46Å; Y16-T18 PolarHBondContact O-N 3.1Å; T18-V20 PolarHBondContact O-N 2.97Å; T18-K21 WeakPolarHBondContact O-CB 3.39Å; T18-K21 PolarHBondContact O-N 3.42Å; T18-K21 VanDerWaalsContact O-N 3.11Å; T18-E22 PolarHBondContact O-N 3.1Å
19	Q	93.3	Very high	90.7	Very high	109 Å²	109	75 Å²	75	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-41.6	178.5	-170.2	-178.6	12	0	0	112.5	E15 Y16 K21 E22 I23	E15-Q19 PolarHBondContact O-N 2.87Å; Y16-Q19 PolarHBondContact O-N 2.93Å; Q19-K21 VanDerWaalsContact C-N 3.31Å; Q19-K21 PolarHBondContact O-N 2.94Å; Q19-E22 PolarHBondContact O-N 3Å; Q19-I23 HydrophobicContact CG-CD1 4.39Å; Q19-I23 WeakPolarHBondContact O-CG1 3.46Å; Q19-I23 PolarHBondContact O-N 3.49Å
20	V	94.4	Very high	91.7	Very high	12 Å²	12	73.9 Å²	73.9	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-33.6	176.1	173.1	0	0	0	0	111.6	Y16 T18 R24 T157	Y16-V20 HydrophobicContact CD1-CG2 4.03Å; Y16-V20 HydrophobicContact CE1-CG2 3.43Å; Y16-V20 VanDerWaalsContact CE1-CG2 3.43Å; Y16-V20 HydrophobicContact CE2-CG2 4.19Å; Y16-V20 VanDerWaalsContact CZ-CG2 3.5Å; Y16-V20 WeakPolarHBondContact O-CG2 3.5Å; Y16-V20 PolarHBondContact O-N 3.44Å; T18-V20 PolarHBondContact O-N 2.97Å; V20-R24 WeakPolarHBondContact O-CG 3.35Å; V20-R24 PolarHBondContact O-N 3.12Å; V20-T157 HydrophobicContact CG2-CG2 4.32Å
21	K	94.8	Very high	92.5	Very high	138 Å²	138	66.5 Å²	66.5	60%	0.6	33%	0.327	S	S	*	.	H	α-helix	trans	-67.8	-40.5	173.2	-174.4	-177.6	177.7	-174.1	0	111.9	E17 T18 Q19 R24 N25	E17-K21 WeakPolarHBondContact O-CB 3.28Å; E17-K21 PolarHBondContact O-N 3.18Å; E17-K21 VanDerWaalsContact O-N 3.12Å; T18-K21 WeakPolarHBondContact O-CB 3.39Å; T18-K21 PolarHBondContact O-N 3.42Å; T18-K21 VanDerWaalsContact O-N 3.11Å; Q19-K21 VanDerWaalsContact C-N 3.31Å; Q19-K21 PolarHBondContact O-N 2.94Å; K21-R24 PolarHBondContact O-N 2.94Å; K21-N25 PolarHBondContact O-N 3.43Å; K21-N25 PolarHBondContact O-OD1 3.13Å
22	E	94.7	Very high	93	Very high	111 Å²	111	68.4 Å²	68.4	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-45.4	174.6	-72.1	170.9	-175.9	0	0	111.6	T18 Q19 N25 Q26	T18-E22 PolarHBondContact O-N 3.1Å; Q19-E22 PolarHBondContact O-N 3Å; E22-N25 PolarHBondContact O-N 3.32Å; E22-Q26 WeakPolarHBondContact O-CG 3.47Å; E22-Q26 PolarHBondContact O-N 3.39Å
23	I	93.9	Very high	93.6	Very high	26 Å²	26	69.7 Å²	69.7	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-58.5	-51.6	173.8	-67.3	165.4	0	0	0	110.4	Q19 N25 Q26 L27	Q19-I23 HydrophobicContact CG-CD1 4.39Å; Q19-I23 WeakPolarHBondContact O-CG1 3.46Å; Q19-I23 PolarHBondContact O-N 3.49Å; I23-N25 VanDerWaalsContact C-N 3.28Å; I23-N25 PolarHBondContact O-N 3.17Å; I23-Q26 WeakPolarHBondContact O-CB 3.3Å; I23-Q26 PolarHBondContact O-N 3.24Å; I23-L27 HydrophobicContact CG2-CD1 4.28Å; I23-L27 HydrophobicContact CG2-CG 4.34Å; I23-L27 WeakPolarHBondContact O-CG 3.35Å; I23-L27 PolarHBondContact O-N 2.98Å
24	R	93.8	Very high	93.9	Very high	98 Å²	98	69.5 Å²	69.5	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-58.8	-37.4	179.6	-73.4	176	-170.1	177.7	7	112.9	V20 K21 V28 V154 N158	V20-R24 WeakPolarHBondContact O-CG 3.35Å; V20-R24 PolarHBondContact O-N 3.12Å; K21-R24 PolarHBondContact O-N 2.94Å; R24-V28 WeakPolarHBondContact O-CG2 3.45Å; R24-V28 PolarHBondContact O-N 3.12Å; R24-V154 HydrophobicContact CG-CG2 4.22Å; R24-N158 PolarHBondContact NH2-OD1 2.88Å
25	N	95.6	Very high	94.2	Very high	92 Å²	92	70.3 Å²	70.3	49%	0.492	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-45.5	173.1	-74	3.2	0	0	0	111.4	K21 E22 I23 L27 V28 E29	K21-N25 PolarHBondContact O-N 3.43Å; K21-N25 PolarHBondContact O-OD1 3.13Å; E22-N25 PolarHBondContact O-N 3.32Å; I23-N25 VanDerWaalsContact C-N 3.28Å; I23-N25 PolarHBondContact O-N 3.17Å; N25-L27 VanDerWaalsContact C-N 3.34Å; N25-L27 PolarHBondContact O-N 3.3Å; N25-V28 PolarHBondContact O-N 2.87Å; N25-E29 PolarHBondContact O-N 2.7Å
26	Q	95.2	Very high	94.5	Very high	93 Å²	93	71.9 Å²	71.9	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-40.7	177.8	-71.4	177.9	11.9	0	0	112.6	E22 I23 V28 E29 Q30 Y258	E22-Q26 WeakPolarHBondContact O-CG 3.47Å; E22-Q26 PolarHBondContact O-N 3.39Å; I23-Q26 WeakPolarHBondContact O-CB 3.3Å; I23-Q26 PolarHBondContact O-N 3.24Å; Q26-V28 VanDerWaalsContact C-N 3.28Å; Q26-V28 PolarHBondContact O-N 3.26Å; Q26-E29 PolarHBondContact O-N 3.37Å; Q26-Q30 WeakPolarHBondContact O-CB 3.19Å; Q26-Q30 VanDerWaalsContact O-CG 3.24Å; Q26-Q30 WeakPolarHBondContact O-CG 3.31Å; Q26-Q30 PolarHBondContact O-N 3.4Å; Q26-Y258 PolarHBondContact OE1-OH 2.91Å
27	L	94.8	Very high	94.6	Very high	6 Å²	6	73.5 Å²	73.5	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-60.1	-37.9	176.7	-64.2	-177.6	0	0	0	112.1	I23 N25 F31 H150 L153 Y257	I23-L27 HydrophobicContact CG2-CD1 4.28Å; I23-L27 HydrophobicContact CG2-CG 4.34Å; I23-L27 WeakPolarHBondContact O-CG 3.35Å; I23-L27 PolarHBondContact O-N 2.98Å; N25-L27 VanDerWaalsContact C-N 3.34Å; N25-L27 PolarHBondContact O-N 3.3Å; L27-F31 PolarHBondContact O-N 3.18Å; L27-H150 HydrophobicContact CD1-CB 4.14Å; L27-H150 PolarHBondContact O-CE1 3.1Å; L27-L153 HydrophobicContact CD1-CD1 4.06Å; L27-L153 HydrophobicContact CD2-CD1 3.88Å; L27-Y257 HydrophobicContact CD2-CD1 4.41Å; L27-Y257 HydrophobicContact CD2-CE1 3.49Å; L27-Y257 VanDerWaalsContact CD2-CE1 3.49Å
28	V	95.4	Very high	94.7	Very high	78 Å²	78	69.4 Å²	69.4	47%	0.473	34%	0.34	S	S	.	.	H	α-helix	trans	-69.3	-44.3	175.3	172.2	0	0	0	0	112	R24 N25 Q26 F31 K32	R24-V28 WeakPolarHBondContact O-CG2 3.45Å; R24-V28 PolarHBondContact O-N 3.12Å; N25-V28 PolarHBondContact O-N 2.87Å; Q26-V28 VanDerWaalsContact C-N 3.28Å; Q26-V28 PolarHBondContact O-N 3.26Å; V28-F31 PolarHBondContact O-N 3.01Å; V28-K32 PolarHBondContact O-N 3.38Å; V28-K32 VanDerWaalsContact O-N 3.13Å
29	E	96.5	Very high	94.8	Very high	101 Å²	101	71.7 Å²	71.7	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-68.9	-32.7	177.9	-57.4	-45.9	122.9	0	0	112.6	N25 Q26 F31 K32 C33	N25-E29 PolarHBondContact O-N 2.7Å; Q26-E29 PolarHBondContact O-N 3.37Å; E29-F31 VanDerWaalsContact C-N 3.35Å; E29-F31 PolarHBondContact O-N 3.05Å; E29-K32 PolarHBondContact O-N 3Å; E29-K32 IonicContact OE1-NZ 3.4Å; E29-K32 PolarHBondContact OE1-NZ 2.99Å; E29-K32 WeakPolarHBondContact OE2-CD 3.46Å; E29-K32 IonicContact OE2-NZ 3.37Å; E29-K32 PolarHBondContact OE2-NZ 3.16Å; E29-C33 WeakPolarHBondContact O-CB 3.04Å; E29-C33 PolarHBondContact O-N 2.72Å
30	Q	93.8	Very high	95	Very high	43 Å²	43	69.9 Å²	69.9	20%	0.201	34%	0.344	C	S	.	.	H	α-helix	trans	-58.2	-45.8	171.2	-77.8	169.8	0.6	0	0	111.1	Q26 C33 L34 Y257	Q26-Q30 WeakPolarHBondContact O-CB 3.19Å; Q26-Q30 VanDerWaalsContact O-CG 3.24Å; Q26-Q30 WeakPolarHBondContact O-CG 3.31Å; Q26-Q30 PolarHBondContact O-N 3.4Å; Q30-C33 WeakPolarHBondContact O-CB 3.31Å; Q30-C33 PolarHBondContact O-N 3.19Å; Q30-L34 WeakPolarHBondContact O-CG 3.46Å; Q30-L34 PolarHBondContact O-N 3.18Å; Q30-L34 VanDerWaalsContact O-N 3.16Å; Q30-Y257 PolarHBondContact OE1-OH 3.41Å
31	F	92.9	Very high	95.1	Very high	23 Å²	23	70.8 Å²	70.8	10%	0.101	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-40.3	177.6	-95.5	-38.2	0	0	0	113.7	L27 V28 E29 C33 L34 E35 K143 I147 H150 M265	L27-F31 PolarHBondContact O-N 3.18Å; V28-F31 PolarHBondContact O-N 3.01Å; E29-F31 VanDerWaalsContact C-N 3.35Å; E29-F31 PolarHBondContact O-N 3.05Å; F31-C33 VanDerWaalsContact C-N 3.27Å; F31-C33 PolarHBondContact O-N 3.04Å; F31-L34 HydrophobicContact CD1-CD1 4.43Å; F31-L34 PolarHBondContact O-N 3.12Å; F31-E35 VanDerWaalsContact O-CB 3.32Å; F31-E35 WeakPolarHBondContact O-CB 3.25Å; F31-E35 PolarHBondContact O-N 3.11Å; F31-K143 HydrophobicContact CD1-CG 4.28Å; F31-K143 HydrophobicContact CE1-CB 4.41Å; F31-K143 HydrophobicContact CE1-CG 3.89Å; F31-K143 HydrophobicContact CZ-CG 4.2Å; F31-K143 WeakPolarHBondContact CZ-O 3.41Å; F31-I147 HydrophobicContact CE2-CG1 3.7Å; F31-I147 HydrophobicContact CZ-CG1 3.86Å; F31-H150 AromaticContact CD1-CE1 3.99Å; F31-H150 AromaticContact CD2-CE1 2.74Å; F31-H150 WeakPolarHBondContact CD2-CE1 3.38Å; F31-H150 AromaticContact CD2-ND1 3.59Å; F31-H150 AromaticContact CE2-CE1 3.11Å; F31-H150 WeakPolarHBondContact CE2-CE1 3.48Å; F31-H150 AromaticContact CE2-ND1 3.33Å; F31-H150 VanDerWaalsContact CE2-ND1 3.33Å; F31-H150 WeakPolarHBondContact CE2-ND1 3.38Å; F31-H150 AromaticContact CG-CE1 3.26Å; F31-H150 WeakPolarHBondContact CG-CE1 3.3Å; F31-H150 AromaticContact CZ-CE1 3.86Å; F31-M265 HydrophobicContact CE1-SD 4.42Å
32	K	95.4	Very high	95.3	Very high	107 Å²	107	65.6 Å²	65.6	47%	0.465	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-40.3	173.8	-71.6	167.5	173.9	172.6	0	112	V28 E29 E35 Q36	V28-K32 PolarHBondContact O-N 3.38Å; V28-K32 VanDerWaalsContact O-N 3.13Å; E29-K32 PolarHBondContact O-N 3Å; E29-K32 IonicContact OE1-NZ 3.4Å; E29-K32 PolarHBondContact OE1-NZ 2.99Å; E29-K32 WeakPolarHBondContact OE2-CD 3.46Å; E29-K32 IonicContact OE2-NZ 3.37Å; E29-K32 PolarHBondContact OE2-NZ 3.16Å; K32-E35 PolarHBondContact O-N 2.78Å; K32-Q36 VanDerWaalsContact O-CB 3.28Å; K32-Q36 WeakPolarHBondContact O-CB 3.36Å; K32-Q36 PolarHBondContact O-N 3.17Å
33	C	95.5	Very high	95.4	Very high	77 Å²	77	65 Å²	65	52%	0.52	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-47.6	177.7	-170.1	0	0	0	0	111.5	E29 Q30 F31 Q36 Q37	E29-C33 WeakPolarHBondContact O-CB 3.04Å; E29-C33 PolarHBondContact O-N 2.72Å; Q30-C33 WeakPolarHBondContact O-CB 3.31Å; Q30-C33 PolarHBondContact O-N 3.19Å; F31-C33 VanDerWaalsContact C-N 3.27Å; F31-C33 PolarHBondContact O-N 3.04Å; C33-Q36 PolarHBondContact O-N 3.47Å; C33-Q37 VanDerWaalsContact O-CB 3.28Å; C33-Q37 WeakPolarHBondContact O-CB 3.3Å; C33-Q37 PolarHBondContact O-N 2.9Å
34	L	94.1	Very high	95.6	Very high	16 Å²	16	67.5 Å²	67.5	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-66.7	-36.7	177.7	-63.5	172.7	0	0	0	112.6	Q30 F31 Q37 S38 F139 M265 I266	Q30-L34 WeakPolarHBondContact O-CG 3.46Å; Q30-L34 PolarHBondContact O-N 3.18Å; Q30-L34 VanDerWaalsContact O-N 3.16Å; F31-L34 HydrophobicContact CD1-CD1 4.43Å; F31-L34 PolarHBondContact O-N 3.12Å; L34-Q37 PolarHBondContact O-N 2.63Å; L34-S38 WeakPolarHBondContact O-CB 3.35Å; L34-S38 PolarHBondContact O-N 3.07Å; L34-F139 HydrophobicContact CB-CE2 4.1Å; L34-M265 HydrophobicContact CD1-CE 3.9Å; L34-M265 HydrophobicContact CD1-SD 4.3Å; L34-I266 HydrophobicContact CD2-CG1 3.78Å
35	E	95.1	Very high	95.9	Very high	64 Å²	64	62.9 Å²	62.9	30%	0.299	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-51.2	175	-169.3	132.1	-114	0	0	110.9	F31 K32 Q37 S38 E39 F139 K143	F31-E35 VanDerWaalsContact O-CB 3.32Å; F31-E35 WeakPolarHBondContact O-CB 3.25Å; F31-E35 PolarHBondContact O-N 3.11Å; K32-E35 PolarHBondContact O-N 2.78Å; E35-Q37 VanDerWaalsContact C-N 3.3Å; E35-Q37 PolarHBondContact O-N 3.05Å; E35-S38 WeakPolarHBondContact O-CB 3.36Å; E35-S38 PolarHBondContact O-N 3.4Å; E35-S38 VanDerWaalsContact O-N 3.09Å; E35-E39 WeakPolarHBondContact O-CG 3.25Å; E35-E39 PolarHBondContact O-N 2.89Å; E35-F139 VanDerWaalsContact CA-CZ 3.47Å; E35-F139 HydrophobicContact CB-CE1 4.45Å; E35-F139 HydrophobicContact CB-CZ 3.76Å; E35-F139 HydrophobicContact CG-CE1 4.25Å; E35-F139 HydrophobicContact CG-CZ 4.03Å; E35-F139 WeakPolarHBondContact OE1-CE1 3.36Å; E35-K143 IonicContact OE1-NZ 3.53Å; E35-K143 PolarHBondContact OE1-NZ 3.44Å; E35-K143 IonicContact OE2-NZ 3.44Å; E35-K143 PolarHBondContact OE2-NZ 2.94Å
36	Q	96.6	Very high	96	Very high	123 Å²	123	63.1 Å²	63.1	58%	0.575	32%	0.316	S	S	*	.	H	α-helix	trans	-60.6	-36.7	175.4	-173.7	180	6.1	0	0	112.5	K32 C33 S40	K32-Q36 VanDerWaalsContact O-CB 3.28Å; K32-Q36 WeakPolarHBondContact O-CB 3.36Å; K32-Q36 PolarHBondContact O-N 3.17Å; C33-Q36 PolarHBondContact O-N 3.47Å; Q36-S40 VanDerWaalsContact O-CB 3.28Å; Q36-S40 WeakPolarHBondContact O-CB 3.28Å; Q36-S40 PolarHBondContact O-N 3.4Å; Q36-S40 PolarHBondContact O-OG 2.85Å
37	Q	94.2	Very high	96.2	Very high	60 Å²	60	62.6 Å²	62.6	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-38.5	174.9	-177.5	-179.3	-4.2	0	0	111.9	C33 L34 E35 R41	C33-Q37 VanDerWaalsContact O-CB 3.28Å; C33-Q37 WeakPolarHBondContact O-CB 3.3Å; C33-Q37 PolarHBondContact O-N 2.9Å; L34-Q37 PolarHBondContact O-N 2.63Å; E35-Q37 VanDerWaalsContact C-N 3.3Å; E35-Q37 PolarHBondContact O-N 3.05Å; Q37-R41 WeakPolarHBondContact O-CG 3.42Å; Q37-R41 PolarHBondContact O-N 3.4Å
38	S	94.9	Very high	96.4	Very high	8 Å²	8	63.6 Å²	63.6	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-66.3	-50	174.2	-168.5	0	0	0	0	111.3	L34 E35 S40 R41 I42 F139	L34-S38 WeakPolarHBondContact O-CB 3.35Å; L34-S38 PolarHBondContact O-N 3.07Å; E35-S38 WeakPolarHBondContact O-CB 3.36Å; E35-S38 PolarHBondContact O-N 3.4Å; E35-S38 VanDerWaalsContact O-N 3.09Å; S38-S40 VanDerWaalsContact C-N 3.34Å; S38-S40 PolarHBondContact O-N 2.99Å; S38-R41 PolarHBondContact O-N 2.87Å; S38-R41 VanDerWaalsContact O-N 3.16Å; S38-I42 WeakPolarHBondContact O-CD1 3.37Å; S38-I42 WeakPolarHBondContact O-CG1 3.2Å; S38-I42 PolarHBondContact O-N 3.08Å; S38-F139 WeakPolarHBondContact OG-CB 3.44Å; S38-F139 WeakPolarHBondContact OG-CG 3.11Å
39	E	96.8	Very high	96.5	Very high	121 Å²	121	61.2 Å²	61.2	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-56.7	-45.2	175.8	-70.4	175.4	162.6	0	0	111.9	E35 R41 I42 Q43	E35-E39 WeakPolarHBondContact O-CG 3.25Å; E35-E39 PolarHBondContact O-N 2.89Å; E39-R41 VanDerWaalsContact C-N 3.3Å; E39-R41 PolarHBondContact O-N 3.22Å; E39-I42 PolarHBondContact O-N 3.34Å; E39-Q43 PolarHBondContact O-N 3.32Å
40	S	97	Very high	96.6	Very high	70 Å²	70	61.3 Å²	61.3	49%	0.49	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-34.4	178.7	-58.6	0	0	0	0	112.9	Q36 S38 L44	Q36-S40 VanDerWaalsContact O-CB 3.28Å; Q36-S40 WeakPolarHBondContact O-CB 3.28Å; Q36-S40 PolarHBondContact O-N 3.4Å; Q36-S40 PolarHBondContact O-OG 2.85Å; S38-S40 VanDerWaalsContact C-N 3.34Å; S38-S40 PolarHBondContact O-N 2.99Å; S40-L44 PolarHBondContact O-N 3.02Å; S40-L44 VanDerWaalsContact O-N 3.13Å
41	R	96.4	Very high	96.9	Very high	31 Å²	31	64.8 Å²	64.8	12%	0.117	32%	0.321	C	S	.	.	H	α-helix	trans	-72.8	-40.5	174.1	-74.1	172.2	175.3	152.9	-6.3	112	Q37 S38 E39 Q43 L44 L45 D270 Y273	Q37-R41 WeakPolarHBondContact O-CG 3.42Å; Q37-R41 PolarHBondContact O-N 3.4Å; S38-R41 PolarHBondContact O-N 2.87Å; S38-R41 VanDerWaalsContact O-N 3.16Å; E39-R41 VanDerWaalsContact C-N 3.3Å; E39-R41 PolarHBondContact O-N 3.22Å; R41-Q43 VanDerWaalsContact C-N 3.31Å; R41-Q43 PolarHBondContact O-N 3.45Å; R41-L44 PolarHBondContact O-N 2.73Å; R41-L45 VanDerWaalsContact O-CG 3.26Å; R41-L45 WeakPolarHBondContact O-CG 3.29Å; R41-L45 PolarHBondContact O-N 2.71Å; R41-D270 IonicContact CZ-OD1 2.7Å; R41-D270 VanDerWaalsContact CZ-OD1 3.25Å; R41-D270 IonicContact CZ-OD2 2.84Å; R41-D270 IonicContact NH1-OD1 3.85Å; R41-D270 PolarHBondContact NH1-OD1 2.88Å; R41-D270 IonicContact NH1-OD2 2.66Å; R41-D270 IonicContact NH2-OD1 2.61Å; R41-D270 PolarHBondContact NH2-OD1 2.83Å; R41-D270 IonicContact NH2-OD2 3.78Å; R41-D270 PolarHBondContact NH2-OD2 3.44Å; R41-Y273 HydrophobicContact CB-CE2 4.37Å; R41-Y273 HydrophobicContact CG-CE1 4.15Å; R41-Y273 HydrophobicContact CG-CE2 4.44Å
42	I	97.8	Very high	97.1	Very high	30 Å²	30	64 Å²	64	15%	0.154	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-41.8	176.4	-66.7	159.6	0	0	0	109.9	S38 E39 L45 Q46 V135 I136	S38-I42 WeakPolarHBondContact O-CD1 3.37Å; S38-I42 WeakPolarHBondContact O-CG1 3.2Å; S38-I42 PolarHBondContact O-N 3.08Å; E39-I42 PolarHBondContact O-N 3.34Å; I42-L45 PolarHBondContact O-N 3.3Å; I42-Q46 WeakPolarHBondContact O-CG 3.43Å; I42-Q46 PolarHBondContact O-N 3.45Å; I42-V135 HydrophobicContact CD1-CG1 4.31Å; I42-V135 HydrophobicContact CG1-CG1 3.97Å; I42-I136 HydrophobicContact CD1-CD1 4.25Å; I42-I136 HydrophobicContact CD1-CG1 3.49Å; I42-I136 VanDerWaalsContact CD1-CG1 3.49Å; I42-I136 HydrophobicContact CG1-CG1 4.13Å
43	Q	98.3	Very high	97.3	Very high	97 Å²	97	63.4 Å²	63.4	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-50.8	173.5	-172.2	62.5	60.8	0	0	111.6	E39 R41 L45 Q46 D47	E39-Q43 PolarHBondContact O-N 3.32Å; R41-Q43 VanDerWaalsContact C-N 3.31Å; R41-Q43 PolarHBondContact O-N 3.45Å; Q43-L45 VanDerWaalsContact C-N 3.26Å; Q43-L45 PolarHBondContact O-N 2.91Å; Q43-Q46 WeakPolarHBondContact O-CA 3.43Å; Q43-Q46 WeakPolarHBondContact O-CB 3.37Å; Q43-Q46 PolarHBondContact O-N 2.96Å; Q43-D47 PolarHBondContact NE2-OD1 2.78Å; Q43-D47 PolarHBondContact O-N 3.12Å
44	L	98.3	Very high	97.4	Very high	80 Å²	80	65.4 Å²	65.4	42%	0.419	31%	0.309	S	S	.	.	H	α-helix	trans	-56.7	-38.8	177.2	176.3	62	0	0	0	112.5	S40 R41 L48	S40-L44 PolarHBondContact O-N 3.02Å; S40-L44 VanDerWaalsContact O-N 3.13Å; R41-L44 PolarHBondContact O-N 2.73Å; L44-L48 HydrophobicContact CD1-CD1 4.29Å; L44-L48 HydrophobicContact CD1-CG 4.34Å; L44-L48 HydrophobicContact CG-CD1 4.19Å; L44-L48 WeakPolarHBondContact O-CB 3.46Å; L44-L48 VanDerWaalsContact O-CG 3.23Å; L44-L48 WeakPolarHBondContact O-CG 3.11Å; L44-L48 PolarHBondContact O-N 3.05Å
45	L	98.6	Very high	97.7	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-70.3	-30.6	176.2	-68.3	166.2	0	0	0	112.7	R41 I42 Q43 Q49 L128 I131 S132 V135 Y273 L277	R41-L45 VanDerWaalsContact O-CG 3.26Å; R41-L45 WeakPolarHBondContact O-CG 3.29Å; R41-L45 PolarHBondContact O-N 2.71Å; I42-L45 PolarHBondContact O-N 3.3Å; Q43-L45 VanDerWaalsContact C-N 3.26Å; Q43-L45 PolarHBondContact O-N 2.91Å; L45-Q49 VanDerWaalsContact O-CG 3.25Å; L45-Q49 WeakPolarHBondContact O-CG 3.43Å; L45-Q49 PolarHBondContact O-N 3.06Å; L45-Q49 VanDerWaalsContact O-N 3.15Å; L45-Q49 PolarHBondContact O-NE2 3.47Å; L45-L128 HydrophobicContact CD2-CD2 3.82Å; L45-I131 HydrophobicContact CD1-CB 4.38Å; L45-I131 HydrophobicContact CD1-CG2 3.77Å; L45-I131 HydrophobicContact CD2-CB 4.28Å; L45-I131 HydrophobicContact CD2-CG2 3.89Å; L45-S132 VanDerWaalsContact CB-OG 3.28Å; L45-S132 WeakPolarHBondContact CB-OG 3.24Å; L45-V135 HydrophobicContact CD1-CG2 4.37Å; L45-Y273 HydrophobicContact CD1-CE2 4.04Å; L45-Y273 HydrophobicContact CD2-CE2 4.25Å; L45-Y273 HydrophobicContact CG-CE2 4.29Å; L45-L277 HydrophobicContact CD2-CD1 4.24Å
46	Q	98.5	Very high	97.8	Very high	97 Å²	97	63.5 Å²	63.5	45%	0.453	30%	0.299	S	S	.	.	H	α-helix	trans	-70.8	-45.7	171.9	-70.8	172.9	16.4	0	0	111.1	I42 Q43 L48 Q49 E50	I42-Q46 WeakPolarHBondContact O-CG 3.43Å; I42-Q46 PolarHBondContact O-N 3.45Å; Q43-Q46 WeakPolarHBondContact O-CA 3.43Å; Q43-Q46 WeakPolarHBondContact O-CB 3.37Å; Q43-Q46 PolarHBondContact O-N 2.96Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.31Å; Q46-Q49 WeakPolarHBondContact O-CB 3.29Å; Q46-Q49 PolarHBondContact O-N 3.3Å; Q46-E50 PolarHBondContact O-N 3.11Å
47	D	98.7	Very high	97.9	Very high	83 Å²	83	62 Å²	62	44%	0.444	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-41.5	177.5	-59.7	-17.3	0	0	0	111.1	Q43 E50 F51	Q43-D47 PolarHBondContact NE2-OD1 2.78Å; Q43-D47 PolarHBondContact O-N 3.12Å; D47-E50 PolarHBondContact O-N 2.85Å; D47-F51 WeakPolarHBondContact O-CB 3.39Å; D47-F51 PolarHBondContact O-N 2.86Å
48	L	98.8	Very high	98.1	Very high	26 Å²	26	63 Å²	63	14%	0.136	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-37.6	173.8	-72.8	170.1	0	0	0	112.7	L44 Q46 F52 L128 L277 F281	L44-L48 HydrophobicContact CD1-CD1 4.29Å; L44-L48 HydrophobicContact CD1-CG 4.34Å; L44-L48 HydrophobicContact CG-CD1 4.19Å; L44-L48 WeakPolarHBondContact O-CB 3.46Å; L44-L48 VanDerWaalsContact O-CG 3.23Å; L44-L48 WeakPolarHBondContact O-CG 3.11Å; L44-L48 PolarHBondContact O-N 3.05Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.31Å; L48-F52 VanDerWaalsContact O-CD2 3.26Å; L48-F52 WeakPolarHBondContact O-CD2 3.39Å; L48-F52 PolarHBondContact O-N 3.46Å; L48-L128 HydrophobicContact CB-CD1 3.75Å; L48-L128 HydrophobicContact CB-CD2 4.28Å; L48-L128 HydrophobicContact CD1-CD2 4.23Å; L48-L277 HydrophobicContact CD1-CD1 4.08Å; L48-F281 HydrophobicContact CD1-CE2 4.47Å; L48-F281 HydrophobicContact CD1-CZ 4.05Å; L48-F281 HydrophobicContact CD2-CE1 4.35Å; L48-F281 HydrophobicContact CD2-CZ 3.87Å
49	Q	98.6	Very high	98.3	Very high	29 Å²	29	63.6 Å²	63.6	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-40.4	174.9	-77.4	168	77.7	0	0	111.8	L45 Q46 R53 I125 L128 S132	L45-Q49 VanDerWaalsContact O-CG 3.25Å; L45-Q49 WeakPolarHBondContact O-CG 3.43Å; L45-Q49 PolarHBondContact O-N 3.06Å; L45-Q49 VanDerWaalsContact O-N 3.15Å; L45-Q49 PolarHBondContact O-NE2 3.47Å; Q46-Q49 WeakPolarHBondContact O-CB 3.29Å; Q46-Q49 PolarHBondContact O-N 3.3Å; Q49-R53 WeakPolarHBondContact O-CB 3.21Å; Q49-R53 PolarHBondContact O-N 3.34Å; Q49-I125 HydrophobicContact CB-CG2 4.41Å; Q49-I125 HydrophobicContact CG-CG2 4.17Å; Q49-L128 HydrophobicContact CG-CB 3.49Å; Q49-L128 VanDerWaalsContact CG-CB 3.49Å; Q49-L128 HydrophobicContact CG-CD1 4.01Å; Q49-L128 HydrophobicContact CG-CG 4.41Å; Q49-S132 PolarHBondContact NE2-OG 3.17Å
50	E	98.7	Very high	98.4	Very high	102 Å²	102	60.2 Å²	60.2	48%	0.477	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-47.3	175.3	-164.2	61.3	-115.3	0	0	111.2	Q46 D47 F52 R53 R54	Q46-E50 PolarHBondContact O-N 3.11Å; D47-E50 PolarHBondContact O-N 2.85Å; E50-F52 PolarHBondContact O-N 2.69Å; E50-R53 PolarHBondContact O-N 2.75Å; E50-R53 IonicContact OE1-CZ 2.76Å; E50-R53 IonicContact OE1-NH1 2.87Å; E50-R53 PolarHBondContact OE1-NH1 2.88Å; E50-R53 IonicContact OE2-CZ 2.92Å; E50-R53 IonicContact OE2-NH1 2.67Å; E50-R53 PolarHBondContact OE2-NH1 3.24Å; E50-R53 IonicContact OE2-NH2 2.83Å; E50-R54 PolarHBondContact O-N 3.27Å
51	F	98.8	Very high	98.5	Very high	116 Å²	116	62 Å²	62	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-56	-50.2	176	175.1	-94.4	0	0	0	112	D47 R53 R54 K55	D47-F51 WeakPolarHBondContact O-CB 3.39Å; D47-F51 PolarHBondContact O-N 2.86Å; F51-R53 PolarHBondContact O-N 3.02Å; F51-R54 PolarHBondContact O-N 2.94Å; F51-K55 HydrophobicContact CE1-CD 4.43Å; F51-K55 PolarHBondContact O-N 3.18Å
52	F	98.8	Very high	98.6	Very high	6 Å²	6	65.6 Å²	65.6	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-70.2	-30	-180	-81.4	-63.2	0	0	0	113.3	L48 E50 A56 Y120 V124 I125 L128 F281 Y284	L48-F52 VanDerWaalsContact O-CD2 3.26Å; L48-F52 WeakPolarHBondContact O-CD2 3.39Å; L48-F52 PolarHBondContact O-N 3.46Å; E50-F52 PolarHBondContact O-N 2.69Å; F52-A56 WeakPolarHBondContact O-CB 3.44Å; F52-A56 PolarHBondContact O-N 3.47Å; F52-Y120 HydrophobicContact CD1-CD1 4.22Å; F52-Y120 HydrophobicContact CD1-CD2 4.42Å; F52-Y120 HydrophobicContact CD1-CG 4.16Å; F52-Y120 HydrophobicContact CE1-CE1 4.48Å; F52-V124 HydrophobicContact CB-CG1 4.31Å; F52-V124 HydrophobicContact CD1-CG1 4.06Å; F52-V124 HydrophobicContact CD2-CG1 3.49Å; F52-V124 VanDerWaalsContact CD2-CG1 3.49Å; F52-V124 HydrophobicContact CE1-CG1 4.3Å; F52-V124 HydrophobicContact CE2-CG1 3.75Å; F52-V124 HydrophobicContact CG-CG1 3.67Å; F52-V124 HydrophobicContact CZ-CG1 4.15Å; F52-I125 HydrophobicContact CB-CD1 4.34Å; F52-I125 HydrophobicContact CB-CG1 3.84Å; F52-L128 HydrophobicContact CD2-CD1 3.97Å; F52-F281 HydrophobicContact CE2-CE1 4.34Å; F52-F281 HydrophobicContact CZ-CE1 4.5Å; F52-Y284 AromaticContact CE1-CD2 3.4Å; F52-Y284 HydrophobicContact CE1-CD2 3.4Å; F52-Y284 VanDerWaalsContact CE1-CD2 3.4Å; F52-Y284 AromaticContact CE1-CE2 3.81Å; F52-Y284 HydrophobicContact CE1-CE2 3.81Å; F52-Y284 HydrophobicContact CE1-CG 4.05Å; F52-Y284 AromaticContact CZ-CD2 3.83Å; F52-Y284 HydrophobicContact CZ-CD2 3.83Å; F52-Y284 HydrophobicContact CZ-CE2 4.32Å; F52-Y284 HydrophobicContact CZ-CG 4Å
53	R	98.7	Very high	98.6	Very high	96 Å²	96	64.6 Å²	64.6	36%	0.362	30%	0.297	S	S	.	.	H	α-helix	trans	-64.2	-48.1	171.5	-161	-176.8	-49.5	116.6	6.9	110.7	Q49 E50 F51 A56 E57 I125	Q49-R53 WeakPolarHBondContact O-CB 3.21Å; Q49-R53 PolarHBondContact O-N 3.34Å; E50-R53 PolarHBondContact O-N 2.75Å; E50-R53 IonicContact OE1-CZ 2.76Å; E50-R53 IonicContact OE1-NH1 2.87Å; E50-R53 PolarHBondContact OE1-NH1 2.88Å; E50-R53 IonicContact OE2-CZ 2.92Å; E50-R53 IonicContact OE2-NH1 2.67Å; E50-R53 PolarHBondContact OE2-NH1 3.24Å; E50-R53 IonicContact OE2-NH2 2.83Å; F51-R53 PolarHBondContact O-N 3.02Å; R53-A56 WeakPolarHBondContact O-CB 3.3Å; R53-A56 PolarHBondContact O-N 3.07Å; R53-E57 WeakPolarHBondContact O-CG 3.34Å; R53-E57 PolarHBondContact O-N 2.91Å; R53-I125 HydrophobicContact CB-CD1 3.81Å; R53-I125 HydrophobicContact CG-CD1 4.27Å
54	R	98.8	Very high	98.6	Very high	118 Å²	118	66 Å²	66	45%	0.445	30%	0.298	S	S	.	.	H	α-helix	trans	-69.4	-33.2	179.4	-172.3	61.1	-163	145.5	10.7	112.7	E50 F51 E57 I58	E50-R54 PolarHBondContact O-N 3.27Å; F51-R54 PolarHBondContact O-N 2.94Å; R54-E57 VanDerWaalsContact CD-OE2 3.3Å; R54-E57 WeakPolarHBondContact CD-OE2 3.44Å; R54-E57 IonicContact CZ-OE2 2.74Å; R54-E57 IonicContact NE-OE2 3.87Å; R54-E57 IonicContact NH1-OE2 3.4Å; R54-E57 PolarHBondContact NH1-OE2 3Å; R54-I58 HydrophobicContact CG-CD1 4.21Å; R54-I58 WeakPolarHBondContact O-CD1 3.39Å; R54-I58 VanDerWaalsContact O-CG1 3.27Å; R54-I58 WeakPolarHBondContact O-CG1 3.36Å; R54-I58 PolarHBondContact O-N 3.45Å
55	K	98.5	Very high	98.7	Very high	38 Å²	38	65.1 Å²	65.1	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-48.2	170.2	-160.7	179.9	-170.3	-72.6	0	110.3	F51 E57 I58 E59 Y120 Y284 E288	F51-K55 HydrophobicContact CE1-CD 4.43Å; F51-K55 PolarHBondContact O-N 3.18Å; K55-E57 VanDerWaalsContact C-N 3.34Å; K55-E57 PolarHBondContact O-N 3.42Å; K55-I58 WeakPolarHBondContact O-CA 3.38Å; K55-I58 WeakPolarHBondContact O-CB 3.48Å; K55-I58 PolarHBondContact O-N 2.97Å; K55-E59 HydrophobicContact CG-CG 4.43Å; K55-E59 IonicContact NZ-OE1 2.63Å; K55-E59 PolarHBondContact NZ-OE1 2.65Å; K55-E59 WeakPolarHBondContact O-CG 3.32Å; K55-E59 PolarHBondContact O-N 3.33Å; K55-Y120 HydrophobicContact CB-CD2 4.26Å; K55-Y120 HydrophobicContact CB-CE2 4.15Å; K55-Y120 HydrophobicContact CD-CD2 4.41Å; K55-Y120 HydrophobicContact CD-CE2 3.55Å; K55-Y120 HydrophobicContact CG-CD2 4.32Å; K55-Y120 HydrophobicContact CG-CE2 3.72Å; K55-Y120 PolarHBondContact NZ-OH 2.87Å; K55-Y284 HydrophobicContact CD-CE2 4.49Å; K55-E288 WeakPolarHBondContact CE-OE1 3.16Å; K55-E288 IonicContact NZ-OE1 3.28Å; K55-E288 PolarHBondContact NZ-OE1 3.03Å
56	A	98.6	Very high	98.6	Very high	3 Å²	3	65.8 Å²	65.8	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-56.4	-44.6	177.8	0	0	0	0	0	112.9	F52 R53 I58 E59 L60 S117 Y120	F52-A56 WeakPolarHBondContact O-CB 3.44Å; F52-A56 PolarHBondContact O-N 3.47Å; R53-A56 WeakPolarHBondContact O-CB 3.3Å; R53-A56 PolarHBondContact O-N 3.07Å; A56-I58 VanDerWaalsContact C-N 3.29Å; A56-I58 PolarHBondContact O-N 3.46Å; A56-E59 PolarHBondContact O-N 3.36Å; A56-L60 VanDerWaalsContact O-CB 3.32Å; A56-L60 WeakPolarHBondContact O-CB 3.4Å; A56-L60 PolarHBondContact O-N 3.41Å; A56-S117 WeakPolarHBondContact O-CB 3.31Å; A56-S117 PolarHBondContact O-OG 3.32Å; A56-Y120 HydrophobicContact CB-CD2 4.18Å
57	E	98.6	Very high	98.6	Very high	91 Å²	91	64.5 Å²	64.5	43%	0.425	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-39.8	174	-72.1	174.1	-177.1	0	0	112.9	R53 R54 K55 E61	R53-E57 WeakPolarHBondContact O-CG 3.34Å; R53-E57 PolarHBondContact O-N 2.91Å; R54-E57 VanDerWaalsContact CD-OE2 3.3Å; R54-E57 WeakPolarHBondContact CD-OE2 3.44Å; R54-E57 IonicContact CZ-OE2 2.74Å; R54-E57 IonicContact NE-OE2 3.87Å; R54-E57 IonicContact NH1-OE2 3.4Å; R54-E57 PolarHBondContact NH1-OE2 3Å; K55-E57 VanDerWaalsContact C-N 3.34Å; K55-E57 PolarHBondContact O-N 3.42Å; E57-E61 WeakPolarHBondContact O-CB 3.22Å; E57-E61 PolarHBondContact O-N 3.5Å
58	I	98.8	Very high	98.5	Very high	80 Å²	80	67.4 Å²	67.4	41%	0.41	30%	0.304	S	S	.	.	H	α-helix	trans	-71	-46.3	178.5	-68.3	165	0	0	0	111	R54 K55 A56 L60 E61 Y62	R54-I58 HydrophobicContact CG-CD1 4.21Å; R54-I58 WeakPolarHBondContact O-CD1 3.39Å; R54-I58 VanDerWaalsContact O-CG1 3.27Å; R54-I58 WeakPolarHBondContact O-CG1 3.36Å; R54-I58 PolarHBondContact O-N 3.45Å; K55-I58 WeakPolarHBondContact O-CA 3.38Å; K55-I58 WeakPolarHBondContact O-CB 3.48Å; K55-I58 PolarHBondContact O-N 2.97Å; A56-I58 VanDerWaalsContact C-N 3.29Å; A56-I58 PolarHBondContact O-N 3.46Å; I58-L60 VanDerWaalsContact C-N 3.27Å; I58-L60 PolarHBondContact O-N 2.96Å; I58-E61 PolarHBondContact O-N 2.85Å; I58-Y62 WeakPolarHBondContact O-CB 3.19Å; I58-Y62 PolarHBondContact O-N 3.39Å
59	E	98.5	Very high	98.4	Very high	21 Å²	21	70.1 Å²	70.1	10%	0.098	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-42.4	175.6	-58.4	-49.9	154.6	0	0	111	K55 A56 Y62 S63 H113 L116 Y120	K55-E59 HydrophobicContact CG-CG 4.43Å; K55-E59 IonicContact NZ-OE1 2.63Å; K55-E59 PolarHBondContact NZ-OE1 2.65Å; K55-E59 WeakPolarHBondContact O-CG 3.32Å; K55-E59 PolarHBondContact O-N 3.33Å; A56-E59 PolarHBondContact O-N 3.36Å; E59-Y62 PolarHBondContact O-N 2.98Å; E59-S63 VanDerWaalsContact O-CB 3.26Å; E59-S63 WeakPolarHBondContact O-CB 3.43Å; E59-S63 PolarHBondContact O-N 3.14Å; E59-H113 IonicContact OE2-CE1 3.99Å; E59-H113 PolarHBondContact OE2-CE1 2.91Å; E59-H113 IonicContact OE2-CG 3.79Å; E59-H113 IonicContact OE2-ND1 3.77Å; E59-H113 PolarHBondContact OE2-ND1 3.47Å; E59-L116 HydrophobicContact CG-CD2 4.16Å; E59-L116 HydrophobicContact CG-CG 4.31Å; E59-Y120 HydrophobicContact CG-CD2 4.39Å; E59-Y120 HydrophobicContact CG-CE2 3.85Å
60	L	98.6	Very high	98.3	Very high	51 Å²	51	68.7 Å²	68.7	27%	0.267	31%	0.312	S	S	.	.	H	α-helix	trans	-73.7	-29.8	-179.4	-168	60.5	0	0	0	113	A56 I58 R64 A114	A56-L60 VanDerWaalsContact O-CB 3.32Å; A56-L60 WeakPolarHBondContact O-CB 3.4Å; A56-L60 PolarHBondContact O-N 3.41Å; I58-L60 VanDerWaalsContact C-N 3.27Å; I58-L60 PolarHBondContact O-N 2.96Å; L60-R64 VanDerWaalsContact CD2-NH2 3.25Å; L60-R64 WeakPolarHBondContact O-CB 3.35Å; L60-R64 VanDerWaalsContact O-CG 3.25Å; L60-R64 WeakPolarHBondContact O-CG 3.2Å; L60-R64 PolarHBondContact O-N 3.33Å; L60-R64 VanDerWaalsContact O-N 3.1Å; L60-R64 PolarHBondContact O-NE 2.93Å; L60-A114 HydrophobicContact CD1-CB 4.31Å
61	E	98.7	Very high	97.9	Very high	108 Å²	108	67.1 Å²	67.1	51%	0.505	31%	0.305	S	S	.	.	H	α-helix	trans	-72.3	-37.9	171.1	-179.1	158	-132	0	0	111.9	E57 I58 S65	E57-E61 WeakPolarHBondContact O-CB 3.22Å; E57-E61 PolarHBondContact O-N 3.5Å; I58-E61 PolarHBondContact O-N 2.85Å; E61-S65 WeakPolarHBondContact O-CB 3.2Å; E61-S65 PolarHBondContact O-N 3.29Å; E61-S65 VanDerWaalsContact O-N 3.13Å; E61-S65 PolarHBondContact O-OG 3.13Å
62	Y	98.8	Very high	97.6	Very high	106 Å²	106	69.7 Å²	69.7	42%	0.416	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-50.3	173.9	-176.4	-124.4	0	0	0	111.5	I58 E59 R64 S65 L66 H113	I58-Y62 WeakPolarHBondContact O-CB 3.19Å; I58-Y62 PolarHBondContact O-N 3.39Å; E59-Y62 PolarHBondContact O-N 2.98Å; Y62-R64 PolarHBondContact O-N 3.46Å; Y62-S65 CarbonylContact O-C 3.58Å; Y62-S65 WeakPolarHBondContact O-CA 3.29Å; Y62-S65 WeakPolarHBondContact O-CB 3.25Å; Y62-S65 PolarHBondContact O-N 3.08Å; Y62-L66 HydrophobicContact CD1-CD1 4.11Å; Y62-L66 HydrophobicContact CD2-CG 4.46Å; Y62-L66 HydrophobicContact CE1-CD1 3.69Å; Y62-L66 HydrophobicContact CE1-CG 4.29Å; Y62-L66 HydrophobicContact CE2-CD1 4.42Å; Y62-L66 HydrophobicContact CE2-CD2 4.04Å; Y62-L66 HydrophobicContact CE2-CG 4.16Å; Y62-L66 PolarHBondContact O-N 3.32Å; Y62-H113 HydrophobicContact CD1-CB 4.49Å; Y62-H113 AromaticContact CD1-CD2 3.83Å; Y62-H113 AromaticContact CD1-CE1 3.82Å; Y62-H113 AromaticContact CD1-CG 3.82Å; Y62-H113 AromaticContact CD1-ND1 3.8Å; Y62-H113 AromaticContact CD1-NE2 3.84Å; Y62-H113 AromaticContact CE1-CD2 3.78Å; Y62-H113 AromaticContact CE1-CE1 3.84Å; Y62-H113 AromaticContact CE1-NE2 3.51Å
63	S	98.7	Very high	97.1	Very high	9 Å²	9	72.5 Å²	72.5	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-47.7	-56.2	170.4	163.9	0	0	0	0	112.3	E59 S65 L66 E67 S110	E59-S63 VanDerWaalsContact O-CB 3.26Å; E59-S63 WeakPolarHBondContact O-CB 3.43Å; E59-S63 PolarHBondContact O-N 3.14Å; S63-S65 PolarHBondContact O-N 3.5Å; S63-L66 PolarHBondContact O-N 3.26Å; S63-L66 VanDerWaalsContact O-N 3.16Å; S63-E67 PolarHBondContact O-N 3.2Å; S63-S110 WeakPolarHBondContact CB-O 3.42Å; S63-S110 PolarHBondContact O-OG 3Å; S63-S110 PolarHBondContact OG-O 3.14Å
64	R	98.6	Very high	96.3	Very high	127 Å²	127	68.2 Å²	68.2	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-19.8	177.2	-76.3	-175.6	-119.6	138.9	-7.7	113.8	L60 Y62 K68	L60-R64 VanDerWaalsContact CD2-NH2 3.25Å; L60-R64 WeakPolarHBondContact O-CB 3.35Å; L60-R64 VanDerWaalsContact O-CG 3.25Å; L60-R64 WeakPolarHBondContact O-CG 3.2Å; L60-R64 PolarHBondContact O-N 3.33Å; L60-R64 VanDerWaalsContact O-N 3.1Å; L60-R64 PolarHBondContact O-NE 2.93Å; Y62-R64 PolarHBondContact O-N 3.46Å; R64-K68 WeakPolarHBondContact O-CD 3.4Å; R64-K68 WeakPolarHBondContact O-CE 3.4Å; R64-K68 WeakPolarHBondContact O-CG 3.33Å
65	S	98.6	Very high	95	Very high	61 Å²	61	65 Å²	65	43%	0.427	30%	0.304	S	S	.	.	H	α-helix	trans	-88.3	-38.9	177.9	-59.5	0	0	0	0	111.8	E61 Y62 S63 K68 L69	E61-S65 WeakPolarHBondContact O-CB 3.2Å; E61-S65 PolarHBondContact O-N 3.29Å; E61-S65 VanDerWaalsContact O-N 3.13Å; E61-S65 PolarHBondContact O-OG 3.13Å; Y62-S65 CarbonylContact O-C 3.58Å; Y62-S65 WeakPolarHBondContact O-CA 3.29Å; Y62-S65 WeakPolarHBondContact O-CB 3.25Å; Y62-S65 PolarHBondContact O-N 3.08Å; S63-S65 PolarHBondContact O-N 3.5Å; S65-K68 PolarHBondContact O-N 2.96Å; S65-L69 WeakPolarHBondContact O-CB 3.2Å; S65-L69 PolarHBondContact O-N 3.48Å
66	L	98.4	Very high	93.6	Very high	14 Å²	14	68.8 Å²	68.8	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-62	-44	170.2	-66.5	179.6	0	0	0	111.5	Y62 S63 K68 L69 A70 T106 E109	Y62-L66 HydrophobicContact CD1-CD1 4.11Å; Y62-L66 HydrophobicContact CD2-CG 4.46Å; Y62-L66 HydrophobicContact CE1-CD1 3.69Å; Y62-L66 HydrophobicContact CE1-CG 4.29Å; Y62-L66 HydrophobicContact CE2-CD1 4.42Å; Y62-L66 HydrophobicContact CE2-CD2 4.04Å; Y62-L66 HydrophobicContact CE2-CG 4.16Å; Y62-L66 PolarHBondContact O-N 3.32Å; S63-L66 PolarHBondContact O-N 3.26Å; S63-L66 VanDerWaalsContact O-N 3.16Å; L66-K68 PolarHBondContact O-N 3.07Å; L66-L69 WeakPolarHBondContact O-CB 3.41Å; L66-L69 PolarHBondContact O-N 3.49Å; L66-L69 VanDerWaalsContact O-N 3.14Å; L66-A70 PolarHBondContact O-N 3.05Å; L66-T106 HydrophobicContact CB-CG2 4.24Å; L66-T106 HydrophobicContact CD2-CG2 4.24Å; L66-E109 HydrophobicContact CD1-CB 3.77Å
67	E	97.4	Very high	91.9	Very high	69 Å²	69	69.8 Å²	69.8	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-46	178.1	-162.7	55.4	-143.4	0	0	111.7	S63 L69 A70 E71 S110	S63-E67 PolarHBondContact O-N 3.2Å; E67-L69 VanDerWaalsContact C-N 3.28Å; E67-L69 PolarHBondContact O-N 3.16Å; E67-A70 PolarHBondContact O-N 3.07Å; E67-E71 WeakPolarHBondContact O-CB 3.04Å; E67-E71 PolarHBondContact O-N 3.39Å; E67-S110 WeakPolarHBondContact CB-OG 3.32Å; E67-S110 WeakPolarHBondContact OE2-CB 3.23Å; E67-S110 PolarHBondContact OE2-OG 3.25Å
68	K	97.3	Very high	89.8	Confident	144 Å²	144	71.1 Å²	71.1	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-62.4	-34.9	175.6	-72	168.5	-166.6	167.3	0	112.3	R64 S65 L66 R72	R64-K68 WeakPolarHBondContact O-CD 3.4Å; R64-K68 WeakPolarHBondContact O-CE 3.4Å; R64-K68 WeakPolarHBondContact O-CG 3.33Å; S65-K68 PolarHBondContact O-N 2.96Å; L66-K68 PolarHBondContact O-N 3.07Å; K68-R72 WeakPolarHBondContact O-CB 3.35Å; K68-R72 PolarHBondContact O-N 3.47Å
69	L	96.9	Very high	87.4	Confident	83 Å²	83	72.1 Å²	72.1	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-54.5	175.9	177.6	62.6	0	0	0	110.2	S65 L66 E67 E71 R72 F73 T106	S65-L69 WeakPolarHBondContact O-CB 3.2Å; S65-L69 PolarHBondContact O-N 3.48Å; L66-L69 WeakPolarHBondContact O-CB 3.41Å; L66-L69 PolarHBondContact O-N 3.49Å; L66-L69 VanDerWaalsContact O-N 3.14Å; E67-L69 VanDerWaalsContact C-N 3.28Å; E67-L69 PolarHBondContact O-N 3.16Å; L69-E71 PolarHBondContact O-N 3.05Å; L69-R72 PolarHBondContact O-N 3Å; L69-F73 HydrophobicContact CD1-CD2 4.25Å; L69-F73 HydrophobicContact CD1-CE2 3.88Å; L69-F73 WeakPolarHBondContact O-CD2 3.13Å; L69-F73 PolarHBondContact O-N 2.84Å; L69-T106 HydrophobicContact CD2-CG2 4.29Å
70	A	94.9	Very high	85	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-42.2	-179.8	0	0	0	0	0	112.3	L66 E67 F73 S74 T106 R107	L66-A70 PolarHBondContact O-N 3.05Å; E67-A70 PolarHBondContact O-N 3.07Å; A70-F73 PolarHBondContact O-N 3.2Å; A70-S74 WeakPolarHBondContact O-CB 3.37Å; A70-S74 PolarHBondContact O-N 2.95Å; A70-S74 PolarHBondContact O-OG 3.37Å; A70-T106 HydrophobicContact CB-CG2 3.94Å; A70-R107 HydrophobicContact CB-CG 3.41Å; A70-R107 VanDerWaalsContact CB-CG 3.41Å
71	E	91.6	Very high	82.6	Confident	69 Å²	69	80.7 Å²	80.7	32%	0.322	37%	0.374	S	S	.	.	H	α-helix	trans	-69	-35.3	-179.2	-178	60.1	-175.5	0	0	112.5	E67 L69 F73 S74 S75 R78	E67-E71 WeakPolarHBondContact O-CB 3.04Å; E67-E71 PolarHBondContact O-N 3.39Å; L69-E71 PolarHBondContact O-N 3.05Å; E71-F73 PolarHBondContact O-N 3.31Å; E71-S74 PolarHBondContact O-N 2.86Å; E71-S75 VanDerWaalsContact O-CB 3.31Å; E71-S75 WeakPolarHBondContact O-CB 3.38Å; E71-S75 PolarHBondContact O-N 3.39Å; E71-S75 PolarHBondContact O-OG 3.3Å; E71-R78 IonicContact OE1-CZ 2.74Å; E71-R78 IonicContact OE1-NH1 2.69Å; E71-R78 PolarHBondContact OE1-NH1 2.97Å; E71-R78 IonicContact OE1-NH2 3.31Å; E71-R78 IonicContact OE2-CZ 3.59Å; E71-R78 IonicContact OE2-NH1 3.15Å; E71-R78 PolarHBondContact OE2-NH1 3.45Å; E71-R78 IonicContact OE2-NH2 3.59Å; E71-R78 PolarHBondContact OE2-NH2 3.22Å
72	R	92.4	Very high	80.1	Confident	170 Å²	170	81.4 Å²	81.4	64%	0.642	38%	0.378	S	S	*	.	H	α-helix	trans	-62.4	-26.5	174.5	-179.1	-180	-174.8	-154.7	2	113.5	K68 L69 S75	K68-R72 WeakPolarHBondContact O-CB 3.35Å; K68-R72 PolarHBondContact O-N 3.47Å; L69-R72 PolarHBondContact O-N 3Å; R72-S75 PolarHBondContact O-OG 3.47Å
73	F	88.8	Confident	77.6	Confident	64 Å²	64	78 Å²	78	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-92.8	-40.8	172.9	-74.4	-75.1	0	0	0	111.9	L69 A70 E71 S75 K76 I77 W99 L103	L69-F73 HydrophobicContact CD1-CD2 4.25Å; L69-F73 HydrophobicContact CD1-CE2 3.88Å; L69-F73 WeakPolarHBondContact O-CD2 3.13Å; L69-F73 PolarHBondContact O-N 2.84Å; A70-F73 PolarHBondContact O-N 3.2Å; E71-F73 PolarHBondContact O-N 3.31Å; F73-S75 VanDerWaalsContact C-N 3.32Å; F73-S75 PolarHBondContact O-N 3.04Å; F73-K76 HydrophobicContact CD1-CD 4.49Å; F73-K76 WeakPolarHBondContact O-CB 3.45Å; F73-K76 PolarHBondContact O-N 3.47Å; F73-K76 VanDerWaalsContact O-N 3.11Å; F73-I77 PolarHBondContact O-N 2.88Å; F73-W99 HydrophobicContact CB-CH2 4.36Å; F73-W99 HydrophobicContact CB-CZ2 3.88Å; F73-W99 AromaticContact CD1-CH2 4Å; F73-W99 HydrophobicContact CD1-CH2 4Å; F73-W99 AromaticContact CD1-CZ2 3.74Å; F73-W99 HydrophobicContact CD1-CZ2 3.74Å; F73-W99 HydrophobicContact CD2-CH2 4.37Å; F73-W99 HydrophobicContact CE1-CH2 4.38Å; F73-W99 HydrophobicContact CE1-CZ2 4.46Å; F73-W99 AromaticContact CG-CH2 3.99Å; F73-W99 HydrophobicContact CG-CH2 3.99Å; F73-W99 AromaticContact CG-CZ2 3.85Å; F73-W99 HydrophobicContact CG-CZ2 3.85Å; F73-L103 HydrophobicContact CB-CD1 4.14Å; F73-L103 HydrophobicContact CB-CD2 3.76Å; F73-L103 HydrophobicContact CG-CD2 4.46Å
74	S	81.9	Confident	75.1	Confident	6 Å²	6	85.4 Å²	85.4	4%	0.042	40%	0.399	C	S	.	.	H	α-helix	trans	-56.8	-42.8	176.9	-56.2	0	0	0	0	112.6	A70 E71 K76 I77 R78 R107	A70-S74 WeakPolarHBondContact O-CB 3.37Å; A70-S74 PolarHBondContact O-N 2.95Å; A70-S74 PolarHBondContact O-OG 3.37Å; E71-S74 PolarHBondContact O-N 2.86Å; S74-K76 VanDerWaalsContact C-N 3.32Å; S74-K76 PolarHBondContact O-N 3.42Å; S74-I77 PolarHBondContact O-N 3.24Å; S74-R78 WeakPolarHBondContact O-CG 3.5Å; S74-R78 PolarHBondContact O-N 2.84Å; S74-R107 PolarHBondContact OG-NH2 3.33Å
75	S	71.3	Confident	72.8	Confident	51 Å²	51	84 Å²	84	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-31.7	177.4	49.4	0	0	0	0	113.9	E71 R72 F73 R78 S79	E71-S75 VanDerWaalsContact O-CB 3.31Å; E71-S75 WeakPolarHBondContact O-CB 3.38Å; E71-S75 PolarHBondContact O-N 3.39Å; E71-S75 PolarHBondContact O-OG 3.3Å; R72-S75 PolarHBondContact O-OG 3.47Å; F73-S75 VanDerWaalsContact C-N 3.32Å; F73-S75 PolarHBondContact O-N 3.04Å; S75-R78 PolarHBondContact O-N 3.35Å; S75-S79 PolarHBondContact O-N 3.4Å; S75-S79 PolarHBondContact O-OG 3.01Å
76	K	67.9	Low	70.5	Confident	118 Å²	118	82.5 Å²	82.5	51%	0.513	38%	0.384	S	S	.	.	H	α-helix	trans	-70.1	-39.3	174.4	-65.7	177.1	177.7	-177.5	0	112.2	F73 S74 R78 S79	F73-K76 HydrophobicContact CD1-CD 4.49Å; F73-K76 WeakPolarHBondContact O-CB 3.45Å; F73-K76 PolarHBondContact O-N 3.47Å; F73-K76 VanDerWaalsContact O-N 3.11Å; S74-K76 VanDerWaalsContact C-N 3.32Å; S74-K76 PolarHBondContact O-N 3.42Å; K76-R78 VanDerWaalsContact C-N 3.35Å; K76-S79 PolarHBondContact O-N 2.55Å; K76-S79 PolarHBondContact O-OG 3.19Å
77	I	64.4	Low	68	Low	24 Å²	24	89.9 Å²	89.9	12%	0.123	42%	0.415	C	S	.	.	H	α-helix	trans	-64.7	-45.2	175.2	-47.1	173.2	0	0	0	108.4	F73 S74 S79 S80 H83 F86 L103	F73-I77 PolarHBondContact O-N 2.88Å; S74-I77 PolarHBondContact O-N 3.24Å; I77-S79 PolarHBondContact O-N 2.85Å; I77-S79 VanDerWaalsContact O-N 3.12Å; I77-S80 PolarHBondContact O-N 3.44Å; I77-H83 VanDerWaalsContact CG2-ND1 3.33Å; I77-H83 WeakPolarHBondContact CG2-ND1 3.5Å; I77-H83 WeakPolarHBondContact O-CB 3.46Å; I77-F86 HydrophobicContact CG2-CD1 4.19Å; I77-F86 HydrophobicContact CG2-CD2 3.49Å; I77-F86 VanDerWaalsContact CG2-CD2 3.49Å; I77-F86 HydrophobicContact CG2-CE1 4.1Å; I77-F86 HydrophobicContact CG2-CE2 3.41Å; I77-F86 VanDerWaalsContact CG2-CE2 3.41Å; I77-F86 HydrophobicContact CG2-CG 3.9Å; I77-F86 HydrophobicContact CG2-CZ 3.72Å; I77-L103 HydrophobicContact CD1-CD1 3.87Å
78	R	53.2	Low	65.7	Low	119 Å²	119	94.9 Å²	94.9	45%	0.449	44%	0.436	S	S	.	.	H	α-helix	trans	-55.3	-26.6	175.4	-73.2	-179.5	-152.4	140.9	13.7	115.4	E71 S74 S75 K76 H83	E71-R78 IonicContact OE1-CZ 2.74Å; E71-R78 IonicContact OE1-NH1 2.69Å; E71-R78 PolarHBondContact OE1-NH1 2.97Å; E71-R78 IonicContact OE1-NH2 3.31Å; E71-R78 IonicContact OE2-CZ 3.59Å; E71-R78 IonicContact OE2-NH1 3.15Å; E71-R78 PolarHBondContact OE2-NH1 3.45Å; E71-R78 IonicContact OE2-NH2 3.59Å; E71-R78 PolarHBondContact OE2-NH2 3.22Å; S74-R78 WeakPolarHBondContact O-CG 3.5Å; S74-R78 PolarHBondContact O-N 2.84Å; S75-R78 PolarHBondContact O-N 3.35Å; K76-R78 VanDerWaalsContact C-N 3.35Å; R78-H83 VanDerWaalsContact CA-CG 3.48Å; R78-H83 WeakPolarHBondContact CG-NE2 3.26Å
79	S	49	Very low	63.3	Low	101 Å²	101	90.4 Å²	90.4	71%	0.706	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.5	178.2	50.3	0	0	0	0	114.9	S75 K76 I77	S75-S79 PolarHBondContact O-N 3.4Å; S75-S79 PolarHBondContact O-OG 3.01Å; K76-S79 PolarHBondContact O-N 2.55Å; K76-S79 PolarHBondContact O-OG 3.19Å; I77-S79 PolarHBondContact O-N 2.85Å; I77-S79 VanDerWaalsContact O-N 3.12Å
80	S	48.7	Very low	61.2	Low	41 Å²	41	95.3 Å²	95.3	29%	0.287	44%	0.439	S	S	.	.	S	Bend	trans	-89.6	148.3	171.6	-171.8	0	0	0	0	111.3	I77 E82 H83	I77-S80 PolarHBondContact O-N 3.44Å; S80-E82 VanDerWaalsContact CB-OE2 3.27Å; S80-E82 WeakPolarHBondContact CB-OE2 3.44Å; S80-E82 PolarHBondContact O-N 3.4Å; S80-E82 VanDerWaalsContact O-N 3.16Å; S80-E82 VanDerWaalsContact OG-CD 3.25Å; S80-E82 WeakPolarHBondContact OG-CG 3.46Å; S80-E82 PolarHBondContact OG-N 2.85Å; S80-E82 PolarHBondContact OG-OE2 3.02Å; S80-H83 PolarHBondContact O-N 3.04Å
81	R	47.5	Very low	59.6	Low	211 Å²	211	101 Å²	101	80%	0.796	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-55.2	-28.7	167.9	-99.2	-175.4	167	-173.4	-7.3	111.6	H83	R81-H83 PolarHBondContact O-N 2.74Å; R81-H83 VanDerWaalsContact O-N 3.09Å
82	E	46	Very low	59.1	Low	123 Å²	123	99.3 Å²	99.3	58%	0.575	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-59	-18.1	175.5	-59.9	156.5	142.5	0	0	113.3	S80 Q84 Q85 F86	S80-E82 VanDerWaalsContact CB-OE2 3.27Å; S80-E82 WeakPolarHBondContact CB-OE2 3.44Å; S80-E82 PolarHBondContact O-N 3.4Å; S80-E82 VanDerWaalsContact O-N 3.16Å; S80-E82 VanDerWaalsContact OG-CD 3.25Å; S80-E82 WeakPolarHBondContact OG-CG 3.46Å; S80-E82 PolarHBondContact OG-N 2.85Å; S80-E82 PolarHBondContact OG-OE2 3.02Å; E82-Q84 PolarHBondContact O-N 3.07Å; E82-Q85 WeakPolarHBondContact O-CB 3.29Å; E82-Q85 PolarHBondContact O-N 3.14Å; E82-Q85 VanDerWaalsContact O-N 3.1Å; E82-F86 HydrophobicContact CB-CD2 4.43Å; E82-F86 HydrophobicContact CB-CE2 4.29Å; E82-F86 WeakPolarHBondContact O-CD2 3.47Å; E82-F86 PolarHBondContact O-N 2.7Å
83	H	46	Very low	58.9	Low	33 Å²	33	93.3 Å²	93.3	15%	0.153	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-70.5	-15.7	-174.3	-154.1	64.9	0	0	0	115.5	I77 R78 S80 R81 F86	I77-H83 VanDerWaalsContact CG2-ND1 3.33Å; I77-H83 WeakPolarHBondContact CG2-ND1 3.5Å; I77-H83 WeakPolarHBondContact O-CB 3.46Å; R78-H83 VanDerWaalsContact CA-CG 3.48Å; R78-H83 WeakPolarHBondContact CG-NE2 3.26Å; S80-H83 PolarHBondContact O-N 3.04Å; R81-H83 PolarHBondContact O-N 2.74Å; R81-H83 VanDerWaalsContact O-N 3.09Å; H83-F86 PolarHBondContact O-N 3.46Å
84	Q	47.3	Very low	59.2	Low	166 Å²	166	91 Å²	91	78%	0.776	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-71.3	-36	171.3	-73.6	172.4	-54.3	0	0	110.8	E82 K87	E82-Q84 PolarHBondContact O-N 3.07Å; Q84-K87 PolarHBondContact O-N 2.9Å
85	Q	49.5	Very low	59.7	Low	97 Å²	97	94.1 Å²	94.1	45%	0.453	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-54.9	-52.6	166.7	-124.9	74.6	65.5	0	0	111.1	E82 K87 K88 D89	E82-Q85 WeakPolarHBondContact O-CB 3.29Å; E82-Q85 PolarHBondContact O-N 3.14Å; E82-Q85 VanDerWaalsContact O-N 3.1Å; Q85-K87 PolarHBondContact O-N 2.87Å; Q85-K88 PolarHBondContact O-N 3.02Å; Q85-D89 VanDerWaalsContact CG-OD2 3.23Å; Q85-D89 WeakPolarHBondContact CG-OD2 3.32Å; Q85-D89 PolarHBondContact NE2-OD2 3.27Å; Q85-D89 WeakPolarHBondContact O-CB 3.49Å; Q85-D89 PolarHBondContact O-N 3.39Å; Q85-D89 VanDerWaalsContact O-N 3.15Å
86	F	49.7	Very low	60.6	Low	30 Å²	30	93.7 Å²	93.7	13%	0.132	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-60.9	-12.6	-175.1	-85.7	-84.3	0	0	0	116	I77 E82 H83 L92 V96	I77-F86 HydrophobicContact CG2-CD1 4.19Å; I77-F86 HydrophobicContact CG2-CD2 3.49Å; I77-F86 VanDerWaalsContact CG2-CD2 3.49Å; I77-F86 HydrophobicContact CG2-CE1 4.1Å; I77-F86 HydrophobicContact CG2-CE2 3.41Å; I77-F86 VanDerWaalsContact CG2-CE2 3.41Å; I77-F86 HydrophobicContact CG2-CG 3.9Å; I77-F86 HydrophobicContact CG2-CZ 3.72Å; E82-F86 HydrophobicContact CB-CD2 4.43Å; E82-F86 HydrophobicContact CB-CE2 4.29Å; E82-F86 WeakPolarHBondContact O-CD2 3.47Å; E82-F86 PolarHBondContact O-N 2.7Å; H83-F86 PolarHBondContact O-N 3.46Å; F86-L92 HydrophobicContact CD1-CD1 4.42Å; F86-L92 HydrophobicContact CD1-CD2 3.89Å; F86-L92 HydrophobicContact CE1-CD2 4.03Å; F86-L92 HydrophobicContact CG-CD2 4.3Å; F86-V96 HydrophobicContact CE1-CG1 3.39Å; F86-V96 HydrophobicContact CZ-CG1 3.36Å
87	K	46.3	Very low	61.6	Low	169 Å²	169	90.7 Å²	90.7	74%	0.735	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-104.9	-10	-179.7	-83.9	-163.4	169.9	-164.1	0	115	Q84 Q85	Q84-K87 PolarHBondContact O-N 2.9Å; Q85-K87 PolarHBondContact O-N 2.87Å
88	K	49.8	Very low	63.1	Low	174 Å²	174	90.4 Å²	90.4	76%	0.757	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-28.8	-177.6	-86.9	-166.5	165.9	-167.4	0	115.2	Q85	Q85-K88 PolarHBondContact O-N 3.02Å
89	D	46.7	Very low	65	Low	49 Å²	49	89.4 Å²	89.4	26%	0.262	43%	0.434	S	S	.	.			trans	-100	133.7	-149.1	-65.8	-3.1	0	0	0	115.9	Q85 H91	Q85-D89 VanDerWaalsContact CG-OD2 3.23Å; Q85-D89 WeakPolarHBondContact CG-OD2 3.32Å; Q85-D89 PolarHBondContact NE2-OD2 3.27Å; Q85-D89 WeakPolarHBondContact O-CB 3.49Å; Q85-D89 PolarHBondContact O-N 3.39Å; Q85-D89 VanDerWaalsContact O-N 3.15Å; D89-H91 HydrophobicContact CB-CB 4.25Å; D89-H91 PolarHBondContact O-N 3.42Å; D89-H91 VanDerWaalsContact O-N 3.07Å
90	Q	52.6	Low	66.9	Low	186 Å²	186	88.2 Å²	88.2	87%	0.869	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-0.5	162.8	-69	178.5	-26.2	0	0	113.4
91	H	61.8	Low	69.1	Low	121 Å²	121	87.8 Å²	87.8	56%	0.56	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	8.8	-166.3	-56.9	-70	0	0	0	114.8	D89 L93	D89-H91 HydrophobicContact CB-CB 4.25Å; D89-H91 PolarHBondContact O-N 3.42Å; D89-H91 VanDerWaalsContact O-N 3.07Å; H91-L93 PolarHBondContact O-N 2.95Å
92	L	79.8	Confident	71.4	Confident	33 Å²	33	81.7 Å²	81.7	17%	0.173	39%	0.391	C	S	.	.			trans	-55.3	139.3	174	-69.1	-179.4	0	0	0	111.6	F86 V96 N97 K317	F86-L92 HydrophobicContact CD1-CD1 4.42Å; F86-L92 HydrophobicContact CD1-CD2 3.89Å; F86-L92 HydrophobicContact CE1-CD2 4.03Å; F86-L92 HydrophobicContact CG-CD2 4.3Å; L92-V96 HydrophobicContact CD2-CG1 4.23Å; L92-N97 HydrophobicContact CB-CB 4.46Å; L92-K317 PolarHBondContact O-NZ 3.12Å
93	L	89.8	Confident	73.7	Confident	44 Å²	44	76.1 Å²	76.1	23%	0.23	37%	0.366	C	S	.	.			trans	-64.6	142.4	169.2	-55.2	-179	0	0	0	109.2	H91 S95 V96 N97 D314 K317 I318	H91-L93 PolarHBondContact O-N 2.95Å; L93-S95 PolarHBondContact O-N 3.06Å; L93-V96 HydrophobicContact CB-CB 4.28Å; L93-V96 HydrophobicContact CB-CG2 4.06Å; L93-V96 CarbonylContact O-C 3.56Å; L93-V96 WeakPolarHBondContact O-CA 3.46Å; L93-V96 WeakPolarHBondContact O-CB 3.22Å; L93-V96 PolarHBondContact O-N 3.33Å; L93-N97 PolarHBondContact O-N 3.35Å; L93-D314 WeakPolarHBondContact CA-OD1 3.34Å; L93-D314 HydrophobicContact CD2-CB 4.02Å; L93-K317 HydrophobicContact CD2-CB 4.06Å; L93-K317 HydrophobicContact CD2-CD 4.13Å; L93-I318 HydrophobicContact CD1-CD1 4.12Å; L93-I318 HydrophobicContact CD1-CG1 4.29Å; L93-I318 HydrophobicContact CD2-CD1 4.25Å; L93-I318 HydrophobicContact CD2-CG1 3.89Å
94	S	93.4	Very high	75.9	Confident	14 Å²	14	76.7 Å²	76.7	10%	0.098	37%	0.37	C	S	.	.	H	α-helix	trans	-54.2	-48.6	-174.2	64.4	0	0	0	0	112.4	V96 N97 C98 N308 D314	S94-V96 VanDerWaalsContact C-N 3.27Å; S94-V96 PolarHBondContact O-N 3.09Å; S94-N97 WeakPolarHBondContact O-CB 3.42Å; S94-N97 PolarHBondContact O-N 3.12Å; S94-N97 VanDerWaalsContact O-N 3.12Å; S94-C98 PolarHBondContact O-N 3.34Å; S94-C98 PolarHBondContact O-SG 3.38Å; S94-N308 WeakPolarHBondContact CB-O 3.2Å; S94-D314 WeakPolarHBondContact CB-OD2 3.37Å; S94-D314 PolarHBondContact N-OD1 3.48Å; S94-D314 PolarHBondContact N-OD2 3.1Å; S94-D314 PolarHBondContact OG-OD2 2.77Å
95	S	93	Very high	78.3	Confident	72 Å²	72	69.2 Å²	69.2	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-58.5	-34.2	174.6	55.3	0	0	0	0	114	L93 W99	L93-S95 PolarHBondContact O-N 3.06Å; S95-W99 PolarHBondContact O-N 2.86Å
96	V	89.8	Confident	80.6	Confident	42 Å²	42	65.5 Å²	65.5	26%	0.255	32%	0.319	S	S	.	.	H	α-helix	trans	-76.8	-35.2	177.4	176.1	0	0	0	0	111	F86 L92 L93 S94 W99 Y100	F86-V96 HydrophobicContact CE1-CG1 3.39Å; F86-V96 HydrophobicContact CZ-CG1 3.36Å; L92-V96 HydrophobicContact CD2-CG1 4.23Å; L93-V96 HydrophobicContact CB-CB 4.28Å; L93-V96 HydrophobicContact CB-CG2 4.06Å; L93-V96 CarbonylContact O-C 3.56Å; L93-V96 WeakPolarHBondContact O-CA 3.46Å; L93-V96 WeakPolarHBondContact O-CB 3.22Å; L93-V96 PolarHBondContact O-N 3.33Å; S94-V96 VanDerWaalsContact C-N 3.27Å; S94-V96 PolarHBondContact O-N 3.09Å; V96-W99 PolarHBondContact O-N 3.48Å; V96-Y100 WeakPolarHBondContact O-CB 3.44Å; V96-Y100 PolarHBondContact O-N 3.3Å
97	N	90.5	Very high	82.9	Confident	56 Å²	56	66.5 Å²	66.5	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-45.9	173	-176.4	50.2	0	0	0	111.5	L92 L93 S94 W99 Y100 L101	L92-N97 HydrophobicContact CB-CB 4.46Å; L93-N97 PolarHBondContact O-N 3.35Å; S94-N97 WeakPolarHBondContact O-CB 3.42Å; S94-N97 PolarHBondContact O-N 3.12Å; S94-N97 VanDerWaalsContact O-N 3.12Å; N97-W99 VanDerWaalsContact C-N 3.3Å; N97-W99 PolarHBondContact O-N 2.95Å; N97-Y100 WeakPolarHBondContact O-CB 3.5Å; N97-Y100 PolarHBondContact O-N 3.37Å; N97-Y100 VanDerWaalsContact O-N 3.1Å; N97-L101 WeakPolarHBondContact O-CG 3.48Å; N97-L101 PolarHBondContact O-N 3.43Å
98	C	94.6	Very high	85.3	Confident	17 Å²	17	61.2 Å²	61.2	12%	0.115	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-41.7	175.9	-60.3	0	0	0	0	112.3	S94 L101 L102 A305	S94-C98 PolarHBondContact O-N 3.34Å; S94-C98 PolarHBondContact O-SG 3.38Å; C98-L101 PolarHBondContact O-N 2.96Å; C98-L102 WeakPolarHBondContact O-CB 3.44Å; C98-L102 PolarHBondContact O-N 2.83Å; C98-A305 PolarHBondContact SG-O 3.09Å
99	W	93.2	Very high	87.6	Confident	99 Å²	99	54 Å²	54	38%	0.375	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-41.4	174.2	172.6	-117.7	0	0	0	112.9	F73 S95 V96 N97 L102 L103	F73-W99 HydrophobicContact CB-CH2 4.36Å; F73-W99 HydrophobicContact CB-CZ2 3.88Å; F73-W99 AromaticContact CD1-CH2 4Å; F73-W99 HydrophobicContact CD1-CH2 4Å; F73-W99 AromaticContact CD1-CZ2 3.74Å; F73-W99 HydrophobicContact CD1-CZ2 3.74Å; F73-W99 HydrophobicContact CD2-CH2 4.37Å; F73-W99 HydrophobicContact CE1-CH2 4.38Å; F73-W99 HydrophobicContact CE1-CZ2 4.46Å; F73-W99 AromaticContact CG-CH2 3.99Å; F73-W99 HydrophobicContact CG-CH2 3.99Å; F73-W99 AromaticContact CG-CZ2 3.85Å; F73-W99 HydrophobicContact CG-CZ2 3.85Å; S95-W99 PolarHBondContact O-N 2.86Å; V96-W99 PolarHBondContact O-N 3.48Å; N97-W99 VanDerWaalsContact C-N 3.3Å; N97-W99 PolarHBondContact O-N 2.95Å; W99-L102 HydrophobicContact CE3-CD2 4.15Å; W99-L102 HydrophobicContact CZ3-CD2 4.18Å; W99-L102 PolarHBondContact O-N 2.8Å; W99-L103 HydrophobicContact CD2-CD1 4.41Å; W99-L103 HydrophobicContact CD2-CG 4.43Å; W99-L103 HydrophobicContact CH2-CD2 4Å; W99-L103 HydrophobicContact CH2-CG 4.4Å; W99-L103 HydrophobicContact CZ2-CD1 3.91Å; W99-L103 HydrophobicContact CZ2-CD2 4.03Å; W99-L103 HydrophobicContact CZ2-CG 4.14Å; W99-L103 HydrophobicContact CZ3-CD2 4.49Å; W99-L103 WeakPolarHBondContact O-CG 3.24Å; W99-L103 PolarHBondContact O-N 3.05Å; W99-L103 VanDerWaalsContact O-N 3.16Å
100	Y	89.6	Confident	90.1	Very high	75 Å²	75	51.9 Å²	51.9	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-42.7	176.5	179.7	-111.9	0	0	0	112.2	V96 N97 L103 N104	V96-Y100 WeakPolarHBondContact O-CB 3.44Å; V96-Y100 PolarHBondContact O-N 3.3Å; N97-Y100 WeakPolarHBondContact O-CB 3.5Å; N97-Y100 PolarHBondContact O-N 3.37Å; N97-Y100 VanDerWaalsContact O-N 3.1Å; Y100-L103 PolarHBondContact O-N 2.98Å; Y100-N104 WeakPolarHBondContact CD1-ND2 3.49Å; Y100-N104 WeakPolarHBondContact CE1-ND2 3.23Å; Y100-N104 VanDerWaalsContact O-CG 3.26Å; Y100-N104 PolarHBondContact O-N 3.04Å
101	L	93.6	Very high	92.3	Very high	33 Å²	33	50.1 Å²	50.1	17%	0.173	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-38.9	177	-69	171.5	0	0	0	112.3	N97 C98 L103 N104 Q105 I301 I302 A305	N97-L101 WeakPolarHBondContact O-CG 3.48Å; N97-L101 PolarHBondContact O-N 3.43Å; C98-L101 PolarHBondContact O-N 2.96Å; L101-L103 VanDerWaalsContact C-N 3.35Å; L101-L103 PolarHBondContact O-N 3.27Å; L101-N104 CarbonylContact O-C 3.6Å; L101-N104 WeakPolarHBondContact O-CB 3.45Å; L101-N104 PolarHBondContact O-N 3.36Å; L101-N104 VanDerWaalsContact O-N 3.11Å; L101-Q105 PolarHBondContact O-N 3.21Å; L101-I301 HydrophobicContact CD1-CG2 4.24Å; L101-I301 HydrophobicContact CD2-CG2 3.95Å; L101-I302 HydrophobicContact CB-CG1 4.17Å; L101-A305 HydrophobicContact CD1-CB 3.48Å; L101-A305 VanDerWaalsContact CD1-CB 3.48Å
102	L	96.1	Very high	94	Very high	83 Å²	83	46 Å²	46	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-59.9	-42.1	172.7	-176.5	64.1	0	0	0	112.4	C98 W99 N104 Q105 T106 I302	C98-L102 WeakPolarHBondContact O-CB 3.44Å; C98-L102 PolarHBondContact O-N 2.83Å; W99-L102 HydrophobicContact CE3-CD2 4.15Å; W99-L102 HydrophobicContact CZ3-CD2 4.18Å; W99-L102 PolarHBondContact O-N 2.8Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-Q105 PolarHBondContact O-N 2.99Å; L102-T106 PolarHBondContact O-N 3.16Å; L102-T106 PolarHBondContact O-OG1 3.46Å; L102-I302 HydrophobicContact CD1-CD1 4.13Å
103	L	94.2	Very high	94.9	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-67.1	-34.8	173.6	-68.4	177.5	0	0	0	112.4	F73 I77 W99 Y100 L101 R107	F73-L103 HydrophobicContact CB-CD1 4.14Å; F73-L103 HydrophobicContact CB-CD2 3.76Å; F73-L103 HydrophobicContact CG-CD2 4.46Å; I77-L103 HydrophobicContact CD1-CD1 3.87Å; W99-L103 HydrophobicContact CD2-CD1 4.41Å; W99-L103 HydrophobicContact CD2-CG 4.43Å; W99-L103 HydrophobicContact CH2-CD2 4Å; W99-L103 HydrophobicContact CH2-CG 4.4Å; W99-L103 HydrophobicContact CZ2-CD1 3.91Å; W99-L103 HydrophobicContact CZ2-CD2 4.03Å; W99-L103 HydrophobicContact CZ2-CG 4.14Å; W99-L103 HydrophobicContact CZ3-CD2 4.49Å; W99-L103 WeakPolarHBondContact O-CG 3.24Å; W99-L103 PolarHBondContact O-N 3.05Å; W99-L103 VanDerWaalsContact O-N 3.16Å; Y100-L103 PolarHBondContact O-N 2.98Å; L101-L103 VanDerWaalsContact C-N 3.35Å; L101-L103 PolarHBondContact O-N 3.27Å; L103-R107 PolarHBondContact O-N 3.19Å
104	N	93.3	Very high	95.4	Very high	44 Å²	44	44.5 Å²	44.5	24%	0.235	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-40.3	175.7	-70.4	-15.3	0	0	0	112.2	Y100 L101 L102 R107 R108	Y100-N104 WeakPolarHBondContact CD1-ND2 3.49Å; Y100-N104 WeakPolarHBondContact CE1-ND2 3.23Å; Y100-N104 VanDerWaalsContact O-CG 3.26Å; Y100-N104 PolarHBondContact O-N 3.04Å; L101-N104 CarbonylContact O-C 3.6Å; L101-N104 WeakPolarHBondContact O-CB 3.45Å; L101-N104 PolarHBondContact O-N 3.36Å; L101-N104 VanDerWaalsContact O-N 3.11Å; L102-N104 VanDerWaalsContact C-N 3.35Å; N104-R107 CarbonylContact O-C 3.57Å; N104-R107 PolarHBondContact O-N 3.2Å; N104-R107 PolarHBondContact OD1-NH1 3.31Å; N104-R108 PolarHBondContact O-N 2.82Å
105	Q	97.5	Very high	95.6	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-39.9	175	177.9	55.8	5.2	0	0	111.9	L101 L102 R107 R108 E109 R295 G298 I302	L101-Q105 PolarHBondContact O-N 3.21Å; L102-Q105 PolarHBondContact O-N 2.99Å; Q105-R107 PolarHBondContact O-N 2.85Å; Q105-R108 WeakPolarHBondContact O-CA 3.23Å; Q105-R108 WeakPolarHBondContact O-CB 3.49Å; Q105-R108 PolarHBondContact O-N 3.35Å; Q105-E109 PolarHBondContact O-N 2.72Å; Q105-R295 PolarHBondContact NE2-O 2.87Å; Q105-G298 VanDerWaalsContact OE1-CA 3.27Å; Q105-I302 HydrophobicContact CB-CD1 3.74Å; Q105-I302 HydrophobicContact CG-CD1 4.09Å
106	T	98.1	Very high	95.9	Very high	19 Å²	19	44.2 Å²	44.2	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-56.4	-37.3	172.2	-51.6	0	0	0	0	111.5	L66 L69 A70 L102 S110	L66-T106 HydrophobicContact CB-CG2 4.24Å; L66-T106 HydrophobicContact CD2-CG2 4.24Å; L69-T106 HydrophobicContact CD2-CG2 4.29Å; A70-T106 HydrophobicContact CB-CG2 3.94Å; L102-T106 PolarHBondContact O-N 3.16Å; L102-T106 PolarHBondContact O-OG1 3.46Å; T106-S110 VanDerWaalsContact O-CB 3.24Å; T106-S110 WeakPolarHBondContact O-CB 3.42Å; T106-S110 PolarHBondContact O-N 3.28Å; T106-S110 VanDerWaalsContact O-N 3.1Å
107	R	96.9	Very high	96.3	Very high	50 Å²	50	42.4 Å²	42.4	19%	0.189	20%	0.201	C	C	.	.	H	α-helix	trans	-79.9	-13	172.9	-66.1	-167	-120.5	79.6	1.4	114.3	A70 S74 L103 N104 Q105 R111	A70-R107 HydrophobicContact CB-CG 3.41Å; A70-R107 VanDerWaalsContact CB-CG 3.41Å; S74-R107 PolarHBondContact OG-NH2 3.33Å; L103-R107 PolarHBondContact O-N 3.19Å; N104-R107 CarbonylContact O-C 3.57Å; N104-R107 PolarHBondContact O-N 3.2Å; N104-R107 PolarHBondContact OD1-NH1 3.31Å; Q105-R107 PolarHBondContact O-N 2.85Å; R107-R111 WeakPolarHBondContact O-CG 3.37Å; R107-R111 PolarHBondContact O-NE 3Å; R107-R111 PolarHBondContact O-NH2 3.14Å
108	R	97.5	Very high	96.7	Very high	58 Å²	58	43.9 Å²	43.9	22%	0.219	21%	0.209	C	C	.	.	H	α-helix	trans	-77.5	-59.4	169.5	-164.5	-171.5	-64.3	-170.6	-2.8	109	N104 Q105 S110 R111 D112 S294 G298	N104-R108 PolarHBondContact O-N 2.82Å; Q105-R108 WeakPolarHBondContact O-CA 3.23Å; Q105-R108 WeakPolarHBondContact O-CB 3.49Å; Q105-R108 PolarHBondContact O-N 3.35Å; R108-S110 PolarHBondContact O-N 3.06Å; R108-S110 VanDerWaalsContact O-N 3.15Å; R108-R111 PolarHBondContact O-N 3.15Å; R108-D112 VanDerWaalsContact O-CG 3.25Å; R108-D112 PolarHBondContact O-N 3.12Å; R108-S294 WeakPolarHBondContact CD-O 3.34Å; R108-S294 VanDerWaalsContact CD-OG 3.26Å; R108-S294 WeakPolarHBondContact CD-OG 3.39Å; R108-S294 PolarHBondContact NH1-O 2.81Å; R108-S294 VanDerWaalsContact NH1-O 3.15Å; R108-G298 VanDerWaalsContact NH1-N 3.2Å
109	E	98.3	Very high	96.9	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.112	22%	0.215	C	C	.	.	H	α-helix	trans	-50.5	-43.7	175	-65.5	-177	149.1	0	0	111.6	L66 Q105 R111 D112 H113 R295	L66-E109 HydrophobicContact CD1-CB 3.77Å; Q105-E109 PolarHBondContact O-N 2.72Å; E109-R111 PolarHBondContact O-N 3.48Å; E109-D112 PolarHBondContact O-N 2.88Å; E109-H113 PolarHBondContact O-CD2 3.31Å; E109-H113 VanDerWaalsContact O-CD2 3.23Å; E109-H113 PolarHBondContact O-N 3.17Å; E109-R295 WeakPolarHBondContact OE1-CG 3.46Å; E109-R295 IonicContact OE1-CZ 2.66Å; E109-R295 IonicContact OE1-NE 2.67Å; E109-R295 PolarHBondContact OE1-NE 3.03Å; E109-R295 IonicContact OE1-NH2 2.7Å
110	S	98.6	Very high	97.1	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-48.4	-48.5	171.9	173.8	0	0	0	0	114.2	S63 E67 T106 R108 A114	S63-S110 WeakPolarHBondContact CB-O 3.42Å; S63-S110 PolarHBondContact O-OG 3Å; S63-S110 PolarHBondContact OG-O 3.14Å; E67-S110 WeakPolarHBondContact CB-OG 3.32Å; E67-S110 WeakPolarHBondContact OE2-CB 3.23Å; E67-S110 PolarHBondContact OE2-OG 3.25Å; T106-S110 VanDerWaalsContact O-CB 3.24Å; T106-S110 WeakPolarHBondContact O-CB 3.42Å; T106-S110 PolarHBondContact O-N 3.28Å; T106-S110 VanDerWaalsContact O-N 3.1Å; R108-S110 PolarHBondContact O-N 3.06Å; R108-S110 VanDerWaalsContact O-N 3.15Å; S110-A114 PolarHBondContact O-N 3.26Å
111	R	98.5	Very high	97.6	Very high	148 Å²	148	39.8 Å²	39.8	56%	0.558	20%	0.2	S	C	*	.	H	α-helix	trans	-77.9	-32.2	-178.5	-72.2	176.6	-70.7	155.1	3.6	112.2	R107 R108 E109 A114 T115	R107-R111 WeakPolarHBondContact O-CG 3.37Å; R107-R111 PolarHBondContact O-NE 3Å; R107-R111 PolarHBondContact O-NH2 3.14Å; R108-R111 PolarHBondContact O-N 3.15Å; E109-R111 PolarHBondContact O-N 3.48Å; R111-A114 PolarHBondContact O-N 2.83Å; R111-T115 WeakPolarHBondContact O-CB 3.26Å; R111-T115 PolarHBondContact O-N 2.97Å; R111-T115 PolarHBondContact O-OG1 3.09Å
112	D	98.6	Very high	97.8	Very high	34 Å²	34	42.8 Å²	42.8	18%	0.182	22%	0.216	C	C	.	.	H	α-helix	trans	-72.8	-41.5	-178.9	-57.7	-14.8	0	0	0	110.5	R108 E109 A114 T115 L116 L291 S294	R108-D112 VanDerWaalsContact O-CG 3.25Å; R108-D112 PolarHBondContact O-N 3.12Å; E109-D112 PolarHBondContact O-N 2.88Å; D112-A114 PolarHBondContact O-N 3.36Å; D112-T115 CarbonylContact O-C 3.51Å; D112-T115 WeakPolarHBondContact O-CB 3.4Å; D112-T115 PolarHBondContact O-N 3.16Å; D112-L116 WeakPolarHBondContact O-CB 3.41Å; D112-L116 PolarHBondContact O-N 2.89Å; D112-L291 HydrophobicContact CB-CD1 3.5Å; D112-L291 VanDerWaalsContact CB-CD1 3.5Å; D112-S294 VanDerWaalsContact OD2-CB 3.32Å; D112-S294 WeakPolarHBondContact OD2-CB 3.33Å; D112-S294 PolarHBondContact OD2-OG 2.95Å
113	H	98.8	Very high	97.9	Very high	22 Å²	22	41.6 Å²	41.6	10%	0.102	21%	0.21	C	C	.	.	H	α-helix	trans	-66.5	-33	172.2	-78.6	-82.8	0	0	0	113	E59 Y62 E109 L116 S117	E59-H113 IonicContact OE2-CE1 3.99Å; E59-H113 PolarHBondContact OE2-CE1 2.91Å; E59-H113 IonicContact OE2-CG 3.79Å; E59-H113 IonicContact OE2-ND1 3.77Å; E59-H113 PolarHBondContact OE2-ND1 3.47Å; Y62-H113 HydrophobicContact CD1-CB 4.49Å; Y62-H113 AromaticContact CD1-CD2 3.83Å; Y62-H113 AromaticContact CD1-CE1 3.82Å; Y62-H113 AromaticContact CD1-CG 3.82Å; Y62-H113 AromaticContact CD1-ND1 3.8Å; Y62-H113 AromaticContact CD1-NE2 3.84Å; Y62-H113 AromaticContact CE1-CD2 3.78Å; Y62-H113 AromaticContact CE1-CE1 3.84Å; Y62-H113 AromaticContact CE1-NE2 3.51Å; E109-H113 PolarHBondContact O-CD2 3.31Å; E109-H113 VanDerWaalsContact O-CD2 3.23Å; E109-H113 PolarHBondContact O-N 3.17Å; H113-L116 PolarHBondContact O-N 3.41Å; H113-S117 PolarHBondContact O-N 2.74Å
114	A	98.7	Very high	98.1	Very high	24 Å²	24	41.3 Å²	41.3	20%	0.198	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-45.9	169.6	0	0	0	0	0	111.2	L60 S110 R111 D112 L116 S117 D118	L60-A114 HydrophobicContact CD1-CB 4.31Å; S110-A114 PolarHBondContact O-N 3.26Å; R111-A114 PolarHBondContact O-N 2.83Å; D112-A114 PolarHBondContact O-N 3.36Å; A114-L116 VanDerWaalsContact C-N 3.29Å; A114-L116 PolarHBondContact O-N 3.39Å; A114-S117 WeakPolarHBondContact O-CB 3.44Å; A114-S117 PolarHBondContact O-N 3.15Å; A114-D118 PolarHBondContact O-N 2.69Å
115	T	98.7	Very high	98.3	Very high	76 Å²	76	40.3 Å²	40.3	47%	0.466	20%	0.203	S	C	.	.	H	α-helix	trans	-61.2	-38.3	177.3	-56.3	0	0	0	0	111.5	R111 D112 D118 I119	R111-T115 WeakPolarHBondContact O-CB 3.26Å; R111-T115 PolarHBondContact O-N 2.97Å; R111-T115 PolarHBondContact O-OG1 3.09Å; D112-T115 CarbonylContact O-C 3.51Å; D112-T115 WeakPolarHBondContact O-CB 3.4Å; D112-T115 PolarHBondContact O-N 3.16Å; T115-D118 PolarHBondContact O-N 3.12Å; T115-I119 HydrophobicContact CG2-CD1 4.13Å; T115-I119 WeakPolarHBondContact O-CG1 3.33Å; T115-I119 PolarHBondContact O-N 3.01Å
116	L	98.6	Very high	98.4	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-43.4	175.6	-171.2	60.1	0	0	0	112.1	E59 D112 H113 A114 D118 I119 Y120 A287 L291	E59-L116 HydrophobicContact CG-CD2 4.16Å; E59-L116 HydrophobicContact CG-CG 4.31Å; D112-L116 WeakPolarHBondContact O-CB 3.41Å; D112-L116 PolarHBondContact O-N 2.89Å; H113-L116 PolarHBondContact O-N 3.41Å; A114-L116 VanDerWaalsContact C-N 3.29Å; A114-L116 PolarHBondContact O-N 3.39Å; L116-D118 VanDerWaalsContact C-N 3.34Å; L116-D118 PolarHBondContact O-N 2.86Å; L116-I119 PolarHBondContact O-N 3.07Å; L116-Y120 HydrophobicContact CD1-CD1 4.4Å; L116-Y120 HydrophobicContact CD1-CE1 3.53Å; L116-Y120 HydrophobicContact CD1-CE2 4.31Å; L116-Y120 VanDerWaalsContact CD1-CZ 3.49Å; L116-Y120 WeakPolarHBondContact CD1-OH 3.39Å; L116-Y120 HydrophobicContact CD2-CE2 4.37Å; L116-Y120 WeakPolarHBondContact CD2-OH 3.47Å; L116-Y120 HydrophobicContact CG-CE1 3.99Å; L116-Y120 HydrophobicContact CG-CE2 3.84Å; L116-Y120 VanDerWaalsContact CG-CZ 3.5Å; L116-Y120 WeakPolarHBondContact CG-OH 3.35Å; L116-Y120 VanDerWaalsContact O-CG 3.31Å; L116-Y120 PolarHBondContact O-N 3.44Å; L116-A287 HydrophobicContact CD1-CB 3.46Å; L116-A287 VanDerWaalsContact CD1-CB 3.46Å; L116-L291 HydrophobicContact CD2-CD2 3.75Å
117	S	98.7	Very high	98.4	Very high	4 Å²	4	48 Å²	48	3%	0.028	24%	0.239	C	C	.	.	H	α-helix	trans	-57.2	-44.6	170.5	166.4	0	0	0	0	112.1	A56 H113 A114 Y120 T121	A56-S117 WeakPolarHBondContact O-CB 3.31Å; A56-S117 PolarHBondContact O-OG 3.32Å; H113-S117 PolarHBondContact O-N 2.74Å; A114-S117 WeakPolarHBondContact O-CB 3.44Å; A114-S117 PolarHBondContact O-N 3.15Å; S117-Y120 PolarHBondContact O-N 3.15Å; S117-T121 WeakPolarHBondContact O-CB 3.37Å; S117-T121 PolarHBondContact O-N 3.46Å; S117-T121 PolarHBondContact O-OG1 2.76Å
118	D	98.6	Very high	98.5	Very high	86 Å²	86	45.7 Å²	45.7	46%	0.46	23%	0.231	S	C	.	.	H	α-helix	trans	-68.3	-34.4	178.7	-78.8	-26.7	0	0	0	112.5	A114 T115 L116 N122	A114-D118 PolarHBondContact O-N 2.69Å; T115-D118 PolarHBondContact O-N 3.12Å; L116-D118 VanDerWaalsContact C-N 3.34Å; L116-D118 PolarHBondContact O-N 2.86Å; D118-N122 VanDerWaalsContact O-CB 3.24Å; D118-N122 WeakPolarHBondContact O-CB 3.42Å; D118-N122 PolarHBondContact O-N 3.41Å; D118-N122 PolarHBondContact O-ND2 2.88Å
119	I	98.6	Very high	98.5	Very high	47 Å²	47	44.5 Å²	44.5	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-43.5	172.4	-70	164.1	0	0	0	110.5	T115 L116 N123 V124 T283 A287	T115-I119 HydrophobicContact CG2-CD1 4.13Å; T115-I119 WeakPolarHBondContact O-CG1 3.33Å; T115-I119 PolarHBondContact O-N 3.01Å; L116-I119 PolarHBondContact O-N 3.07Å; I119-N123 HydrophobicContact CG2-CB 4.47Å; I119-N123 WeakPolarHBondContact O-CA 3.44Å; I119-N123 VanDerWaalsContact O-CB 3.24Å; I119-N123 WeakPolarHBondContact O-CB 3.27Å; I119-N123 PolarHBondContact O-N 2.93Å; I119-V124 PolarHBondContact O-N 3.34Å; I119-V124 VanDerWaalsContact O-N 3.08Å; I119-T283 HydrophobicContact CG2-CG2 4.21Å; I119-A287 HydrophobicContact CD1-CB 3.94Å; I119-A287 HydrophobicContact CG2-CB 3.98Å
120	Y	98.7	Very high	98.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-63.3	-48.2	176.8	-63	-14.8	0	0	0	111.7	F52 K55 A56 E59 L116 S117 V124 I125 Y284 E288	F52-Y120 HydrophobicContact CD1-CD1 4.22Å; F52-Y120 HydrophobicContact CD1-CD2 4.42Å; F52-Y120 HydrophobicContact CD1-CG 4.16Å; F52-Y120 HydrophobicContact CE1-CE1 4.48Å; K55-Y120 HydrophobicContact CB-CD2 4.26Å; K55-Y120 HydrophobicContact CB-CE2 4.15Å; K55-Y120 HydrophobicContact CD-CD2 4.41Å; K55-Y120 HydrophobicContact CD-CE2 3.55Å; K55-Y120 HydrophobicContact CG-CD2 4.32Å; K55-Y120 HydrophobicContact CG-CE2 3.72Å; K55-Y120 PolarHBondContact NZ-OH 2.87Å; A56-Y120 HydrophobicContact CB-CD2 4.18Å; E59-Y120 HydrophobicContact CG-CD2 4.39Å; E59-Y120 HydrophobicContact CG-CE2 3.85Å; L116-Y120 HydrophobicContact CD1-CD1 4.4Å; L116-Y120 HydrophobicContact CD1-CE1 3.53Å; L116-Y120 HydrophobicContact CD1-CE2 4.31Å; L116-Y120 VanDerWaalsContact CD1-CZ 3.49Å; L116-Y120 WeakPolarHBondContact CD1-OH 3.39Å; L116-Y120 HydrophobicContact CD2-CE2 4.37Å; L116-Y120 WeakPolarHBondContact CD2-OH 3.47Å; L116-Y120 HydrophobicContact CG-CE1 3.99Å; L116-Y120 HydrophobicContact CG-CE2 3.84Å; L116-Y120 VanDerWaalsContact CG-CZ 3.5Å; L116-Y120 WeakPolarHBondContact CG-OH 3.35Å; L116-Y120 VanDerWaalsContact O-CG 3.31Å; L116-Y120 PolarHBondContact O-N 3.44Å; S117-Y120 PolarHBondContact O-N 3.15Å; Y120-V124 HydrophobicContact CD1-CG2 4.06Å; Y120-V124 PolarHBondContact O-N 3.28Å; Y120-I125 WeakPolarHBondContact O-CG1 3.16Å; Y120-I125 PolarHBondContact O-N 3.44Å; Y120-Y284 AromaticContact CE1-CD2 3.67Å; Y120-Y284 HydrophobicContact CE1-CD2 3.67Å; Y120-Y284 HydrophobicContact CE1-CE2 4.2Å; Y120-Y284 WeakPolarHBondContact OH-CE2 3.42Å; Y120-E288 PolarHBondContact OH-OE1 2.97Å
121	T	98.4	Very high	98.5	Very high	59 Å²	59	48.1 Å²	48.1	36%	0.362	25%	0.25	S	C	.	.	I	π-helix	trans	-64.5	-52.2	-177.5	-55.2	0	0	0	0	111.6	S117	S117-T121 WeakPolarHBondContact O-CB 3.37Å; S117-T121 PolarHBondContact O-N 3.46Å; S117-T121 PolarHBondContact O-OG1 2.76Å
122	N	98.1	Very high	98.5	Very high	95 Å²	95	41.7 Å²	41.7	51%	0.508	23%	0.227	S	C	.	.	I	π-helix	trans	-94	-18.7	-168.4	-55.9	-62.9	0	0	0	113.9	D118 V126	D118-N122 VanDerWaalsContact O-CB 3.24Å; D118-N122 WeakPolarHBondContact O-CB 3.42Å; D118-N122 PolarHBondContact O-N 3.41Å; D118-N122 PolarHBondContact O-ND2 2.88Å; N122-V126 WeakPolarHBondContact O-CG2 3.34Å
123	N	98.1	Very high	98.4	Very high	58 Å²	58	45.6 Å²	45.6	31%	0.31	25%	0.245	S	C	.	.	I	π-helix	trans	-113.3	-54	176.1	-82	-92.5	0	0	0	113.4	I119 R127 T283	I119-N123 HydrophobicContact CG2-CB 4.47Å; I119-N123 WeakPolarHBondContact O-CA 3.44Å; I119-N123 VanDerWaalsContact O-CB 3.24Å; I119-N123 WeakPolarHBondContact O-CB 3.27Å; I119-N123 PolarHBondContact O-N 2.93Å; N123-R127 WeakPolarHBondContact O-CB 3.48Å; N123-R127 WeakPolarHBondContact O-CD 3.41Å; N123-R127 WeakPolarHBondContact O-CG 3.23Å; N123-R127 PolarHBondContact O-N 3.37Å; N123-R127 VanDerWaalsContact O-N 3.08Å; N123-R127 PolarHBondContact OD1-NH2 3.5Å; N123-T283 HydrophobicContact CB-CG2 4.22Å
124	V	98.6	Very high	98.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-70.9	-53.1	-170	-178.3	0	0	0	0	111.3	F52 I119 Y120 V126 R127 L128 T280 T283	F52-V124 HydrophobicContact CB-CG1 4.31Å; F52-V124 HydrophobicContact CD1-CG1 4.06Å; F52-V124 HydrophobicContact CD2-CG1 3.49Å; F52-V124 VanDerWaalsContact CD2-CG1 3.49Å; F52-V124 HydrophobicContact CE1-CG1 4.3Å; F52-V124 HydrophobicContact CE2-CG1 3.75Å; F52-V124 HydrophobicContact CG-CG1 3.67Å; F52-V124 HydrophobicContact CZ-CG1 4.15Å; I119-V124 PolarHBondContact O-N 3.34Å; I119-V124 VanDerWaalsContact O-N 3.08Å; Y120-V124 HydrophobicContact CD1-CG2 4.06Å; Y120-V124 PolarHBondContact O-N 3.28Å; V124-V126 PolarHBondContact O-N 3.27Å; V124-R127 PolarHBondContact O-N 3.28Å; V124-L128 HydrophobicContact CG1-CD1 4.19Å; V124-L128 WeakPolarHBondContact O-CG 3.28Å; V124-L128 PolarHBondContact O-N 2.95Å; V124-T280 HydrophobicContact CG1-CG2 3.85Å; V124-T283 HydrophobicContact CG2-CG2 4.47Å
125	I	98.6	Very high	98.3	Very high	23 Å²	23	46 Å²	46	12%	0.118	24%	0.244	C	C	.	.	I	π-helix	trans	-62.9	-44.6	-179.7	-64	172.5	0	0	0	110.8	Q49 F52 R53 Y120 R127 L128 A129	Q49-I125 HydrophobicContact CB-CG2 4.41Å; Q49-I125 HydrophobicContact CG-CG2 4.17Å; F52-I125 HydrophobicContact CB-CD1 4.34Å; F52-I125 HydrophobicContact CB-CG1 3.84Å; R53-I125 HydrophobicContact CB-CD1 3.81Å; R53-I125 HydrophobicContact CG-CD1 4.27Å; Y120-I125 WeakPolarHBondContact O-CG1 3.16Å; Y120-I125 PolarHBondContact O-N 3.44Å; I125-R127 VanDerWaalsContact C-N 3.33Å; I125-R127 PolarHBondContact O-N 2.75Å; I125-L128 PolarHBondContact O-N 2.87Å; I125-A129 PolarHBondContact O-N 3.41Å
126	V	98.4	Very high	98.2	Very high	85 Å²	85	46.8 Å²	46.8	52%	0.515	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-41.8	178	178.5	0	0	0	0	111.7	N122 V124 A129 Q130	N122-V126 WeakPolarHBondContact O-CG2 3.34Å; V124-V126 PolarHBondContact O-N 3.27Å; V126-A129 PolarHBondContact O-N 3.16Å; V126-Q130 PolarHBondContact O-N 3.21Å
127	R	98.3	Very high	98.1	Very high	107 Å²	107	52 Å²	52	40%	0.404	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-40.2	175.9	-71.5	168.9	-163.3	-79.4	-1	112	N123 V124 I125 Q130 I131 T280	N123-R127 WeakPolarHBondContact O-CB 3.48Å; N123-R127 WeakPolarHBondContact O-CD 3.41Å; N123-R127 WeakPolarHBondContact O-CG 3.23Å; N123-R127 PolarHBondContact O-N 3.37Å; N123-R127 VanDerWaalsContact O-N 3.08Å; N123-R127 PolarHBondContact OD1-NH2 3.5Å; V124-R127 PolarHBondContact O-N 3.28Å; I125-R127 VanDerWaalsContact C-N 3.33Å; I125-R127 PolarHBondContact O-N 2.75Å; R127-Q130 PolarHBondContact O-N 3.35Å; R127-I131 WeakPolarHBondContact O-CD1 3.47Å; R127-I131 WeakPolarHBondContact O-CG1 3.45Å; R127-I131 PolarHBondContact O-N 2.77Å; R127-T280 HydrophobicContact CB-CG2 4.07Å
128	L	98.6	Very high	98	Very high	1 Å²	1	53 Å²	53	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-38.9	175.9	-67.7	168.7	0	0	0	112.5	L45 L48 Q49 F52 V124 I125 I131 S132 L277 T280	L45-L128 HydrophobicContact CD2-CD2 3.82Å; L48-L128 HydrophobicContact CB-CD1 3.75Å; L48-L128 HydrophobicContact CB-CD2 4.28Å; L48-L128 HydrophobicContact CD1-CD2 4.23Å; Q49-L128 HydrophobicContact CG-CB 3.49Å; Q49-L128 VanDerWaalsContact CG-CB 3.49Å; Q49-L128 HydrophobicContact CG-CD1 4.01Å; Q49-L128 HydrophobicContact CG-CG 4.41Å; F52-L128 HydrophobicContact CD2-CD1 3.97Å; V124-L128 HydrophobicContact CG1-CD1 4.19Å; V124-L128 WeakPolarHBondContact O-CG 3.28Å; V124-L128 PolarHBondContact O-N 2.95Å; I125-L128 PolarHBondContact O-N 2.87Å; L128-I131 PolarHBondContact O-N 2.8Å; L128-S132 PolarHBondContact O-N 3.18Å; L128-S132 PolarHBondContact O-OG 2.77Å; L128-L277 HydrophobicContact CD2-CD1 3.81Å; L128-T280 HydrophobicContact CD2-CG2 4.15Å; L128-T280 HydrophobicContact CG-CG2 4.06Å
129	A	98.3	Very high	97.9	Very high	33 Å²	33	50 Å²	50	27%	0.273	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-48.6	173.4	0	0	0	0	0	111.1	I125 V126 I131 S132 E133	I125-A129 PolarHBondContact O-N 3.41Å; V126-A129 PolarHBondContact O-N 3.16Å; A129-I131 VanDerWaalsContact C-N 3.31Å; A129-I131 PolarHBondContact O-N 3.34Å; A129-S132 WeakPolarHBondContact O-CB 3.45Å; A129-S132 PolarHBondContact O-N 3.21Å; A129-E133 PolarHBondContact O-N 3.18Å
130	Q	98.2	Very high	97.7	Very high	96 Å²	96	54 Å²	54	45%	0.449	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-38.6	177.2	-171.5	63.9	86.6	0	0	112.7	V126 R127 S132 E133 D134	V126-Q130 PolarHBondContact O-N 3.21Å; R127-Q130 PolarHBondContact O-N 3.35Å; Q130-S132 VanDerWaalsContact C-N 3.3Å; Q130-S132 PolarHBondContact O-N 2.91Å; Q130-E133 PolarHBondContact NE2-OE2 3.33Å; Q130-E133 PolarHBondContact O-N 3.45Å; Q130-D134 WeakPolarHBondContact O-CB 3.32Å; Q130-D134 PolarHBondContact O-N 3.36Å
131	I	98.3	Very high	97.6	Very high	7 Å²	7	59.7 Å²	59.7	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-35.7	175.2	-64.2	160.5	0	0	0	110.9	L45 R127 L128 A129 D134 V135 Y273	L45-I131 HydrophobicContact CD1-CB 4.38Å; L45-I131 HydrophobicContact CD1-CG2 3.77Å; L45-I131 HydrophobicContact CD2-CB 4.28Å; L45-I131 HydrophobicContact CD2-CG2 3.89Å; R127-I131 WeakPolarHBondContact O-CD1 3.47Å; R127-I131 WeakPolarHBondContact O-CG1 3.45Å; R127-I131 PolarHBondContact O-N 2.77Å; L128-I131 PolarHBondContact O-N 2.8Å; A129-I131 VanDerWaalsContact C-N 3.31Å; A129-I131 PolarHBondContact O-N 3.34Å; I131-D134 PolarHBondContact O-N 3.45Å; I131-V135 HydrophobicContact CG2-CG2 4.41Å; I131-V135 WeakPolarHBondContact O-CG2 3.45Å; I131-V135 PolarHBondContact O-N 3.14Å; I131-Y273 HydrophobicContact CG2-CD2 3.75Å; I131-Y273 HydrophobicContact CG2-CE2 4.15Å
132	S	98	Very high	97.5	Very high	13 Å²	13	57.2 Å²	57.2	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-45.5	176.2	-55.5	0	0	0	0	111.5	L45 Q49 L128 A129 Q130 D134 V135 I136	L45-S132 VanDerWaalsContact CB-OG 3.28Å; L45-S132 WeakPolarHBondContact CB-OG 3.24Å; Q49-S132 PolarHBondContact NE2-OG 3.17Å; L128-S132 PolarHBondContact O-N 3.18Å; L128-S132 PolarHBondContact O-OG 2.77Å; A129-S132 WeakPolarHBondContact O-CB 3.45Å; A129-S132 PolarHBondContact O-N 3.21Å; Q130-S132 VanDerWaalsContact C-N 3.3Å; Q130-S132 PolarHBondContact O-N 2.91Å; S132-D134 VanDerWaalsContact C-N 3.33Å; S132-D134 PolarHBondContact O-N 2.98Å; S132-V135 PolarHBondContact O-N 2.93Å; S132-I136 WeakPolarHBondContact O-CD1 3.33Å; S132-I136 VanDerWaalsContact O-CG1 3.3Å; S132-I136 WeakPolarHBondContact O-CG1 3.48Å; S132-I136 PolarHBondContact O-N 3.45Å; S132-I136 VanDerWaalsContact O-N 3.11Å
133	E	98	Very high	97.3	Very high	117 Å²	117	55.3 Å²	55.3	55%	0.547	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-43.3	173.5	-66.9	-177.3	175.3	0	0	111.8	A129 Q130 I136 R137	A129-E133 PolarHBondContact O-N 3.18Å; Q130-E133 PolarHBondContact NE2-OE2 3.33Å; Q130-E133 PolarHBondContact O-N 3.45Å; E133-I136 PolarHBondContact O-N 2.84Å; E133-R137 WeakPolarHBondContact O-CB 3.33Å; E133-R137 PolarHBondContact O-N 2.95Å
134	D	97.1	Very high	97.2	Very high	46 Å²	46	57.5 Å²	57.5	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-41.9	179.2	-79.5	-18.4	0	0	0	112.4	Q130 I131 S132 R137 L138	Q130-D134 WeakPolarHBondContact O-CB 3.32Å; Q130-D134 PolarHBondContact O-N 3.36Å; I131-D134 PolarHBondContact O-N 3.45Å; S132-D134 VanDerWaalsContact C-N 3.33Å; S132-D134 PolarHBondContact O-N 2.98Å; D134-R137 PolarHBondContact O-N 3.32Å; D134-R137 IonicContact OD1-CZ 2.75Å; D134-R137 VanDerWaalsContact OD1-CZ 3.27Å; D134-R137 IonicContact OD1-NE 2.64Å; D134-R137 PolarHBondContact OD1-NE 3.47Å; D134-R137 VanDerWaalsContact OD1-NE 3.13Å; D134-R137 IonicContact OD1-NH2 3.39Å; D134-R137 PolarHBondContact OD1-NH2 3.32Å; D134-R137 IonicContact OD2-NH2 3.27Å; D134-L138 VanDerWaalsContact O-CB 3.27Å; D134-L138 WeakPolarHBondContact O-CB 3.34Å; D134-L138 WeakPolarHBondContact O-CG 3.42Å; D134-L138 PolarHBondContact O-N 3.14Å
135	V	97.1	Very high	97	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-48.2	174.9	168.2	0	0	0	0	110.8	I42 L45 I131 S132 R137 L138 F139 Y273	I42-V135 HydrophobicContact CD1-CG1 4.31Å; I42-V135 HydrophobicContact CG1-CG1 3.97Å; L45-V135 HydrophobicContact CD1-CG2 4.37Å; I131-V135 HydrophobicContact CG2-CG2 4.41Å; I131-V135 WeakPolarHBondContact O-CG2 3.45Å; I131-V135 PolarHBondContact O-N 3.14Å; S132-V135 PolarHBondContact O-N 2.93Å; V135-R137 VanDerWaalsContact C-N 3.33Å; V135-R137 PolarHBondContact O-N 3.45Å; V135-L138 PolarHBondContact O-N 3.31Å; V135-F139 VanDerWaalsContact O-CB 3.24Å; V135-F139 WeakPolarHBondContact O-CB 3.42Å; V135-F139 PolarHBondContact O-N 3.37Å; V135-Y273 HydrophobicContact CG2-CD2 3.68Å; V135-Y273 HydrophobicContact CG2-CE2 4.34Å; V135-Y273 HydrophobicContact CG2-CG 4.38Å
136	I	96.7	Very high	96.8	Very high	93 Å²	93	60.6 Å²	60.6	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-46.5	176.7	-66.9	163.8	0	0	0	110.7	I42 S132 E133 K140	I42-I136 HydrophobicContact CD1-CD1 4.25Å; I42-I136 HydrophobicContact CD1-CG1 3.49Å; I42-I136 VanDerWaalsContact CD1-CG1 3.49Å; I42-I136 HydrophobicContact CG1-CG1 4.13Å; S132-I136 WeakPolarHBondContact O-CD1 3.33Å; S132-I136 VanDerWaalsContact O-CG1 3.3Å; S132-I136 WeakPolarHBondContact O-CG1 3.48Å; S132-I136 PolarHBondContact O-N 3.45Å; S132-I136 VanDerWaalsContact O-N 3.11Å; E133-I136 PolarHBondContact O-N 2.84Å; I136-K140 WeakPolarHBondContact O-CB 3.17Å; I136-K140 PolarHBondContact O-N 3.45Å; I136-K140 VanDerWaalsContact O-N 3.1Å
137	R	97.1	Very high	96.7	Very high	114 Å²	114	60.1 Å²	60.1	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-36	-177.2	-177	-173.2	56.1	59.2	-12.5	113.1	E133 D134 V135	E133-R137 WeakPolarHBondContact O-CB 3.33Å; E133-R137 PolarHBondContact O-N 2.95Å; D134-R137 PolarHBondContact O-N 3.32Å; D134-R137 IonicContact OD1-CZ 2.75Å; D134-R137 VanDerWaalsContact OD1-CZ 3.27Å; D134-R137 IonicContact OD1-NE 2.64Å; D134-R137 PolarHBondContact OD1-NE 3.47Å; D134-R137 VanDerWaalsContact OD1-NE 3.13Å; D134-R137 IonicContact OD1-NH2 3.39Å; D134-R137 PolarHBondContact OD1-NH2 3.32Å; D134-R137 IonicContact OD2-NH2 3.27Å; V135-R137 VanDerWaalsContact C-N 3.33Å; V135-R137 PolarHBondContact O-N 3.45Å
138	L	95.8	Very high	96.6	Very high	27 Å²	27	61.3 Å²	61.3	14%	0.141	29%	0.293	C	S	.	.	H	α-helix	trans	-76.8	-50.3	177.1	-72.7	168.1	0	0	0	110.8	D134 V135 K140 K141 S142 L271	D134-L138 VanDerWaalsContact O-CB 3.27Å; D134-L138 WeakPolarHBondContact O-CB 3.34Å; D134-L138 WeakPolarHBondContact O-CG 3.42Å; D134-L138 PolarHBondContact O-N 3.14Å; V135-L138 PolarHBondContact O-N 3.31Å; L138-K140 VanDerWaalsContact C-N 3.26Å; L138-K140 PolarHBondContact O-N 2.97Å; L138-K141 PolarHBondContact O-N 3.4Å; L138-S142 PolarHBondContact O-N 3.01Å; L138-S142 PolarHBondContact O-OG 3.25Å; L138-L271 HydrophobicContact CD1-CB 4.27Å; L138-L271 VanDerWaalsContact CD1-O 3.24Å; L138-L271 WeakPolarHBondContact CD1-O 3.41Å; L138-L271 HydrophobicContact CD2-CD2 4.42Å
139	F	96.2	Very high	96.4	Very high	22 Å²	22	63.6 Å²	63.6	10%	0.096	30%	0.304	C	S	.	.	H	α-helix	trans	-54	-43	177.5	173.1	-110.2	0	0	0	112	L34 E35 S38 V135 K141 S142 K143	L34-F139 HydrophobicContact CB-CE2 4.1Å; E35-F139 VanDerWaalsContact CA-CZ 3.47Å; E35-F139 HydrophobicContact CB-CE1 4.45Å; E35-F139 HydrophobicContact CB-CZ 3.76Å; E35-F139 HydrophobicContact CG-CE1 4.25Å; E35-F139 HydrophobicContact CG-CZ 4.03Å; E35-F139 WeakPolarHBondContact OE1-CE1 3.36Å; S38-F139 WeakPolarHBondContact OG-CB 3.44Å; S38-F139 WeakPolarHBondContact OG-CG 3.11Å; V135-F139 VanDerWaalsContact O-CB 3.24Å; V135-F139 WeakPolarHBondContact O-CB 3.42Å; V135-F139 PolarHBondContact O-N 3.37Å; F139-K141 VanDerWaalsContact C-N 3.34Å; F139-K141 PolarHBondContact O-N 3.18Å; F139-S142 PolarHBondContact O-N 3.21Å; F139-K143 HydrophobicContact CE1-CD 4.14Å; F139-K143 HydrophobicContact CZ-CD 3.98Å; F139-K143 WeakPolarHBondContact O-CB 3.41Å; F139-K143 PolarHBondContact O-N 2.78Å
140	K	95.8	Very high	96.2	Very high	130 Å²	130	63.1 Å²	63.1	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-56.6	-45.2	175.6	-174.4	-179.4	176.6	-169.2	0	112.5	I136 L138 K143 E144	I136-K140 WeakPolarHBondContact O-CB 3.17Å; I136-K140 PolarHBondContact O-N 3.45Å; I136-K140 VanDerWaalsContact O-N 3.1Å; L138-K140 VanDerWaalsContact C-N 3.26Å; L138-K140 PolarHBondContact O-N 2.97Å; K140-K143 PolarHBondContact O-N 3.18Å; K140-E144 WeakPolarHBondContact CE-OE1 3.4Å; K140-E144 IonicContact NZ-OE1 3.64Å; K140-E144 WeakPolarHBondContact O-CG 3.47Å; K140-E144 PolarHBondContact O-N 3.49Å
141	K	96.1	Very high	96.1	Very high	121 Å²	121	64.4 Å²	64.4	53%	0.526	30%	0.302	S	S	.	.	H	α-helix	trans	-68	-42.4	178.5	-71.3	-176.1	175.5	-170.7	0	112.1	L138 F139 K143 E144 I145	L138-K141 PolarHBondContact O-N 3.4Å; F139-K141 VanDerWaalsContact C-N 3.34Å; F139-K141 PolarHBondContact O-N 3.18Å; K141-K143 VanDerWaalsContact C-N 3.28Å; K141-K143 PolarHBondContact O-N 3.38Å; K141-E144 PolarHBondContact O-N 2.93Å; K141-I145 WeakPolarHBondContact O-CG1 3.42Å; K141-I145 PolarHBondContact O-N 2.93Å
142	S	95.3	Very high	96	Very high	6 Å²	6	68.1 Å²	68.1	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-37	174.8	-58.3	0	0	0	0	111.8	L138 F139 I145 G146 C269	L138-S142 PolarHBondContact O-N 3.01Å; L138-S142 PolarHBondContact O-OG 3.25Å; F139-S142 PolarHBondContact O-N 3.21Å; S142-I145 PolarHBondContact O-N 2.84Å; S142-G146 PolarHBondContact O-N 3.27Å; S142-C269 WeakPolarHBondContact CB-SG 3.43Å; S142-C269 PolarHBondContact OG-N 2.83Å; S142-C269 PolarHBondContact OG-SG 3.46Å
143	K	94.3	Very high	95.9	Very high	56 Å²	56	67.9 Å²	67.9	24%	0.243	32%	0.317	C	S	.	.	H	α-helix	trans	-65.6	-43.7	174.6	-163	176.8	-164.6	178	0	112	F31 E35 F139 K140 K141 G146 I147	F31-K143 HydrophobicContact CD1-CG 4.28Å; F31-K143 HydrophobicContact CE1-CB 4.41Å; F31-K143 HydrophobicContact CE1-CG 3.89Å; F31-K143 HydrophobicContact CZ-CG 4.2Å; F31-K143 WeakPolarHBondContact CZ-O 3.41Å; E35-K143 IonicContact OE1-NZ 3.53Å; E35-K143 PolarHBondContact OE1-NZ 3.44Å; E35-K143 IonicContact OE2-NZ 3.44Å; E35-K143 PolarHBondContact OE2-NZ 2.94Å; F139-K143 HydrophobicContact CE1-CD 4.14Å; F139-K143 HydrophobicContact CZ-CD 3.98Å; F139-K143 WeakPolarHBondContact O-CB 3.41Å; F139-K143 PolarHBondContact O-N 2.78Å; K140-K143 PolarHBondContact O-N 3.18Å; K141-K143 VanDerWaalsContact C-N 3.28Å; K141-K143 PolarHBondContact O-N 3.38Å; K143-G146 PolarHBondContact O-N 3.04Å; K143-I147 HydrophobicContact CG-CD1 4.41Å; K143-I147 WeakPolarHBondContact O-CD1 3.29Å; K143-I147 VanDerWaalsContact O-CG1 3.26Å; K143-I147 WeakPolarHBondContact O-CG1 3.28Å; K143-I147 PolarHBondContact O-N 3.02Å
144	E	95.6	Very high	95.7	Very high	104 Å²	104	64.3 Å²	64.3	49%	0.486	30%	0.303	S	S	.	.	H	α-helix	trans	-59.1	-44.3	173.7	-73.2	166.8	-177.5	0	0	111.8	K140 K141	K140-E144 WeakPolarHBondContact CE-OE1 3.4Å; K140-E144 IonicContact NZ-OE1 3.64Å; K140-E144 WeakPolarHBondContact O-CG 3.47Å; K140-E144 PolarHBondContact O-N 3.49Å; K141-E144 PolarHBondContact O-N 2.93Å
145	I	95.6	Very high	95.7	Very high	88 Å²	88	66.5 Å²	66.5	45%	0.451	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-50.3	175.7	-66.9	165.5	0	0	0	111	K141 S142 I147 Q148 M149	K141-I145 WeakPolarHBondContact O-CG1 3.42Å; K141-I145 PolarHBondContact O-N 2.93Å; S142-I145 PolarHBondContact O-N 2.84Å; I145-I147 VanDerWaalsContact C-N 3.25Å; I145-I147 PolarHBondContact O-N 2.76Å; I145-Q148 WeakPolarHBondContact O-CB 3.3Å; I145-Q148 PolarHBondContact O-N 3.08Å; I145-M149 HydrophobicContact CG2-CG 4.45Å; I145-M149 HydrophobicContact CG2-SD 4.43Å; I145-M149 WeakPolarHBondContact O-CG 3.47Å; I145-M149 PolarHBondContact O-N 3.32Å; I145-M149 VanDerWaalsContact O-N 3.16Å
146	G	95	Very high	95.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-34.4	-178.4	0	0	0	0	0	113.4	S142 K143 M149 H150	S142-G146 PolarHBondContact O-N 3.27Å; K143-G146 PolarHBondContact O-N 3.04Å; G146-M149 WeakPolarHBondContact O-CB 3.48Å; G146-M149 PolarHBondContact O-N 3.39Å; G146-M149 VanDerWaalsContact O-N 3.15Å; G146-H150 PolarHBondContact O-CD2 2.98Å; G146-H150 PolarHBondContact O-N 3.05Å
147	I	95.4	Very high	95.6	Very high	75 Å²	75	63.2 Å²	63.2	39%	0.385	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-45.7	175.7	-72	164	0	0	0	110	F31 K143 I145 M149 H150 E151	F31-I147 HydrophobicContact CE2-CG1 3.7Å; F31-I147 HydrophobicContact CZ-CG1 3.86Å; K143-I147 HydrophobicContact CG-CD1 4.41Å; K143-I147 WeakPolarHBondContact O-CD1 3.29Å; K143-I147 VanDerWaalsContact O-CG1 3.26Å; K143-I147 WeakPolarHBondContact O-CG1 3.28Å; K143-I147 PolarHBondContact O-N 3.02Å; I145-I147 VanDerWaalsContact C-N 3.25Å; I145-I147 PolarHBondContact O-N 2.76Å; I147-M149 VanDerWaalsContact C-N 3.25Å; I147-M149 PolarHBondContact O-N 3.14Å; I147-H150 PolarHBondContact O-N 2.96Å; I147-H150 VanDerWaalsContact O-N 3.16Å; I147-E151 HydrophobicContact CG2-CG 4.49Å; I147-E151 WeakPolarHBondContact O-CG 3.31Å; I147-E151 PolarHBondContact O-N 3.39Å
148	Q	95.8	Very high	95.5	Very high	132 Å²	132	61.6 Å²	61.6	62%	0.617	29%	0.294	S	S	*	.	H	α-helix	trans	-59.5	-36.4	175.3	-170.3	-177.5	6.5	0	0	112	I145 E152	I145-Q148 WeakPolarHBondContact O-CB 3.3Å; I145-Q148 PolarHBondContact O-N 3.08Å; Q148-E152 PolarHBondContact O-N 3.42Å; Q148-E152 VanDerWaalsContact O-N 3.15Å
149	M	94.7	Very high	95.5	Very high	49 Å²	49	64.2 Å²	64.2	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-69.8	-39.4	176.3	-51	-156.9	72.9	0	0	112.3	I145 G146 I147 E152 L153 Y257 D261	I145-M149 HydrophobicContact CG2-CG 4.45Å; I145-M149 HydrophobicContact CG2-SD 4.43Å; I145-M149 WeakPolarHBondContact O-CG 3.47Å; I145-M149 PolarHBondContact O-N 3.32Å; I145-M149 VanDerWaalsContact O-N 3.16Å; G146-M149 WeakPolarHBondContact O-CB 3.48Å; G146-M149 PolarHBondContact O-N 3.39Å; G146-M149 VanDerWaalsContact O-N 3.15Å; I147-M149 VanDerWaalsContact C-N 3.25Å; I147-M149 PolarHBondContact O-N 3.14Å; M149-E152 PolarHBondContact O-N 3.43Å; M149-L153 WeakPolarHBondContact O-CG 3.38Å; M149-L153 PolarHBondContact O-N 2.88Å; M149-L153 VanDerWaalsContact O-N 3.08Å; M149-Y257 HydrophobicContact CB-CD2 4.3Å; M149-Y257 HydrophobicContact CB-CE2 4.2Å; M149-D261 HydrophobicContact CE-CB 3.43Å; M149-D261 VanDerWaalsContact CE-CB 3.43Å; M149-D261 VanDerWaalsContact CE-CG 3.45Å; M149-D261 WeakPolarHBondContact CE-OD2 3.37Å; M149-D261 HydrophobicContact SD-CB 3.99Å
150	H	95.3	Very high	95.5	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.102	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-38.9	175.4	-68	-169.8	0	0	0	111.4	L27 F31 G146 I147 L153 V154 Y257	L27-H150 HydrophobicContact CD1-CB 4.14Å; L27-H150 PolarHBondContact O-CE1 3.1Å; F31-H150 AromaticContact CD1-CE1 3.99Å; F31-H150 AromaticContact CD2-CE1 2.74Å; F31-H150 WeakPolarHBondContact CD2-CE1 3.38Å; F31-H150 AromaticContact CD2-ND1 3.59Å; F31-H150 AromaticContact CE2-CE1 3.11Å; F31-H150 WeakPolarHBondContact CE2-CE1 3.48Å; F31-H150 AromaticContact CE2-ND1 3.33Å; F31-H150 VanDerWaalsContact CE2-ND1 3.33Å; F31-H150 WeakPolarHBondContact CE2-ND1 3.38Å; F31-H150 AromaticContact CG-CE1 3.26Å; F31-H150 WeakPolarHBondContact CG-CE1 3.3Å; F31-H150 AromaticContact CZ-CE1 3.86Å; G146-H150 PolarHBondContact O-CD2 2.98Å; G146-H150 PolarHBondContact O-N 3.05Å; I147-H150 PolarHBondContact O-N 2.96Å; I147-H150 VanDerWaalsContact O-N 3.16Å; H150-L153 PolarHBondContact O-N 3.36Å; H150-V154 WeakPolarHBondContact O-CB 3.35Å; H150-V154 VanDerWaalsContact O-CG2 3.31Å; H150-V154 WeakPolarHBondContact O-CG2 3.21Å; H150-V154 PolarHBondContact O-N 2.94Å; H150-Y257 AromaticContact CD2-CE2 3.98Å; H150-Y257 AromaticContact CD2-CZ 3.93Å; H150-Y257 PolarHBondContact CD2-OH 2.86Å; H150-Y257 AromaticContact NE2-CE2 3.6Å; H150-Y257 AromaticContact NE2-CZ 3.11Å; H150-Y257 PolarHBondContact NE2-OH 3.04Å
151	E	95.6	Very high	95.5	Very high	124 Å²	124	60.1 Å²	60.1	58%	0.579	29%	0.287	S	S	*	.	H	α-helix	trans	-61.8	-45.9	175.2	-75.4	-179.1	172.9	0	0	112	I147 V154 K155	I147-E151 HydrophobicContact CG2-CG 4.49Å; I147-E151 WeakPolarHBondContact O-CG 3.31Å; I147-E151 PolarHBondContact O-N 3.39Å; E151-V154 PolarHBondContact O-N 2.8Å; E151-K155 VanDerWaalsContact O-CB 3.25Å; E151-K155 WeakPolarHBondContact O-CB 3.44Å; E151-K155 PolarHBondContact O-N 3.03Å
152	E	95.1	Very high	95.4	Very high	85 Å²	85	58.1 Å²	58.1	40%	0.397	29%	0.285	S	S	.	.	H	α-helix	trans	-66	-37.3	176.4	-75.6	-66.1	146.2	0	0	112.7	Q148 M149 K155 V156	Q148-E152 PolarHBondContact O-N 3.42Å; Q148-E152 VanDerWaalsContact O-N 3.15Å; M149-E152 PolarHBondContact O-N 3.43Å; E152-K155 PolarHBondContact O-N 3.42Å; E152-K155 IonicContact OE1-NZ 3.53Å; E152-K155 PolarHBondContact OE1-NZ 3.16Å; E152-K155 IonicContact OE2-NZ 2.69Å; E152-K155 PolarHBondContact OE2-NZ 2.87Å; E152-V156 WeakPolarHBondContact O-CG2 3.46Å; E152-V156 PolarHBondContact O-N 3.04Å
153	L	95.7	Very high	95.5	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.037	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-44.7	171	-76.2	171.7	0	0	0	112.6	L27 M149 H150 K155 T157 V253 V254 Y257	L27-L153 HydrophobicContact CD1-CD1 4.06Å; L27-L153 HydrophobicContact CD2-CD1 3.88Å; M149-L153 WeakPolarHBondContact O-CG 3.38Å; M149-L153 PolarHBondContact O-N 2.88Å; M149-L153 VanDerWaalsContact O-N 3.08Å; H150-L153 PolarHBondContact O-N 3.36Å; L153-K155 VanDerWaalsContact C-N 3.31Å; L153-T157 WeakPolarHBondContact O-CB 3.3Å; L153-T157 WeakPolarHBondContact O-CG2 3.5Å; L153-T157 PolarHBondContact O-N 2.83Å; L153-T157 PolarHBondContact O-OG1 3.26Å; L153-V253 HydrophobicContact CD2-CG1 4.07Å; L153-V254 HydrophobicContact CD2-CG2 3.97Å; L153-Y257 HydrophobicContact CD1-CD1 3.67Å; L153-Y257 HydrophobicContact CD1-CD2 3.85Å; L153-Y257 HydrophobicContact CD1-CE1 3.98Å; L153-Y257 HydrophobicContact CD1-CE2 4.14Å; L153-Y257 HydrophobicContact CD1-CG 3.61Å; L153-Y257 HydrophobicContact CG-CG 4.45Å
154	V	94.5	Very high	95.5	Very high	43 Å²	43	56.5 Å²	56.5	26%	0.261	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-37.6	177.9	166.7	0	0	0	0	110.8	R24 H150 E151 T157 N158	R24-V154 HydrophobicContact CG-CG2 4.22Å; H150-V154 WeakPolarHBondContact O-CB 3.35Å; H150-V154 VanDerWaalsContact O-CG2 3.31Å; H150-V154 WeakPolarHBondContact O-CG2 3.21Å; H150-V154 PolarHBondContact O-N 2.94Å; E151-V154 PolarHBondContact O-N 2.8Å; V154-T157 WeakPolarHBondContact CA-OG1 3.41Å; V154-T157 PolarHBondContact O-OG1 3.44Å; V154-T157 VanDerWaalsContact O-OG1 3.06Å; V154-N158 WeakPolarHBondContact O-CB 3.29Å; V154-N158 PolarHBondContact O-N 3.21Å; V154-N158 PolarHBondContact O-ND2 2.98Å
155	K	96.3	Very high	95.5	Very high	91 Å²	91	56.7 Å²	56.7	40%	0.396	28%	0.279	S	S	.	.	H	α-helix	trans	-65	-54	175.1	171.9	176.8	156.2	-132.6	0	112.1	E151 E152 L153 T157 N158 E159	E151-K155 VanDerWaalsContact O-CB 3.25Å; E151-K155 WeakPolarHBondContact O-CB 3.44Å; E151-K155 PolarHBondContact O-N 3.03Å; E152-K155 PolarHBondContact O-N 3.42Å; E152-K155 IonicContact OE1-NZ 3.53Å; E152-K155 PolarHBondContact OE1-NZ 3.16Å; E152-K155 IonicContact OE2-NZ 2.69Å; E152-K155 PolarHBondContact OE2-NZ 2.87Å; L153-K155 VanDerWaalsContact C-N 3.31Å; K155-T157 VanDerWaalsContact C-N 3.31Å; K155-T157 PolarHBondContact O-N 2.82Å; K155-N158 CarbonylContact O-C 3.58Å; K155-N158 WeakPolarHBondContact O-CB 3.36Å; K155-N158 PolarHBondContact O-N 3.4Å; K155-N158 VanDerWaalsContact O-N 3.09Å; K155-E159 WeakPolarHBondContact CE-OE1 3.42Å; K155-E159 WeakPolarHBondContact CG-OE1 3.46Å; K155-E159 WeakPolarHBondContact O-CG 3.41Å; K155-E159 PolarHBondContact O-N 3.44Å
156	V	96.4	Very high	95.4	Very high	23 Å²	23	55.2 Å²	55.2	14%	0.139	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-35.1	-178.8	175.1	0	0	0	0	111.9	E152 E159 L160 T250	E152-V156 WeakPolarHBondContact O-CG2 3.46Å; E152-V156 PolarHBondContact O-N 3.04Å; V156-E159 PolarHBondContact O-N 2.7Å; V156-L160 PolarHBondContact O-N 2.8Å; V156-T250 HydrophobicContact CG1-CG2 4.1Å; V156-T250 WeakPolarHBondContact CG1-OG1 3.46Å
157	T	95.4	Very high	95.5	Very high	9 Å²	9	57.1 Å²	57.1	6%	0.055	28%	0.282	C	S	.	.	H	α-helix	trans	-69.1	-40.1	171.7	49.8	0	0	0	0	113	Y16 V20 L153 V154 K155 E159 L160 Y161 T250	Y16-T157 WeakPolarHBondContact OH-CA 3.29Å; Y16-T157 WeakPolarHBondContact OH-CB 3.44Å; Y16-T157 PolarHBondContact OH-O 3.28Å; V20-T157 HydrophobicContact CG2-CG2 4.32Å; L153-T157 WeakPolarHBondContact O-CB 3.3Å; L153-T157 WeakPolarHBondContact O-CG2 3.5Å; L153-T157 PolarHBondContact O-N 2.83Å; L153-T157 PolarHBondContact O-OG1 3.26Å; V154-T157 WeakPolarHBondContact CA-OG1 3.41Å; V154-T157 PolarHBondContact O-OG1 3.44Å; V154-T157 VanDerWaalsContact O-OG1 3.06Å; K155-T157 VanDerWaalsContact C-N 3.31Å; K155-T157 PolarHBondContact O-N 2.82Å; T157-E159 VanDerWaalsContact C-N 3.33Å; T157-E159 PolarHBondContact O-N 2.94Å; T157-L160 PolarHBondContact O-N 3.36Å; T157-Y161 PolarHBondContact O-N 3.13Å; T157-Y161 VanDerWaalsContact O-N 3.14Å; T157-T250 HydrophobicContact CG2-CG2 4.16Å
158	N	95	Very high	95.4	Very high	79 Å²	79	54.4 Å²	54.4	42%	0.422	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-37.2	172.1	-70.1	-28.5	0	0	0	112	R24 V154 K155 Y161 T162	R24-N158 PolarHBondContact NH2-OD1 2.88Å; V154-N158 WeakPolarHBondContact O-CB 3.29Å; V154-N158 PolarHBondContact O-N 3.21Å; V154-N158 PolarHBondContact O-ND2 2.98Å; K155-N158 CarbonylContact O-C 3.58Å; K155-N158 WeakPolarHBondContact O-CB 3.36Å; K155-N158 PolarHBondContact O-N 3.4Å; K155-N158 VanDerWaalsContact O-N 3.09Å; N158-Y161 WeakPolarHBondContact O-CB 3.35Å; N158-Y161 PolarHBondContact O-N 3.02Å; N158-T162 PolarHBondContact O-N 3.19Å
159	E	95.9	Very high	95.3	Very high	82 Å²	82	52.6 Å²	52.6	38%	0.383	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-50.7	174.9	-74	170.6	-169.5	0	0	110.7	K155 V156 T157 Y161 T162 V163	K155-E159 WeakPolarHBondContact CE-OE1 3.42Å; K155-E159 WeakPolarHBondContact CG-OE1 3.46Å; K155-E159 WeakPolarHBondContact O-CG 3.41Å; K155-E159 PolarHBondContact O-N 3.44Å; V156-E159 PolarHBondContact O-N 2.7Å; T157-E159 VanDerWaalsContact C-N 3.33Å; T157-E159 PolarHBondContact O-N 2.94Å; E159-Y161 VanDerWaalsContact C-N 3.27Å; E159-Y161 PolarHBondContact O-N 2.77Å; E159-T162 PolarHBondContact O-N 2.9Å; E159-T162 PolarHBondContact O-OG1 2.88Å; E159-V163 PolarHBondContact O-N 2.92Å
160	L	96.4	Very high	95.4	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-40.7	177.1	-178.1	59.7	0	0	0	112.8	Y16 V156 T157 T162 V163 M164 Y243 N246 L247 T250	Y16-L160 HydrophobicContact CE2-CD2 3.82Å; Y16-L160 HydrophobicContact CE2-CG 4.38Å; V156-L160 PolarHBondContact O-N 2.8Å; T157-L160 PolarHBondContact O-N 3.36Å; L160-T162 PolarHBondContact O-N 3.2Å; L160-V163 PolarHBondContact O-N 2.97Å; L160-M164 VanDerWaalsContact O-CB 3.32Å; L160-M164 WeakPolarHBondContact O-CB 3.34Å; L160-M164 PolarHBondContact O-N 2.91Å; L160-Y243 HydrophobicContact CD1-CD2 3.78Å; L160-Y243 HydrophobicContact CD1-CE2 3.63Å; L160-Y243 HydrophobicContact CG-CE2 4.42Å; L160-N246 HydrophobicContact CD1-CB 4.08Å; L160-L247 HydrophobicContact CD1-CB 4.03Å; L160-L247 HydrophobicContact CD1-CD1 4.49Å; L160-L247 HydrophobicContact CD2-CD1 3.9Å; L160-T250 HydrophobicContact CD2-CG2 3.84Å
161	Y	95.4	Very high	95.3	Very high	62 Å²	62	56.1 Å²	56.1	24%	0.243	27%	0.273	C	S	.	.	H	α-helix	trans	-56.6	-46	174.6	-177.2	-92.9	0	0	0	112.6	I13 Y16 E17 T157 N158 E159 M164 K165	I13-Y161 HydrophobicContact CG2-CE2 4.01Å; Y16-Y161 AromaticContact CD1-CD2 3.87Å; Y16-Y161 HydrophobicContact CD1-CD2 3.87Å; Y16-Y161 HydrophobicContact CE1-CD2 4.09Å; E17-Y161 HydrophobicContact CG-CE2 3.82Å; E17-Y161 WeakPolarHBondContact OE1-CE2 3.33Å; E17-Y161 VanDerWaalsContact OE1-CZ 3.3Å; E17-Y161 PolarHBondContact OE1-OH 3.11Å; T157-Y161 PolarHBondContact O-N 3.13Å; T157-Y161 VanDerWaalsContact O-N 3.14Å; N158-Y161 WeakPolarHBondContact O-CB 3.35Å; N158-Y161 PolarHBondContact O-N 3.02Å; E159-Y161 VanDerWaalsContact C-N 3.27Å; E159-Y161 PolarHBondContact O-N 2.77Å; Y161-M164 HydrophobicContact CD2-CE 4.48Å; Y161-K165 HydrophobicContact CE1-CD 4.26Å; Y161-K165 WeakPolarHBondContact O-CB 3.44Å; Y161-K165 PolarHBondContact O-N 2.65Å
162	T	95.9	Very high	95.2	Very high	80 Å²	80	54.3 Å²	54.3	49%	0.491	27%	0.271	S	S	.	.	H	α-helix	trans	-66.3	-40.1	-178.9	66.1	0	0	0	0	112.1	N158 E159 L160 T166	N158-T162 PolarHBondContact O-N 3.19Å; E159-T162 PolarHBondContact O-N 2.9Å; E159-T162 PolarHBondContact O-OG1 2.88Å; L160-T162 PolarHBondContact O-N 3.2Å; T162-T166 WeakPolarHBondContact O-CB 3.44Å; T162-T166 PolarHBondContact O-N 2.97Å; T162-T166 PolarHBondContact O-OG1 3.28Å
163	V	96.4	Very high	95.1	Very high	26 Å²	26	54.4 Å²	54.4	16%	0.158	27%	0.271	C	S	.	.	H	α-helix	trans	-71.5	-41.6	179.5	-171.8	0	0	0	0	110.9	E159 L160 K165 T166 Y167 D242	E159-V163 PolarHBondContact O-N 2.92Å; L160-V163 PolarHBondContact O-N 2.97Å; V163-K165 PolarHBondContact O-N 3.41Å; V163-T166 WeakPolarHBondContact O-CB 3.13Å; V163-T166 PolarHBondContact O-N 3.24Å; V163-Y167 PolarHBondContact O-N 2.92Å; V163-D242 HydrophobicContact CG1-CB 4.05Å
164	M	95.1	Very high	95	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-49.2	173.5	-177.5	175.9	61.2	0	0	111.9	I12 I13 Y16 L160 Y161 T166 Y167 H168 Y243	I12-M164 HydrophobicContact CG2-SD 3.92Å; I13-M164 HydrophobicContact CG1-CE 4.21Å; Y16-M164 HydrophobicContact CD1-CE 4.04Å; Y16-M164 HydrophobicContact CD2-CE 4.49Å; Y16-M164 HydrophobicContact CG-CE 3.87Å; L160-M164 VanDerWaalsContact O-CB 3.32Å; L160-M164 WeakPolarHBondContact O-CB 3.34Å; L160-M164 PolarHBondContact O-N 2.91Å; Y161-M164 HydrophobicContact CD2-CE 4.48Å; M164-T166 VanDerWaalsContact C-N 3.3Å; M164-T166 PolarHBondContact O-N 3.28Å; M164-Y167 WeakPolarHBondContact O-CB 3.29Å; M164-Y167 PolarHBondContact O-N 3.42Å; M164-H168 PolarHBondContact O-N 3Å; M164-Y243 HydrophobicContact CB-CD2 3.78Å; M164-Y243 HydrophobicContact CB-CE2 3.6Å; M164-Y243 HydrophobicContact CG-CD2 4.34Å; M164-Y243 HydrophobicContact CG-CE2 3.84Å; M164-Y243 HydrophobicContact SD-CE2 4.31Å
165	K	94.3	Very high	94.9	Very high	107 Å²	107	57 Å²	57	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-61.7	-38	178	-173.9	171.4	-177.2	171.8	0	112.3	Y161 V163 H168 M169	Y161-K165 HydrophobicContact CE1-CD 4.26Å; Y161-K165 WeakPolarHBondContact O-CB 3.44Å; Y161-K165 PolarHBondContact O-N 2.65Å; V163-K165 PolarHBondContact O-N 3.41Å; K165-H168 PolarHBondContact O-N 3.13Å; K165-M169 WeakPolarHBondContact O-CB 3.3Å; K165-M169 PolarHBondContact O-N 2.63Å
166	T	95	Very high	94.7	Very high	58 Å²	58	55 Å²	55	36%	0.356	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-41.1	175.4	-59.6	0	0	0	0	111.5	T162 V163 M164 Y170 A239	T162-T166 WeakPolarHBondContact O-CB 3.44Å; T162-T166 PolarHBondContact O-N 2.97Å; T162-T166 PolarHBondContact O-OG1 3.28Å; V163-T166 WeakPolarHBondContact O-CB 3.13Å; V163-T166 PolarHBondContact O-N 3.24Å; M164-T166 VanDerWaalsContact C-N 3.3Å; M164-T166 PolarHBondContact O-N 3.28Å; T166-Y170 HydrophobicContact CG2-CD2 3.95Å; T166-Y170 HydrophobicContact CG2-CE2 3.62Å; T166-Y170 WeakPolarHBondContact O-CD2 3.32Å; T166-Y170 PolarHBondContact O-N 3.12Å; T166-A239 HydrophobicContact CG2-CB 4.44Å
167	Y	95.8	Very high	94.5	Very high	40 Å²	40	54.4 Å²	54.4	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-49.2	172	163.1	-118.1	0	0	0	112.1	V163 M164 M169 Y170 H171 R240 Y243	V163-Y167 PolarHBondContact O-N 2.92Å; M164-Y167 WeakPolarHBondContact O-CB 3.29Å; M164-Y167 PolarHBondContact O-N 3.42Å; Y167-M169 VanDerWaalsContact C-N 3.3Å; Y167-M169 PolarHBondContact O-N 2.94Å; Y167-Y170 PolarHBondContact O-N 3.29Å; Y167-H171 HydrophobicContact CD2-CB 4.44Å; Y167-H171 HydrophobicContact CE2-CB 4.05Å; Y167-H171 VanDerWaalsContact O-CB 3.24Å; Y167-H171 WeakPolarHBondContact O-CB 2.98Å; Y167-H171 PolarHBondContact O-N 3.41Å; Y167-R240 HydrophobicContact CD2-CB 3.56Å; Y167-R240 HydrophobicContact CD2-CG 4.05Å; Y167-R240 HydrophobicContact CE2-CB 3.52Å; Y167-R240 HydrophobicContact CE2-CG 3.63Å; Y167-R240 HydrophobicContact CG-CB 4.42Å; Y167-Y243 HydrophobicContact CD1-CD1 4.08Å
168	H	94.3	Very high	94.3	Very high	17 Å²	17	56.6 Å²	56.6	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-38.3	179.6	-66.8	172.9	0	0	0	112.9	D9 M164 K165 T172	D9-H168 WeakPolarHBondContact OD1-CB 3.38Å; D9-H168 IonicContact OD1-CE1 2.67Å; D9-H168 IonicContact OD1-CG 3.92Å; D9-H168 IonicContact OD1-ND1 3.85Å; D9-H168 PolarHBondContact OD1-ND1 3.2Å; M164-H168 PolarHBondContact O-N 3Å; K165-H168 PolarHBondContact O-N 3.13Å; H168-T172 WeakPolarHBondContact O-CB 3.32Å; H168-T172 PolarHBondContact O-N 2.9Å; H168-T172 PolarHBondContact O-OG1 2.96Å
169	M	93.7	Very high	94.2	Very high	95 Å²	95	55.9 Å²	55.9	47%	0.468	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-58.1	173.9	-177.2	179.2	68.1	0	0	111.3	K165 Y167 H171 T172 E173	K165-M169 WeakPolarHBondContact O-CB 3.3Å; K165-M169 PolarHBondContact O-N 2.63Å; Y167-M169 VanDerWaalsContact C-N 3.3Å; Y167-M169 PolarHBondContact O-N 2.94Å; M169-H171 VanDerWaalsContact C-N 3.29Å; M169-H171 PolarHBondContact O-N 2.89Å; M169-T172 WeakPolarHBondContact O-CB 3.27Å; M169-T172 PolarHBondContact O-N 3Å; M169-T172 VanDerWaalsContact O-N 3.16Å; M169-E173 PolarHBondContact O-N 2.95Å
170	Y	95.4	Very high	94	Very high	72 Å²	72	57.4 Å²	57.4	28%	0.282	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-29	-179.3	-67.8	-48.5	0	0	0	113.4	T166 Y167 E173 S174 K235 A239	T166-Y170 HydrophobicContact CG2-CD2 3.95Å; T166-Y170 HydrophobicContact CG2-CE2 3.62Å; T166-Y170 WeakPolarHBondContact O-CD2 3.32Å; T166-Y170 PolarHBondContact O-N 3.12Å; Y167-Y170 PolarHBondContact O-N 3.29Å; Y170-E173 PolarHBondContact O-N 3.02Å; Y170-S174 VanDerWaalsContact O-CB 3.29Å; Y170-S174 WeakPolarHBondContact O-CB 3.48Å; Y170-S174 PolarHBondContact O-N 3.4Å; Y170-K235 HydrophobicContact CD1-CB 4.2Å; Y170-K235 HydrophobicContact CD1-CD 4.47Å; Y170-K235 HydrophobicContact CE1-CD 4.28Å; Y170-K235 HydrophobicContact CG-CB 4.19Å; Y170-A239 HydrophobicContact CD2-CB 3.79Å; Y170-A239 HydrophobicContact CE2-CB 4.47Å
171	H	94	Very high	93.7	Very high	72 Å²	72	57.5 Å²	57.5	33%	0.333	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-45.4	172.3	-170.6	63.3	0	0	0	111.3	Y167 M169 S174 I175	Y167-H171 HydrophobicContact CD2-CB 4.44Å; Y167-H171 HydrophobicContact CE2-CB 4.05Å; Y167-H171 VanDerWaalsContact O-CB 3.24Å; Y167-H171 WeakPolarHBondContact O-CB 2.98Å; Y167-H171 PolarHBondContact O-N 3.41Å; M169-H171 VanDerWaalsContact C-N 3.29Å; M169-H171 PolarHBondContact O-N 2.89Å; H171-S174 PolarHBondContact O-N 3.34Å; H171-I175 WeakPolarHBondContact O-CG1 3.35Å; H171-I175 PolarHBondContact O-N 3.13Å
172	T	93.1	Very high	93.4	Very high	87 Å²	87	59 Å²	59	53%	0.534	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-42.4	175	-57	0	0	0	0	111.6	H168 M169 S174 I175 S176	H168-T172 WeakPolarHBondContact O-CB 3.32Å; H168-T172 PolarHBondContact O-N 2.9Å; H168-T172 PolarHBondContact O-OG1 2.96Å; M169-T172 WeakPolarHBondContact O-CB 3.27Å; M169-T172 PolarHBondContact O-N 3Å; M169-T172 VanDerWaalsContact O-N 3.16Å; T172-S174 VanDerWaalsContact C-N 3.34Å; T172-S174 PolarHBondContact O-N 2.8Å; T172-I175 PolarHBondContact O-N 3.24Å; T172-S176 WeakPolarHBondContact O-CB 3.4Å; T172-S176 PolarHBondContact O-N 2.92Å
173	E	93.1	Very high	93	Very high	86 Å²	86	58.5 Å²	58.5	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-35.4	174.3	-68.8	-159.1	136.8	0	0	113.2	M169 Y170 A177 N232	M169-E173 PolarHBondContact O-N 2.95Å; Y170-E173 PolarHBondContact O-N 3.02Å; E173-A177 WeakPolarHBondContact O-CB 3.45Å; E173-A177 PolarHBondContact O-N 3.39Å; E173-N232 PolarHBondContact O-ND2 3.1Å; E173-N232 VanDerWaalsContact O-ND2 3.08Å
174	S	93.8	Very high	92.4	Very high	9 Å²	9	57.3 Å²	57.3	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-47	176	-174.7	0	0	0	0	111.3	Y170 H171 T172 S176 A177 E178	Y170-S174 VanDerWaalsContact O-CB 3.29Å; Y170-S174 WeakPolarHBondContact O-CB 3.48Å; Y170-S174 PolarHBondContact O-N 3.4Å; H171-S174 PolarHBondContact O-N 3.34Å; T172-S174 VanDerWaalsContact C-N 3.34Å; T172-S174 PolarHBondContact O-N 2.8Å; S174-S176 VanDerWaalsContact C-N 3.32Å; S174-S176 PolarHBondContact O-N 2.98Å; S174-A177 PolarHBondContact O-N 2.9Å; S174-E178 WeakPolarHBondContact O-CB 3.43Å; S174-E178 PolarHBondContact O-N 2.87Å
175	I	92.7	Very high	91.9	Very high	95 Å²	95	59.8 Å²	59.8	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-41.1	175.5	-68.7	168.6	0	0	0	110.8	H171 T172 A177 E178 S179	H171-I175 WeakPolarHBondContact O-CG1 3.35Å; H171-I175 PolarHBondContact O-N 3.13Å; T172-I175 PolarHBondContact O-N 3.24Å; I175-A177 VanDerWaalsContact C-N 3.34Å; I175-A177 PolarHBondContact O-N 3.3Å; I175-E178 PolarHBondContact O-N 3.34Å; I175-S179 PolarHBondContact O-N 2.89Å
176	S	92.3	Very high	91.4	Very high	50 Å²	50	59.7 Å²	59.7	35%	0.35	30%	0.301	S	S	.	.	H	α-helix	trans	-64	-37.8	176.8	-162.5	0	0	0	0	112.4	T172 S174 K180	T172-S176 WeakPolarHBondContact O-CB 3.4Å; T172-S176 PolarHBondContact O-N 2.92Å; S174-S176 VanDerWaalsContact C-N 3.32Å; S174-S176 PolarHBondContact O-N 2.98Å; S176-K180 VanDerWaalsContact O-CD 3.24Å; S176-K180 WeakPolarHBondContact O-CD 3.29Å; S176-K180 VanDerWaalsContact O-CG 3.27Å; S176-K180 WeakPolarHBondContact O-CG 3.29Å; S176-K180 PolarHBondContact O-N 2.86Å; S176-K180 PolarHBondContact OG-NZ 2.96Å
177	A	91.8	Very high	90.6	Very high	10 Å²	10	61.4 Å²	61.4	8%	0.083	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-39.6	172.9	0	0	0	0	0	112	E173 S174 I175 K180 L181 Y229 N232	E173-A177 WeakPolarHBondContact O-CB 3.45Å; E173-A177 PolarHBondContact O-N 3.39Å; S174-A177 PolarHBondContact O-N 2.9Å; I175-A177 VanDerWaalsContact C-N 3.34Å; I175-A177 PolarHBondContact O-N 3.3Å; A177-K180 PolarHBondContact O-N 3.37Å; A177-L181 WeakPolarHBondContact O-CB 3.47Å; A177-L181 PolarHBondContact O-N 2.85Å; A177-Y229 HydrophobicContact CB-CD2 4.35Å; A177-N232 HydrophobicContact CB-CB 4.39Å
178	E	92.4	Very high	89.5	Confident	56 Å²	56	61.5 Å²	61.5	26%	0.262	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-43.1	178.2	-160.6	174.4	125.4	0	0	112.5	S174 I175 L181 K182 Y229	S174-E178 WeakPolarHBondContact O-CB 3.43Å; S174-E178 PolarHBondContact O-N 2.87Å; I175-E178 PolarHBondContact O-N 3.34Å; E178-L181 PolarHBondContact O-N 3.14Å; E178-K182 HydrophobicContact CG-CD 4.43Å; E178-K182 WeakPolarHBondContact O-CG 3.42Å; E178-K182 PolarHBondContact O-N 2.75Å; E178-K182 WeakPolarHBondContact OE1-CE 3.4Å; E178-K182 IonicContact OE1-NZ 3.45Å; E178-K182 PolarHBondContact OE1-NZ 3.33Å; E178-Y229 HydrophobicContact CB-CD2 3.76Å; E178-Y229 HydrophobicContact CB-CE2 3.45Å; E178-Y229 VanDerWaalsContact CB-CE2 3.45Å; E178-Y229 VanDerWaalsContact CD-OH 3.32Å; E178-Y229 HydrophobicContact CG-CD2 4.15Å; E178-Y229 HydrophobicContact CG-CE2 3.52Å; E178-Y229 WeakPolarHBondContact OE2-CE2 3.45Å; E178-Y229 PolarHBondContact OE2-OH 3.14Å
179	S	91.9	Very high	88.5	Confident	63 Å²	63	66.1 Å²	66.1	44%	0.441	33%	0.328	S	S	.	.	H	α-helix	trans	-60.8	-47.6	174.2	-167.2	0	0	0	0	110.9	I175 L181 K182 D183	I175-S179 PolarHBondContact O-N 2.89Å; S179-L181 PolarHBondContact O-N 3.4Å; S179-K182 PolarHBondContact O-N 2.64Å; S179-K182 VanDerWaalsContact O-N 3.15Å; S179-D183 WeakPolarHBondContact O-CB 3.49Å; S179-D183 PolarHBondContact O-N 3.48Å; S179-D183 PolarHBondContact OG-OD2 3.05Å
180	K	91.4	Very high	87.2	Confident	115 Å²	115	68.8 Å²	68.8	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-31.7	179.8	-70.8	163	-174.4	149.7	0	112.4	S176 A177 A184 R225	S176-K180 VanDerWaalsContact O-CD 3.24Å; S176-K180 WeakPolarHBondContact O-CD 3.29Å; S176-K180 VanDerWaalsContact O-CG 3.27Å; S176-K180 WeakPolarHBondContact O-CG 3.29Å; S176-K180 PolarHBondContact O-N 2.86Å; S176-K180 PolarHBondContact OG-NZ 2.96Å; A177-K180 PolarHBondContact O-N 3.37Å; K180-A184 PolarHBondContact O-N 3.2Å; K180-R225 WeakPolarHBondContact O-CD 3.48Å
181	L	89.8	Confident	85.6	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-68.4	-51.9	171.2	173.9	60.1	0	0	0	111.3	A177 E178 S179 D183 A184 E185 K222 R225 Q226 Y229	A177-L181 WeakPolarHBondContact O-CB 3.47Å; A177-L181 PolarHBondContact O-N 2.85Å; E178-L181 PolarHBondContact O-N 3.14Å; S179-L181 PolarHBondContact O-N 3.4Å; L181-D183 PolarHBondContact O-N 3.44Å; L181-A184 CarbonylContact O-C 3.58Å; L181-A184 VanDerWaalsContact O-CA 3.31Å; L181-A184 WeakPolarHBondContact O-CA 3.29Å; L181-A184 WeakPolarHBondContact O-CB 3.43Å; L181-A184 PolarHBondContact O-N 3.17Å; L181-E185 HydrophobicContact CD1-CG 4.34Å; L181-E185 WeakPolarHBondContact O-CG 3.48Å; L181-E185 PolarHBondContact O-N 2.97Å; L181-K222 HydrophobicContact CD1-CG 4.23Å; L181-R225 HydrophobicContact CB-CB 4.49Å; L181-R225 HydrophobicContact CD1-CB 4.29Å; L181-Q226 HydrophobicContact CD1-CB 4.09Å; L181-Y229 HydrophobicContact CD2-CD1 3.53Å; L181-Y229 HydrophobicContact CD2-CE1 4.23Å; L181-Y229 HydrophobicContact CD2-CG 3.9Å
182	K	89.7	Confident	83.8	Confident	94 Å²	94	72.5 Å²	72.5	41%	0.409	36%	0.356	S	S	.	.	H	α-helix	trans	-60	-32.5	177.6	-71.1	174.8	-175.8	171.7	0	113.2	E178 S179 A184 E185 K186	E178-K182 HydrophobicContact CG-CD 4.43Å; E178-K182 WeakPolarHBondContact O-CG 3.42Å; E178-K182 PolarHBondContact O-N 2.75Å; E178-K182 WeakPolarHBondContact OE1-CE 3.4Å; E178-K182 IonicContact OE1-NZ 3.45Å; E178-K182 PolarHBondContact OE1-NZ 3.33Å; S179-K182 PolarHBondContact O-N 2.64Å; S179-K182 VanDerWaalsContact O-N 3.15Å; K182-A184 VanDerWaalsContact C-N 3.32Å; K182-E185 WeakPolarHBondContact CA-OE2 3.45Å; K182-K186 WeakPolarHBondContact O-CB 3.38Å; K182-K186 WeakPolarHBondContact O-CD 3.39Å; K182-K186 VanDerWaalsContact O-CG 3.24Å; K182-K186 WeakPolarHBondContact O-CG 3.39Å; K182-K186 PolarHBondContact O-N 3.42Å
183	D	87.3	Confident	81.9	Confident	68 Å²	68	72.7 Å²	72.7	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-75.1	-21.5	173.5	-62.9	-35.9	0	0	0	112.6	S179 L181 Q187	S179-D183 WeakPolarHBondContact O-CB 3.49Å; S179-D183 PolarHBondContact O-N 3.48Å; S179-D183 PolarHBondContact OG-OD2 3.05Å; L181-D183 PolarHBondContact O-N 3.44Å; D183-Q187 WeakPolarHBondContact O-CG 3.45Å; D183-Q187 PolarHBondContact O-N 3.45Å
184	A	84.4	Confident	79.9	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.008	38%	0.381	C	S	.	.	H	α-helix	trans	-75.1	-44.3	168.4	0	0	0	0	0	111.7	K180 L181 K182 Q187 E188 K222	K180-A184 PolarHBondContact O-N 3.2Å; L181-A184 CarbonylContact O-C 3.58Å; L181-A184 VanDerWaalsContact O-CA 3.31Å; L181-A184 WeakPolarHBondContact O-CA 3.29Å; L181-A184 WeakPolarHBondContact O-CB 3.43Å; L181-A184 PolarHBondContact O-N 3.17Å; K182-A184 VanDerWaalsContact C-N 3.32Å; A184-Q187 WeakPolarHBondContact O-CA 3.38Å; A184-Q187 WeakPolarHBondContact O-CB 3.41Å; A184-Q187 PolarHBondContact O-N 2.94Å; A184-E188 PolarHBondContact O-N 3.45Å; A184-K222 HydrophobicContact CB-CB 4.25Å
185	E	84.2	Confident	77.7	Confident	54 Å²	54	81.7 Å²	81.7	25%	0.252	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-48.1	178.1	-68.3	167.9	147.8	0	0	110.2	L181 K182 Q187 E188 E189 K222	L181-E185 HydrophobicContact CD1-CG 4.34Å; L181-E185 WeakPolarHBondContact O-CG 3.48Å; L181-E185 PolarHBondContact O-N 2.97Å; K182-E185 WeakPolarHBondContact CA-OE2 3.45Å; E185-Q187 PolarHBondContact O-N 2.79Å; E185-Q187 VanDerWaalsContact O-N 3.16Å; E185-E188 WeakPolarHBondContact O-CB 3.43Å; E185-E188 PolarHBondContact O-N 3.16Å; E185-E188 VanDerWaalsContact O-N 3.1Å; E185-E189 WeakPolarHBondContact O-CG 3.47Å; E185-E189 PolarHBondContact O-N 2.99Å; E185-K222 HydrophobicContact CG-CD 4.15Å; E185-K222 HydrophobicContact CG-CG 4.42Å
186	K	84.1	Confident	75.5	Confident	105 Å²	105	80.1 Å²	80.1	46%	0.457	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-21.4	172.2	-68.4	167.3	-171.9	169.9	0	114.4	K182 K190	K182-K186 WeakPolarHBondContact O-CB 3.38Å; K182-K186 WeakPolarHBondContact O-CD 3.39Å; K182-K186 VanDerWaalsContact O-CG 3.24Å; K182-K186 WeakPolarHBondContact O-CG 3.39Å; K182-K186 PolarHBondContact O-N 3.42Å; K186-K190 WeakPolarHBondContact O-CB 3.44Å; K186-K190 VanDerWaalsContact O-CD 3.28Å; K186-K190 WeakPolarHBondContact O-CD 3.27Å; K186-K190 WeakPolarHBondContact O-CG 3.48Å; K186-K190 PolarHBondContact O-N 3.34Å
187	Q	76.8	Confident	73.2	Confident	95 Å²	95	85.1 Å²	85.1	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-82.7	-33.6	174.9	-78.8	166.1	6.7	0	0	111.8	D183 A184 E185 Q191	D183-Q187 WeakPolarHBondContact O-CG 3.45Å; D183-Q187 PolarHBondContact O-N 3.45Å; A184-Q187 WeakPolarHBondContact O-CA 3.38Å; A184-Q187 WeakPolarHBondContact O-CB 3.41Å; A184-Q187 PolarHBondContact O-N 2.94Å; E185-Q187 PolarHBondContact O-N 2.79Å; E185-Q187 VanDerWaalsContact O-N 3.16Å; Q187-Q191 PolarHBondContact O-N 2.95Å
188	E	74.3	Confident	70.9	Confident	41 Å²	41	92.7 Å²	92.7	19%	0.192	48%	0.477	C	S	.	.	H	α-helix	trans	-68.8	-51.2	172.2	-179.7	-174	-117.2	0	0	110.9	A184 E185 K190 Q191 F192 I218 K222	A184-E188 PolarHBondContact O-N 3.45Å; E185-E188 WeakPolarHBondContact O-CB 3.43Å; E185-E188 PolarHBondContact O-N 3.16Å; E185-E188 VanDerWaalsContact O-N 3.1Å; E188-K190 VanDerWaalsContact C-N 3.31Å; E188-K190 PolarHBondContact O-N 3.47Å; E188-Q191 PolarHBondContact O-N 2.65Å; E188-F192 HydrophobicContact CG-CD2 4.23Å; E188-F192 HydrophobicContact CG-CE2 4.28Å; E188-F192 PolarHBondContact O-N 3.28Å; E188-I218 HydrophobicContact CB-CG2 4.06Å; E188-K222 WeakPolarHBondContact OE1-CD 3.41Å; E188-K222 IonicContact OE1-NZ 3.76Å; E188-K222 PolarHBondContact OE1-NZ 3.14Å; E188-K222 VanDerWaalsContact OE2-CD 3.31Å; E188-K222 WeakPolarHBondContact OE2-CD 3.48Å; E188-K222 WeakPolarHBondContact OE2-CE 3.47Å; E188-K222 IonicContact OE2-NZ 3.69Å; E188-K222 PolarHBondContact OE2-NZ 3.32Å
189	E	71.6	Confident	68.3	Low	115 Å²	115	97.1 Å²	97.1	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-50.9	-49.1	173.6	-71.8	173.2	162.5	0	0	111.4	E185 Q191 F192 S193	E185-E189 WeakPolarHBondContact O-CG 3.47Å; E185-E189 PolarHBondContact O-N 2.99Å; E189-Q191 PolarHBondContact O-N 3.21Å; E189-F192 PolarHBondContact O-N 2.95Å; E189-S193 PolarHBondContact O-N 2.97Å; E189-S193 PolarHBondContact O-OG 3.3Å
190	K	68.3	Low	65.9	Low	150 Å²	150	100 Å²	100	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-66	-16.4	179.2	-75.3	174.8	-174.6	-179.9	0	114.7	K186 E188	K186-K190 WeakPolarHBondContact O-CB 3.44Å; K186-K190 VanDerWaalsContact O-CD 3.28Å; K186-K190 WeakPolarHBondContact O-CD 3.27Å; K186-K190 WeakPolarHBondContact O-CG 3.48Å; K186-K190 PolarHBondContact O-N 3.34Å; E188-K190 VanDerWaalsContact C-N 3.31Å; E188-K190 PolarHBondContact O-N 3.47Å
191	Q	60.8	Low	63.2	Low	86 Å²	86	100.9 Å²	100.9	40%	0.402	53%	0.527	S	S	.	.	H	α-helix	trans	-85.5	-39.5	167.4	-71.5	-153.7	-7.8	0	0	112	Q187 E188 E189 K194 I218	Q187-Q191 PolarHBondContact O-N 2.95Å; E188-Q191 PolarHBondContact O-N 2.65Å; E189-Q191 PolarHBondContact O-N 3.21Å; Q191-K194 PolarHBondContact O-N 3.17Å; Q191-I218 VanDerWaalsContact CD-CD1 3.41Å; Q191-I218 HydrophobicContact CG-CD1 4.24Å
192	F	57	Low	60.9	Low	137 Å²	137	107.4 Å²	107.4	60%	0.601	56%	0.561	S	S	*	*	H	α-helix	trans	-66.8	-42.6	176.4	-87.2	-82.7	0	0	0	112.8	E188 E189 K194 S195	E188-F192 HydrophobicContact CG-CD2 4.23Å; E188-F192 HydrophobicContact CG-CE2 4.28Å; E188-F192 PolarHBondContact O-N 3.28Å; E189-F192 PolarHBondContact O-N 2.95Å; F192-K194 PolarHBondContact O-N 2.77Å; F192-K194 VanDerWaalsContact O-N 3.16Å; F192-S195 WeakPolarHBondContact O-CB 3.38Å; F192-S195 PolarHBondContact O-N 3.35Å; F192-S195 PolarHBondContact O-OG 2.9Å
193	S	52.8	Low	58.5	Low	90 Å²	90	110.2 Å²	110.2	63%	0.629	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-60.8	-25.9	176.5	-55.1	0	0	0	0	113.2	E189 S195	E189-S193 PolarHBondContact O-N 2.97Å; E189-S193 PolarHBondContact O-OG 3.3Å; S193-S195 PolarHBondContact O-N 3.23Å
194	K	51.8	Low	56.1	Low	195 Å²	195	119.1 Å²	119.1	85%	0.848	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-78.1	8.3	172.4	-80	-167.6	170.6	-170.2	0	114.6	Q191 F192	Q191-K194 PolarHBondContact O-N 3.17Å; F192-K194 PolarHBondContact O-N 2.77Å; F192-K194 VanDerWaalsContact O-N 3.16Å
195	S	46.8	Very low	54	Low	89 Å²	89	127 Å²	127	62%	0.622	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-116.9	0.5	175.5	69.1	0	0	0	0	114.7	F192 S193	F192-S195 WeakPolarHBondContact O-CB 3.38Å; F192-S195 PolarHBondContact O-N 3.35Å; F192-S195 PolarHBondContact O-OG 2.9Å; S193-S195 PolarHBondContact O-N 3.23Å
196	G	46.8	Very low	51.9	Low	62 Å²	62	132.2 Å²	132.2	64%	0.639	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-44.6	177.1	0	0	0	0	0	113.9	L198	G196-L198 PolarHBondContact O-N 2.83Å
197	D	43.3	Very low	49.8	Very low	156 Å²	156	134.1 Å²	134.1	83%	0.834	68%	0.684	S	S	*	*	S	Bend	trans	-81.8	78.5	-177.9	-69.2	-39.5	0	0	0	112.3
198	L	44.2	Very low	48.4	Very low	169 Å²	169	141.1 Å²	141.1	89%	0.885	71%	0.706	S	S	*	*			trans	174	92.2	143.5	-98.2	159.9	0	0	0	111.9	G196	G196-L198 PolarHBondContact O-N 2.83Å
199	N	37.7	Very low	47	Very low	149 Å²	149	147.2 Å²	147.2	80%	0.797	74%	0.735	S	S	*	*			trans	-156.5	87.3	143.4	-168.3	14	0	0	0	113.4
200	V	40.3	Very low	45.8	Very low	124 Å²	124	146.2 Å²	146.2	75%	0.752	74%	0.738	S	S	*	*	S	Bend	trans	-129.5	108.8	141.6	177	0	0	0	0	107.7
201	N	35	Very low	44.8	Very low	132 Å²	132	149.6 Å²	149.6	71%	0.706	75%	0.747	S	S	*	*	S	Bend	trans	76.9	128.9	161.2	-66.9	-19.1	0	0	0	121.8
202	L	41.6	Very low	44.5	Very low	144 Å²	144	155.2 Å²	155.2	75%	0.754	76%	0.764	S	S	*	*			trans	79.7	111.2	144.4	-94.8	66	0	0	0	122.7
203	L	39.9	Very low	44.7	Very low	152 Å²	152	152.4 Å²	152.4	80%	0.796	76%	0.762	S	S	*	*			trans	51.8	100.3	130.2	-64.5	171.6	0	0	0	120.7
204	R	35.9	Very low	44.9	Very low	255 Å²	255	150.4 Å²	150.4	96%	0.962	75%	0.748	S	S	*	*				-174.6	-177.3	101.9	-103.5	-176.2	174.4	-163.5	-1.7	113.1
205	H	41.3	Very low	45.6	Very low	167 Å²	167	143 Å²	143	77%	0.773	72%	0.723	S	S	*	*			trans	-91.4	174.7	-164.3	-128.2	-92.2	0	0	0	114.4
206	E	39.7	Very low	46.8	Very low	164 Å²	164	147 Å²	147	77%	0.766	73%	0.725	S	S	*	*			trans	53.7	88.1	162.7	-56.8	-57.7	87.8	0	0	117.5
207	D	40.4	Very low	48.2	Very low	145 Å²	145	151.5 Å²	151.5	78%	0.775	73%	0.727	S	S	*	*				174.6	117.9	109.9	-153.8	-20.6	0	0	0	110.3
208	R	47.9	Very low	49.7	Very low	241 Å²	241	145.4 Å²	145.4	91%	0.909	69%	0.694	S	S	*	*			trans	-147	34	-165.4	-140.5	178	-169.5	-174.9	4.6	117.8
209	Q	43.5	Very low	51.4	Low	170 Å²	170	142.8 Å²	142.8	79%	0.794	68%	0.677	S	S	*	*	S	Bend	trans	-106.7	-34.3	173	-65.4	-145.8	4.7	0	0	117.8	R211	Q209-R211 VanDerWaalsContact C-N 3.34Å; Q209-R211 PolarHBondContact O-N 3.5Å; Q209-R211 VanDerWaalsContact O-N 3.16Å
210	P	46.2	Very low	53.5	Low	93 Å²	93	142.9 Å²	142.9	60%	0.604	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-30.6	-170.4	-27.9	35.4	0	0	0	116.3	S213	P210-S213 PolarHBondContact O-OG 2.9Å; P210-S213 VanDerWaalsContact O-OG 3.1Å
211	R	48.6	Very low	55.5	Low	222 Å²	222	140.1 Å²	140.1	84%	0.838	65%	0.65	S	S	*	*	H	α-helix	trans	-85.2	-12.8	-169.1	-69.9	-178.5	176.4	165.4	0.2	115.6	Q209 S214	Q209-R211 VanDerWaalsContact C-N 3.34Å; Q209-R211 PolarHBondContact O-N 3.5Å; Q209-R211 VanDerWaalsContact O-N 3.16Å; R211-S214 PolarHBondContact O-OG 3.09Å
212	R	54.2	Low	57.9	Low	203 Å²	203	136.4 Å²	136.4	77%	0.766	63%	0.628	S	S	*	*	H	α-helix	trans	-82.4	-19.1	179.2	-109.8	-180	174.7	177	-2	113.7
213	S	59.8	Low	60.2	Low	79 Å²	79	135.8 Å²	135.8	55%	0.552	62%	0.621	S	S	*	*	H	α-helix	trans	-81.6	-36.3	-178.9	61.5	0	0	0	0	112.9	P210 K217	P210-S213 PolarHBondContact O-OG 2.9Å; P210-S213 VanDerWaalsContact O-OG 3.1Å; S213-K217 WeakPolarHBondContact O-CB 3.49Å; S213-K217 PolarHBondContact O-N 2.87Å
214	S	58.8	Low	62.5	Low	47 Å²	47	136.4 Å²	136.4	33%	0.329	62%	0.617	S	S	.	*	H	α-helix	trans	-66.5	-43	178.6	57	0	0	0	0	112.5	R211 K217 I218	R211-S214 PolarHBondContact O-OG 3.09Å; S214-K217 PolarHBondContact O-N 3.05Å; S214-I218 PolarHBondContact O-N 3.11Å; S214-I218 VanDerWaalsContact O-N 3.1Å
215	A	65.3	Low	65.1	Low	41 Å²	41	127.9 Å²	127.9	34%	0.339	59%	0.585	S	S	.	*	H	α-helix	trans	-59.7	-54.3	176.7	0	0	0	0	0	110.9	K217 I218 E219	A215-K217 PolarHBondContact O-N 3.03Å; A215-K217 VanDerWaalsContact O-N 3.17Å; A215-I218 PolarHBondContact O-N 3.23Å; A215-E219 WeakPolarHBondContact O-CB 3.36Å; A215-E219 PolarHBondContact O-N 3.09Å
216	R	72.5	Confident	67.4	Low	173 Å²	173	123.4 Å²	123.4	65%	0.653	56%	0.564	S	S	*	*	H	α-helix	trans	-57.1	-31.1	175.6	-75.7	179.1	167.7	-176	-4.5	113.7	K220	R216-K220 VanDerWaalsContact O-CB 3.28Å; R216-K220 WeakPolarHBondContact O-CB 3.43Å; R216-K220 PolarHBondContact O-N 2.83Å
217	K	76.3	Confident	69.9	Low	156 Å²	156	118.5 Å²	118.5	68%	0.678	55%	0.552	S	S	*	*	H	α-helix	trans	-73	-30.3	176.1	-172.5	175	-179.8	178.9	0	112.6	S213 S214 A215 M221	S213-K217 WeakPolarHBondContact O-CB 3.49Å; S213-K217 PolarHBondContact O-N 2.87Å; S214-K217 PolarHBondContact O-N 3.05Å; A215-K217 PolarHBondContact O-N 3.03Å; A215-K217 VanDerWaalsContact O-N 3.17Å; K217-M221 WeakPolarHBondContact O-CB 3.37Å; K217-M221 PolarHBondContact O-N 2.78Å
218	I	75.1	Confident	72.4	Confident	28 Å²	28	117.4 Å²	117.4	14%	0.144	54%	0.541	C	S	.	.	H	α-helix	trans	-82.8	-42	175.5	-73.5	164.1	0	0	0	110.9	E188 Q191 S214 A215 K220 M221 K222	E188-I218 HydrophobicContact CB-CG2 4.06Å; Q191-I218 VanDerWaalsContact CD-CD1 3.41Å; Q191-I218 HydrophobicContact CG-CD1 4.24Å; S214-I218 PolarHBondContact O-N 3.11Å; S214-I218 VanDerWaalsContact O-N 3.1Å; A215-I218 PolarHBondContact O-N 3.23Å; I218-K220 PolarHBondContact O-N 2.8Å; I218-M221 CarbonylContact O-C 3.59Å; I218-M221 WeakPolarHBondContact O-CA 3.36Å; I218-M221 VanDerWaalsContact O-CB 3.31Å; I218-M221 WeakPolarHBondContact O-CB 3.27Å; I218-M221 PolarHBondContact O-N 3.46Å; I218-K222 PolarHBondContact O-N 2.9Å
219	E	79.1	Confident	74.5	Confident	114 Å²	114	107.1 Å²	107.1	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-50.8	-53.8	169.9	-178.3	178.6	-147.5	0	0	110.9	A215 M221 K222 E223	A215-E219 WeakPolarHBondContact O-CB 3.36Å; A215-E219 PolarHBondContact O-N 3.09Å; E219-M221 VanDerWaalsContact C-N 3.25Å; E219-M221 PolarHBondContact O-N 2.89Å; E219-K222 WeakPolarHBondContact O-CB 3.38Å; E219-K222 PolarHBondContact O-N 3.07Å; E219-E223 WeakPolarHBondContact O-CB 3.49Å; E219-E223 PolarHBondContact O-N 2.84Å
220	K	83	Confident	76.9	Confident	150 Å²	150	102 Å²	102	65%	0.652	48%	0.484	S	S	*	.	H	α-helix	trans	-65.9	-22.3	175	-168.7	164.1	-172.4	165.9	0	114.1	R216 I218 K224	R216-K220 VanDerWaalsContact O-CB 3.28Å; R216-K220 WeakPolarHBondContact O-CB 3.43Å; R216-K220 PolarHBondContact O-N 2.83Å; I218-K220 PolarHBondContact O-N 2.8Å; K220-K224 WeakPolarHBondContact O-CB 3.14Å; K220-K224 PolarHBondContact O-N 2.93Å
221	M	82.5	Confident	79.2	Confident	66 Å²	66	102 Å²	102	33%	0.325	48%	0.477	S	S	.	.	H	α-helix	trans	-78.2	-40.2	173.7	-168.9	-170.7	-51.5	0	0	111.5	K217 I218 E219 R225	K217-M221 WeakPolarHBondContact O-CB 3.37Å; K217-M221 PolarHBondContact O-N 2.78Å; I218-M221 CarbonylContact O-C 3.59Å; I218-M221 WeakPolarHBondContact O-CA 3.36Å; I218-M221 VanDerWaalsContact O-CB 3.31Å; I218-M221 WeakPolarHBondContact O-CB 3.27Å; I218-M221 PolarHBondContact O-N 3.46Å; E219-M221 VanDerWaalsContact C-N 3.25Å; E219-M221 PolarHBondContact O-N 2.89Å; M221-R225 WeakPolarHBondContact O-CB 3.39Å; M221-R225 WeakPolarHBondContact O-CD 3.41Å; M221-R225 VanDerWaalsContact O-CG 3.26Å; M221-R225 WeakPolarHBondContact O-CG 3.42Å; M221-R225 PolarHBondContact O-N 3.26Å; M221-R225 VanDerWaalsContact SD-CZ 3.52Å; M221-R225 PolarHBondContact SD-NH2 2.9Å
222	K	85.1	Confident	81.3	Confident	55 Å²	55	91.9 Å²	91.9	24%	0.239	44%	0.439	C	S	.	.	H	α-helix	trans	-62.9	-49.9	171.2	174.9	-177.3	170.8	-178	0	110.1	L181 A184 E185 E188 I218 E219 K224 R225 Q226	L181-K222 HydrophobicContact CD1-CG 4.23Å; A184-K222 HydrophobicContact CB-CB 4.25Å; E185-K222 HydrophobicContact CG-CD 4.15Å; E185-K222 HydrophobicContact CG-CG 4.42Å; E188-K222 WeakPolarHBondContact OE1-CD 3.41Å; E188-K222 IonicContact OE1-NZ 3.76Å; E188-K222 PolarHBondContact OE1-NZ 3.14Å; E188-K222 VanDerWaalsContact OE2-CD 3.31Å; E188-K222 WeakPolarHBondContact OE2-CD 3.48Å; E188-K222 WeakPolarHBondContact OE2-CE 3.47Å; E188-K222 IonicContact OE2-NZ 3.69Å; E188-K222 PolarHBondContact OE2-NZ 3.32Å; I218-K222 PolarHBondContact O-N 2.9Å; E219-K222 WeakPolarHBondContact O-CB 3.38Å; E219-K222 PolarHBondContact O-N 3.07Å; K222-K224 PolarHBondContact O-N 2.87Å; K222-R225 CarbonylContact O-C 3.52Å; K222-R225 WeakPolarHBondContact O-CA 3.17Å; K222-R225 WeakPolarHBondContact O-CB 3.46Å; K222-R225 PolarHBondContact O-N 3.4Å; K222-Q226 WeakPolarHBondContact O-CB 3.18Å; K222-Q226 PolarHBondContact O-N 3.18Å
223	E	88.4	Confident	83.2	Confident	130 Å²	130	87.1 Å²	87.1	61%	0.607	42%	0.424	S	S	*	.	H	α-helix	trans	-52.8	-49.1	174.9	-175.8	-171.8	-150.1	0	0	111.9	E219 R225 Q226 A227	E219-E223 WeakPolarHBondContact O-CB 3.49Å; E219-E223 PolarHBondContact O-N 2.84Å; E223-R225 VanDerWaalsContact C-N 3.31Å; E223-R225 PolarHBondContact O-N 2.94Å; E223-Q226 WeakPolarHBondContact O-CB 3.46Å; E223-Q226 PolarHBondContact O-N 2.74Å; E223-A227 PolarHBondContact O-N 3.16Å
224	K	89.1	Confident	84.9	Confident	166 Å²	166	88.2 Å²	88.2	72%	0.722	42%	0.423	S	S	*	.	H	α-helix	trans	-63.7	-33.3	176.6	-174.2	170.1	-178.1	173.3	0	113.2	K220 K222 K228	K220-K224 WeakPolarHBondContact O-CB 3.14Å; K220-K224 PolarHBondContact O-N 2.93Å; K222-K224 PolarHBondContact O-N 2.87Å; K224-K228 PolarHBondContact O-N 2.73Å
225	R	89.8	Confident	86.7	Confident	76 Å²	76	89.6 Å²	89.6	29%	0.287	42%	0.423	S	S	.	.	H	α-helix	trans	-75.1	-36.5	174.8	-72.9	167.5	174.4	171.6	5.7	111.8	K180 L181 M221 K222 E223 K228 Y229	K180-R225 WeakPolarHBondContact O-CD 3.48Å; L181-R225 HydrophobicContact CB-CB 4.49Å; L181-R225 HydrophobicContact CD1-CB 4.29Å; M221-R225 WeakPolarHBondContact O-CB 3.39Å; M221-R225 WeakPolarHBondContact O-CD 3.41Å; M221-R225 VanDerWaalsContact O-CG 3.26Å; M221-R225 WeakPolarHBondContact O-CG 3.42Å; M221-R225 PolarHBondContact O-N 3.26Å; M221-R225 VanDerWaalsContact SD-CZ 3.52Å; M221-R225 PolarHBondContact SD-NH2 2.9Å; K222-R225 CarbonylContact O-C 3.52Å; K222-R225 WeakPolarHBondContact O-CA 3.17Å; K222-R225 WeakPolarHBondContact O-CB 3.46Å; K222-R225 PolarHBondContact O-N 3.4Å; E223-R225 VanDerWaalsContact C-N 3.31Å; E223-R225 PolarHBondContact O-N 2.94Å; R225-K228 PolarHBondContact O-N 3.42Å; R225-Y229 WeakPolarHBondContact O-CB 3.31Å; R225-Y229 PolarHBondContact O-N 3.19Å
226	Q	91.1	Very high	88.2	Confident	72 Å²	72	88.1 Å²	88.1	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-63.4	-47.5	174.7	179	64.2	66.2	0	0	110.9	L181 K222 E223 K228 Y229 S230	L181-Q226 HydrophobicContact CD1-CB 4.09Å; K222-Q226 WeakPolarHBondContact O-CB 3.18Å; K222-Q226 PolarHBondContact O-N 3.18Å; E223-Q226 WeakPolarHBondContact O-CB 3.46Å; E223-Q226 PolarHBondContact O-N 2.74Å; Q226-K228 PolarHBondContact O-N 3.17Å; Q226-Y229 PolarHBondContact O-N 3.04Å; Q226-S230 PolarHBondContact NE2-OG 3.01Å; Q226-S230 PolarHBondContact O-N 3.34Å; Q226-S230 PolarHBondContact O-OG 3.2Å; Q226-S230 VanDerWaalsContact O-OG 3.14Å
227	A	91.8	Very high	89.3	Confident	62 Å²	62	82.3 Å²	82.3	51%	0.512	39%	0.394	S	S	.	.	H	α-helix	trans	-58.4	-47.5	175.5	0	0	0	0	0	111.6	E223 Y229 S230 E231	E223-A227 PolarHBondContact O-N 3.16Å; A227-Y229 PolarHBondContact O-N 3.3Å; A227-S230 PolarHBondContact O-N 3.36Å; A227-E231 WeakPolarHBondContact O-CB 3.47Å; A227-E231 PolarHBondContact O-N 3.16Å
228	K	91.9	Very high	90.2	Very high	122 Å²	122	81 Å²	81	53%	0.53	39%	0.389	S	S	.	.	H	α-helix	trans	-67.5	-33.3	177.5	-175.7	159.5	-174.9	161.6	0	113.3	K224 R225 Q226 N232	K224-K228 PolarHBondContact O-N 2.73Å; R225-K228 PolarHBondContact O-N 3.42Å; Q226-K228 PolarHBondContact O-N 3.17Å; K228-N232 WeakPolarHBondContact O-CB 3.18Å; K228-N232 PolarHBondContact O-N 2.85Å
229	Y	93.1	Very high	91.3	Very high	24 Å²	24	80 Å²	80	9%	0.094	38%	0.384	C	S	.	.	H	α-helix	trans	-65.4	-47.7	171.6	170.3	-116.3	0	0	0	111.2	A177 E178 L181 R225 Q226 A227 E231 N232 K233	A177-Y229 HydrophobicContact CB-CD2 4.35Å; E178-Y229 HydrophobicContact CB-CD2 3.76Å; E178-Y229 HydrophobicContact CB-CE2 3.45Å; E178-Y229 VanDerWaalsContact CB-CE2 3.45Å; E178-Y229 VanDerWaalsContact CD-OH 3.32Å; E178-Y229 HydrophobicContact CG-CD2 4.15Å; E178-Y229 HydrophobicContact CG-CE2 3.52Å; E178-Y229 WeakPolarHBondContact OE2-CE2 3.45Å; E178-Y229 PolarHBondContact OE2-OH 3.14Å; L181-Y229 HydrophobicContact CD2-CD1 3.53Å; L181-Y229 HydrophobicContact CD2-CE1 4.23Å; L181-Y229 HydrophobicContact CD2-CG 3.9Å; R225-Y229 WeakPolarHBondContact O-CB 3.31Å; R225-Y229 PolarHBondContact O-N 3.19Å; Q226-Y229 PolarHBondContact O-N 3.04Å; A227-Y229 PolarHBondContact O-N 3.3Å; Y229-E231 VanDerWaalsContact C-N 3.32Å; Y229-E231 PolarHBondContact O-N 2.93Å; Y229-N232 PolarHBondContact O-N 3.36Å; Y229-K233 HydrophobicContact CE1-CD 4.04Å; Y229-K233 HydrophobicContact CE2-CB 4.44Å; Y229-K233 HydrophobicContact CE2-CD 4.21Å; Y229-K233 WeakPolarHBondContact O-CB 3.28Å; Y229-K233 PolarHBondContact O-N 3.33Å; Y229-K233 PolarHBondContact OH-NZ 2.79Å
230	S	93	Very high	92.1	Very high	62 Å²	62	79.7 Å²	79.7	43%	0.434	38%	0.378	S	S	.	.	H	α-helix	trans	-59.2	-41.2	176	-63	0	0	0	0	112.2	Q226 A227 L234	Q226-S230 PolarHBondContact NE2-OG 3.01Å; Q226-S230 PolarHBondContact O-N 3.34Å; Q226-S230 PolarHBondContact O-OG 3.2Å; Q226-S230 VanDerWaalsContact O-OG 3.14Å; A227-S230 PolarHBondContact O-N 3.36Å; S230-L234 WeakPolarHBondContact O-CB 3.28Å; S230-L234 PolarHBondContact O-N 3.33Å
231	E	93.8	Very high	92.8	Very high	95 Å²	95	76 Å²	76	44%	0.444	37%	0.366	S	S	.	.	H	α-helix	trans	-61.9	-52.8	174.8	-170.1	-162.5	163	0	0	112	A227 Y229 K233 L234 K235	A227-E231 WeakPolarHBondContact O-CB 3.47Å; A227-E231 PolarHBondContact O-N 3.16Å; Y229-E231 VanDerWaalsContact C-N 3.32Å; Y229-E231 PolarHBondContact O-N 2.93Å; E231-K233 VanDerWaalsContact C-N 3.33Å; E231-K233 PolarHBondContact O-N 3.16Å; E231-L234 PolarHBondContact O-N 3.06Å; E231-K235 WeakPolarHBondContact O-CG 3.47Å; E231-K235 PolarHBondContact O-N 3.47Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.41Å; E231-K235 IonicContact OE1-NZ 2.9Å; E231-K235 PolarHBondContact OE1-NZ 3.49Å
232	N	94	Very high	93.5	Very high	9 Å²	9	76.5 Å²	76.5	5%	0.048	37%	0.37	C	S	.	.	H	α-helix	trans	-65.3	-36.1	179.9	-78.2	14.7	0	0	0	112	E173 A177 K228 Y229 K235 C236	E173-N232 PolarHBondContact O-ND2 3.1Å; E173-N232 VanDerWaalsContact O-ND2 3.08Å; A177-N232 HydrophobicContact CB-CB 4.39Å; K228-N232 WeakPolarHBondContact O-CB 3.18Å; K228-N232 PolarHBondContact O-N 2.85Å; Y229-N232 PolarHBondContact O-N 3.36Å; N232-K235 PolarHBondContact O-N 3.23Å; N232-C236 VanDerWaalsContact O-CB 3.31Å; N232-C236 WeakPolarHBondContact O-CB 3.33Å; N232-C236 PolarHBondContact O-N 3.31Å
233	K	94.4	Very high	94.1	Very high	102 Å²	102	75.9 Å²	75.9	44%	0.443	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-40.1	175.7	-169.7	174.4	-165.8	164.6	0	111.6	Y229 E231 C236 T237	Y229-K233 HydrophobicContact CE1-CD 4.04Å; Y229-K233 HydrophobicContact CE2-CB 4.44Å; Y229-K233 HydrophobicContact CE2-CD 4.21Å; Y229-K233 WeakPolarHBondContact O-CB 3.28Å; Y229-K233 PolarHBondContact O-N 3.33Å; Y229-K233 PolarHBondContact OH-NZ 2.79Å; E231-K233 VanDerWaalsContact C-N 3.33Å; E231-K233 PolarHBondContact O-N 3.16Å; K233-C236 PolarHBondContact O-N 2.9Å; K233-T237 WeakPolarHBondContact O-CB 3.36Å; K233-T237 PolarHBondContact O-N 2.94Å; K233-T237 PolarHBondContact O-OG1 3.12Å
234	L	95	Very high	94.5	Very high	102 Å²	102	74 Å²	74	53%	0.534	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-44	173.8	-178.5	59.9	0	0	0	111.8	S230 E231 T237 K238	S230-L234 WeakPolarHBondContact O-CB 3.28Å; S230-L234 PolarHBondContact O-N 3.33Å; E231-L234 PolarHBondContact O-N 3.06Å; L234-T237 PolarHBondContact O-N 3.07Å; L234-K238 WeakPolarHBondContact O-CG 3.35Å; L234-K238 PolarHBondContact O-N 2.98Å
235	K	95.8	Very high	94.9	Very high	76 Å²	76	71.9 Å²	71.9	33%	0.33	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-46.7	173.9	-69.6	175.4	-172.7	168.7	0	111.8	Y170 E231 N232 T237 K238 A239	Y170-K235 HydrophobicContact CD1-CB 4.2Å; Y170-K235 HydrophobicContact CD1-CD 4.47Å; Y170-K235 HydrophobicContact CE1-CD 4.28Å; Y170-K235 HydrophobicContact CG-CB 4.19Å; E231-K235 WeakPolarHBondContact O-CG 3.47Å; E231-K235 PolarHBondContact O-N 3.47Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.41Å; E231-K235 IonicContact OE1-NZ 2.9Å; E231-K235 PolarHBondContact OE1-NZ 3.49Å; N232-K235 PolarHBondContact O-N 3.23Å; K235-T237 VanDerWaalsContact C-N 3.32Å; K235-T237 PolarHBondContact O-N 3.38Å; K235-K238 PolarHBondContact O-N 2.91Å; K235-A239 PolarHBondContact O-N 3.26Å
236	C	96.3	Very high	95.3	Very high	11 Å²	11	70.6 Å²	70.6	7%	0.074	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-40.1	174.5	175.3	0	0	0	0	112.3	N232 K233 R240	N232-C236 VanDerWaalsContact O-CB 3.31Å; N232-C236 WeakPolarHBondContact O-CB 3.33Å; N232-C236 PolarHBondContact O-N 3.31Å; K233-C236 PolarHBondContact O-N 2.9Å; C236-R240 WeakPolarHBondContact O-CB 3.35Å; C236-R240 PolarHBondContact O-N 2.94Å
237	T	95.7	Very high	95.6	Very high	51 Å²	51	69.4 Å²	69.4	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-68.2	-41.4	177.7	-62.9	0	0	0	0	112	K233 L234 K235 N241	K233-T237 WeakPolarHBondContact O-CB 3.36Å; K233-T237 PolarHBondContact O-N 2.94Å; K233-T237 PolarHBondContact O-OG1 3.12Å; L234-T237 PolarHBondContact O-N 3.07Å; K235-T237 VanDerWaalsContact C-N 3.32Å; K235-T237 PolarHBondContact O-N 3.38Å; T237-N241 PolarHBondContact O-N 2.95Å; T237-N241 PolarHBondContact O-OD1 2.77Å; T237-N241 VanDerWaalsContact O-OD1 3.12Å
238	K	96.8	Very high	95.9	Very high	128 Å²	128	69.4 Å²	69.4	56%	0.557	35%	0.35	S	S	*	.	H	α-helix	trans	-59.9	-59.5	173.8	-71.9	-174.8	176.3	-167.5	0	111.2	L234 K235 R240 N241 D242	L234-K238 WeakPolarHBondContact O-CG 3.35Å; L234-K238 PolarHBondContact O-N 2.98Å; K235-K238 PolarHBondContact O-N 2.91Å; K238-R240 PolarHBondContact O-N 2.59Å; K238-R240 VanDerWaalsContact O-N 3.12Å; K238-N241 WeakPolarHBondContact O-CA 3.49Å; K238-N241 WeakPolarHBondContact O-CB 3.23Å; K238-N241 PolarHBondContact O-N 3.07Å; K238-D242 VanDerWaalsContact C-OD2 3.26Å; K238-D242 PolarHBondContact O-N 2.99Å; K238-D242 VanDerWaalsContact O-OD2 3.06Å
239	A	96.6	Very high	96.2	Very high	6 Å²	6	66 Å²	66	5%	0.05	35%	0.345	C	S	.	.	H	α-helix	trans	-59.3	-30.4	-178.7	0	0	0	0	0	113.6	T166 Y170 K235 D242 Y243	T166-A239 HydrophobicContact CG2-CB 4.44Å; Y170-A239 HydrophobicContact CD2-CB 3.79Å; Y170-A239 HydrophobicContact CE2-CB 4.47Å; K235-A239 PolarHBondContact O-N 3.26Å; A239-D242 WeakPolarHBondContact CA-OD2 3.2Å; A239-Y243 VanDerWaalsContact O-CB 3.29Å; A239-Y243 WeakPolarHBondContact O-CB 3.46Å; A239-Y243 PolarHBondContact O-N 2.91Å
240	R	97.3	Very high	96.4	Very high	109 Å²	109	65.2 Å²	65.2	41%	0.411	34%	0.342	S	S	.	.	H	α-helix	trans	-68	-42	171.7	-170.5	-170.2	64.5	173.5	0.1	112.3	Y167 C236 K238 Y243 L244	Y167-R240 HydrophobicContact CD2-CB 3.56Å; Y167-R240 HydrophobicContact CD2-CG 4.05Å; Y167-R240 HydrophobicContact CE2-CB 3.52Å; Y167-R240 HydrophobicContact CE2-CG 3.63Å; Y167-R240 HydrophobicContact CG-CB 4.42Å; C236-R240 WeakPolarHBondContact O-CB 3.35Å; C236-R240 PolarHBondContact O-N 2.94Å; K238-R240 PolarHBondContact O-N 2.59Å; K238-R240 VanDerWaalsContact O-N 3.12Å; R240-Y243 PolarHBondContact O-N 3.49Å; R240-L244 HydrophobicContact CG-CD1 4.34Å; R240-L244 VanDerWaalsContact O-CG 3.29Å; R240-L244 WeakPolarHBondContact O-CG 3.46Å; R240-L244 PolarHBondContact O-N 2.93Å
241	N	97.3	Very high	96.6	Very high	73 Å²	73	66.7 Å²	66.7	39%	0.39	35%	0.346	S	S	.	.	H	α-helix	trans	-66.7	-42.7	176.9	-66.6	4.1	0	0	0	110.1	T237 K238 Y243 L244 L245	T237-N241 PolarHBondContact O-N 2.95Å; T237-N241 PolarHBondContact O-OD1 2.77Å; T237-N241 VanDerWaalsContact O-OD1 3.12Å; K238-N241 WeakPolarHBondContact O-CA 3.49Å; K238-N241 WeakPolarHBondContact O-CB 3.23Å; K238-N241 PolarHBondContact O-N 3.07Å; N241-Y243 VanDerWaalsContact C-N 3.33Å; N241-Y243 PolarHBondContact O-N 3.39Å; N241-L244 PolarHBondContact O-N 2.82Å; N241-L245 WeakPolarHBondContact O-CG 3.43Å; N241-L245 PolarHBondContact O-N 3.17Å
242	D	97.4	Very high	96.8	Very high	76 Å²	76	65 Å²	65	41%	0.406	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-43.7	174.9	-53.4	-35.6	0	0	0	110.8	V163 K238 A239 L245 N246	V163-D242 HydrophobicContact CG1-CB 4.05Å; K238-D242 VanDerWaalsContact C-OD2 3.26Å; K238-D242 PolarHBondContact O-N 2.99Å; K238-D242 VanDerWaalsContact O-OD2 3.06Å; A239-D242 WeakPolarHBondContact CA-OD2 3.2Å; D242-L245 PolarHBondContact O-N 3.24Å; D242-N246 PolarHBondContact O-N 3.11Å; D242-N246 PolarHBondContact O-ND2 2.86Å
243	Y	97.6	Very high	96.9	Very high	42 Å²	42	67.5 Å²	67.5	17%	0.165	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-45.1	173.5	170.8	-118.2	0	0	0	112.6	L160 M164 Y167 A239 R240 N241 L245 N246 L247	L160-Y243 HydrophobicContact CD1-CD2 3.78Å; L160-Y243 HydrophobicContact CD1-CE2 3.63Å; L160-Y243 HydrophobicContact CG-CE2 4.42Å; M164-Y243 HydrophobicContact CB-CD2 3.78Å; M164-Y243 HydrophobicContact CB-CE2 3.6Å; M164-Y243 HydrophobicContact CG-CD2 4.34Å; M164-Y243 HydrophobicContact CG-CE2 3.84Å; M164-Y243 HydrophobicContact SD-CE2 4.31Å; Y167-Y243 HydrophobicContact CD1-CD1 4.08Å; A239-Y243 VanDerWaalsContact O-CB 3.29Å; A239-Y243 WeakPolarHBondContact O-CB 3.46Å; A239-Y243 PolarHBondContact O-N 2.91Å; R240-Y243 PolarHBondContact O-N 3.49Å; N241-Y243 VanDerWaalsContact C-N 3.33Å; N241-Y243 PolarHBondContact O-N 3.39Å; Y243-L245 VanDerWaalsContact C-N 3.34Å; Y243-L245 PolarHBondContact O-N 2.94Å; Y243-N246 PolarHBondContact O-N 2.91Å; Y243-L247 HydrophobicContact CE1-CD2 4.48Å; Y243-L247 VanDerWaalsContact O-CB 3.22Å; Y243-L247 WeakPolarHBondContact O-CB 3.15Å; Y243-L247 PolarHBondContact O-N 3.3Å
244	L	97.8	Very high	97	Very high	90 Å²	90	64.3 Å²	64.3	47%	0.471	35%	0.352	S	S	.	.	H	α-helix	trans	-65.5	-35.7	178.6	-71.5	168.5	0	0	0	112.7	R240 N241 A248	R240-L244 HydrophobicContact CG-CD1 4.34Å; R240-L244 VanDerWaalsContact O-CG 3.29Å; R240-L244 WeakPolarHBondContact O-CG 3.46Å; R240-L244 PolarHBondContact O-N 2.93Å; N241-L244 PolarHBondContact O-N 2.82Å; L244-A248 WeakPolarHBondContact O-CB 3.35Å; L244-A248 PolarHBondContact O-N 2.81Å
245	L	97.5	Very high	97.1	Very high	121 Å²	121	61.4 Å²	61.4	63%	0.634	34%	0.343	S	S	*	.	H	α-helix	trans	-67.7	-46.2	174.5	-69.9	170.4	0	0	0	111.6	N241 D242 Y243 L247 A248 A249	N241-L245 WeakPolarHBondContact O-CG 3.43Å; N241-L245 PolarHBondContact O-N 3.17Å; D242-L245 PolarHBondContact O-N 3.24Å; Y243-L245 VanDerWaalsContact C-N 3.34Å; Y243-L245 PolarHBondContact O-N 2.94Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 3.25Å; L245-A248 PolarHBondContact O-N 2.82Å; L245-A249 PolarHBondContact O-N 3.27Å
246	N	97.7	Very high	97.2	Very high	50 Å²	50	63 Å²	63	27%	0.267	35%	0.35	S	S	.	.	H	α-helix	trans	-66.2	-35.2	177	-78.3	-91.4	0	0	0	112	L160 D242 Y243 A249 T250	L160-N246 HydrophobicContact CD1-CB 4.08Å; D242-N246 PolarHBondContact O-N 3.11Å; D242-N246 PolarHBondContact O-ND2 2.86Å; Y243-N246 PolarHBondContact O-N 2.91Å; N246-A249 PolarHBondContact O-N 3.15Å; N246-T250 WeakPolarHBondContact O-CB 3.41Å; N246-T250 PolarHBondContact O-N 3.2Å; N246-T250 PolarHBondContact O-OG1 3.43Å
247	L	97.6	Very high	97.3	Very high	47 Å²	47	62.6 Å²	62.6	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-43.9	174.1	179.6	62.7	0	0	0	111.3	L160 Y243 L245 T250 N251	L160-L247 HydrophobicContact CD1-CB 4.03Å; L160-L247 HydrophobicContact CD1-CD1 4.49Å; L160-L247 HydrophobicContact CD2-CD1 3.9Å; Y243-L247 HydrophobicContact CE1-CD2 4.48Å; Y243-L247 VanDerWaalsContact O-CB 3.22Å; Y243-L247 WeakPolarHBondContact O-CB 3.15Å; Y243-L247 PolarHBondContact O-N 3.3Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 3.25Å; L247-T250 PolarHBondContact O-N 2.77Å; L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 2.78Å; L247-N251 PolarHBondContact O-ND2 2.88Å
248	A	97.6	Very high	97.3	Very high	61 Å²	61	63.7 Å²	63.7	50%	0.504	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-44.4	175.2	0	0	0	0	0	111.9	L244 L245 N251 A252	L244-A248 WeakPolarHBondContact O-CB 3.35Å; L244-A248 PolarHBondContact O-N 2.81Å; L245-A248 PolarHBondContact O-N 2.82Å; A248-N251 PolarHBondContact O-N 3.32Å; A248-A252 WeakPolarHBondContact O-CB 3.18Å; A248-A252 PolarHBondContact O-N 3.22Å
249	A	97.2	Very high	97.3	Very high	51 Å²	51	63 Å²	63	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-46.2	175.9	0	0	0	0	0	112.2	L245 N246 N251 A252 V253	L245-A249 PolarHBondContact O-N 3.27Å; N246-A249 PolarHBondContact O-N 3.15Å; A249-N251 PolarHBondContact O-N 2.86Å; A249-A252 PolarHBondContact O-N 3.09Å; A249-V253 WeakPolarHBondContact O-CG2 3.39Å; A249-V253 PolarHBondContact O-N 3.28Å
250	T	97.6	Very high	97.3	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.043	37%	0.368	C	S	.	.	H	α-helix	trans	-58.6	-48.6	177.3	-56.1	0	0	0	0	111.2	V156 T157 L160 N246 L247 A252 V253 V254	V156-T250 HydrophobicContact CG1-CG2 4.1Å; V156-T250 WeakPolarHBondContact CG1-OG1 3.46Å; T157-T250 HydrophobicContact CG2-CG2 4.16Å; L160-T250 HydrophobicContact CD2-CG2 3.84Å; N246-T250 WeakPolarHBondContact O-CB 3.41Å; N246-T250 PolarHBondContact O-N 3.2Å; N246-T250 PolarHBondContact O-OG1 3.43Å; L247-T250 PolarHBondContact O-N 2.77Å; T250-A252 VanDerWaalsContact C-N 3.29Å; T250-A252 PolarHBondContact O-N 3.48Å; T250-V253 PolarHBondContact O-N 3.2Å; T250-V254 HydrophobicContact CG2-CG2 4.33Å; T250-V254 WeakPolarHBondContact O-CB 3.39Å; T250-V254 VanDerWaalsContact O-CG2 3.29Å; T250-V254 WeakPolarHBondContact O-CG2 3.18Å; T250-V254 PolarHBondContact O-N 3.04Å
251	N	97.5	Very high	97.3	Very high	94 Å²	94	63.6 Å²	63.6	50%	0.503	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-35.7	178.9	-69.1	-18.4	0	0	0	111.9	L247 A248 A249 A255	L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 2.78Å; L247-N251 PolarHBondContact O-ND2 2.88Å; A248-N251 PolarHBondContact O-N 3.32Å; A249-N251 PolarHBondContact O-N 2.86Å; N251-A255 WeakPolarHBondContact O-CB 3.37Å; N251-A255 PolarHBondContact O-N 3.35Å
252	A	97.6	Very high	97.2	Very high	60 Å²	60	61.5 Å²	61.5	50%	0.496	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-42.5	176.2	0	0	0	0	0	112.7	A248 A249 T250 A255 K256	A248-A252 WeakPolarHBondContact O-CB 3.18Å; A248-A252 PolarHBondContact O-N 3.22Å; A249-A252 PolarHBondContact O-N 3.09Å; T250-A252 VanDerWaalsContact C-N 3.29Å; T250-A252 PolarHBondContact O-N 3.48Å; A252-A255 PolarHBondContact O-N 3.29Å; A252-K256 WeakPolarHBondContact O-CB 3.35Å; A252-K256 PolarHBondContact O-N 3.12Å
253	V	97	Very high	97.1	Very high	60 Å²	60	60.8 Å²	60.8	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-67.5	-44.2	177	176.5	0	0	0	0	111.1	L153 A249 T250 K256 Y257	L153-V253 HydrophobicContact CD2-CG1 4.07Å; A249-V253 WeakPolarHBondContact O-CG2 3.39Å; A249-V253 PolarHBondContact O-N 3.28Å; T250-V253 PolarHBondContact O-N 3.2Å; V253-K256 PolarHBondContact O-N 2.87Å; V253-Y257 PolarHBondContact O-N 3.33Å
254	V	97.1	Very high	97.1	Very high	35 Å²	35	63.1 Å²	63.1	21%	0.212	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-46.3	174.8	171.8	0	0	0	0	110.8	L153 T250 Y257 Y258	L153-V254 HydrophobicContact CD2-CG2 3.97Å; T250-V254 HydrophobicContact CG2-CG2 4.33Å; T250-V254 WeakPolarHBondContact O-CB 3.39Å; T250-V254 VanDerWaalsContact O-CG2 3.29Å; T250-V254 WeakPolarHBondContact O-CG2 3.18Å; T250-V254 PolarHBondContact O-N 3.04Å; V254-Y257 PolarHBondContact O-N 3.44Å; V254-Y258 HydrophobicContact CG1-CD2 3.92Å; V254-Y258 HydrophobicContact CG1-CE2 4.09Å; V254-Y258 WeakPolarHBondContact O-CD2 3.4Å; V254-Y258 PolarHBondContact O-N 2.95Å; V254-Y258 VanDerWaalsContact O-N 3.12Å
255	A	97.4	Very high	96.9	Very high	41 Å²	41	59.3 Å²	59.3	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-45.2	177.1	0	0	0	0	0	112	N251 A252 Y257 Y258 I259	N251-A255 WeakPolarHBondContact O-CB 3.37Å; N251-A255 PolarHBondContact O-N 3.35Å; A252-A255 PolarHBondContact O-N 3.29Å; A255-Y257 VanDerWaalsContact C-N 3.34Å; A255-Y257 PolarHBondContact O-N 2.82Å; A255-Y258 PolarHBondContact O-N 3.16Å; A255-I259 HydrophobicContact CB-CD1 4.18Å; A255-I259 VanDerWaalsContact O-CB 3.22Å; A255-I259 WeakPolarHBondContact O-CB 3.47Å; A255-I259 WeakPolarHBondContact O-CD1 3.18Å; A255-I259 WeakPolarHBondContact O-CG1 3.22Å; A255-I259 PolarHBondContact O-N 3.1Å
256	K	97.2	Very high	96.8	Very high	109 Å²	109	56.2 Å²	56.2	47%	0.474	32%	0.323	S	S	.	.	H	α-helix	trans	-57.3	-46.2	176.8	-176.4	-174.7	173.4	-66.4	0	111.6	A252 V253 H260 D261	A252-K256 WeakPolarHBondContact O-CB 3.35Å; A252-K256 PolarHBondContact O-N 3.12Å; V253-K256 PolarHBondContact O-N 2.87Å; K256-H260 WeakPolarHBondContact O-CB 3.44Å; K256-H260 PolarHBondContact O-N 2.82Å; K256-D261 IonicContact NZ-OD1 2.99Å; K256-D261 PolarHBondContact NZ-OD1 2.87Å; K256-D261 IonicContact NZ-OD2 2.66Å; K256-D261 PolarHBondContact NZ-OD2 3.03Å; K256-D261 PolarHBondContact O-N 2.95Å
257	Y	97.4	Very high	96.6	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.012	34%	0.335	C	S	.	.	I	π-helix	trans	-60.5	-54.2	179.4	174.8	-95.9	0	0	0	112.3	L27 Q30 M149 H150 L153 V253 V254 A255 I259 D261 V262	L27-Y257 HydrophobicContact CD2-CD1 4.41Å; L27-Y257 HydrophobicContact CD2-CE1 3.49Å; L27-Y257 VanDerWaalsContact CD2-CE1 3.49Å; Q30-Y257 PolarHBondContact OE1-OH 3.41Å; M149-Y257 HydrophobicContact CB-CD2 4.3Å; M149-Y257 HydrophobicContact CB-CE2 4.2Å; H150-Y257 AromaticContact CD2-CE2 3.98Å; H150-Y257 AromaticContact CD2-CZ 3.93Å; H150-Y257 PolarHBondContact CD2-OH 2.86Å; H150-Y257 AromaticContact NE2-CE2 3.6Å; H150-Y257 AromaticContact NE2-CZ 3.11Å; H150-Y257 PolarHBondContact NE2-OH 3.04Å; L153-Y257 HydrophobicContact CD1-CD1 3.67Å; L153-Y257 HydrophobicContact CD1-CD2 3.85Å; L153-Y257 HydrophobicContact CD1-CE1 3.98Å; L153-Y257 HydrophobicContact CD1-CE2 4.14Å; L153-Y257 HydrophobicContact CD1-CG 3.61Å; L153-Y257 HydrophobicContact CG-CG 4.45Å; V253-Y257 PolarHBondContact O-N 3.33Å; V254-Y257 PolarHBondContact O-N 3.44Å; A255-Y257 VanDerWaalsContact C-N 3.34Å; A255-Y257 PolarHBondContact O-N 2.82Å; Y257-I259 VanDerWaalsContact C-N 3.34Å; Y257-I259 PolarHBondContact O-N 2.72Å; Y257-D261 HydrophobicContact CD2-CB 4.22Å; Y257-D261 PolarHBondContact O-N 3.47Å; Y257-V262 HydrophobicContact CD1-CG2 3.91Å; Y257-V262 HydrophobicContact CD2-CG2 4.29Å; Y257-V262 HydrophobicContact CE1-CG2 3.4Å; Y257-V262 HydrophobicContact CE2-CG2 3.83Å; Y257-V262 HydrophobicContact CG-CG2 4.32Å; Y257-V262 WeakPolarHBondContact O-CG2 3.46Å; Y257-V262 PolarHBondContact O-N 3.2Å
258	Y	96.6	Very high	96.4	Very high	75 Å²	75	59 Å²	59	29%	0.294	34%	0.342	S	S	.	.	I	π-helix	trans	-74.1	-19.3	-174.8	-80.7	-89.8	0	0	0	114.3	Q26 V254 A255	Q26-Y258 PolarHBondContact OE1-OH 2.91Å; V254-Y258 HydrophobicContact CG1-CD2 3.92Å; V254-Y258 HydrophobicContact CG1-CE2 4.09Å; V254-Y258 WeakPolarHBondContact O-CD2 3.4Å; V254-Y258 PolarHBondContact O-N 2.95Å; V254-Y258 VanDerWaalsContact O-N 3.12Å; A255-Y258 PolarHBondContact O-N 3.16Å
259	I	96.6	Very high	96.2	Very high	114 Å²	114	56.6 Å²	56.6	59%	0.585	32%	0.322	S	S	*	.	I	π-helix	trans	-99.4	-35.2	-178.2	-61.4	170.8	0	0	0	112.3	A255 Y257	A255-I259 HydrophobicContact CB-CD1 4.18Å; A255-I259 VanDerWaalsContact O-CB 3.22Å; A255-I259 WeakPolarHBondContact O-CB 3.47Å; A255-I259 WeakPolarHBondContact O-CD1 3.18Å; A255-I259 WeakPolarHBondContact O-CG1 3.22Å; A255-I259 PolarHBondContact O-N 3.1Å; Y257-I259 VanDerWaalsContact C-N 3.34Å; Y257-I259 PolarHBondContact O-N 2.72Å
260	H	96.8	Very high	95.9	Very high	108 Å²	108	55.7 Å²	55.7	50%	0.5	31%	0.309	S	S	.	.	I	π-helix	trans	-118.6	-60.1	-175.1	-59.1	-64	0	0	0	111.8	K256 V262 S263 D264	K256-H260 WeakPolarHBondContact O-CB 3.44Å; K256-H260 PolarHBondContact O-N 2.82Å; H260-V262 VanDerWaalsContact C-N 3.3Å; H260-V262 PolarHBondContact O-N 3.43Å; H260-S263 WeakPolarHBondContact O-CA 3.36Å; H260-S263 VanDerWaalsContact O-CB 3.25Å; H260-S263 WeakPolarHBondContact O-CB 3.27Å; H260-S263 PolarHBondContact O-N 2.91Å; H260-D264 PolarHBondContact O-N 2.87Å
261	D	96.5	Very high	95.7	Very high	18 Å²	18	60.8 Å²	60.8	10%	0.096	34%	0.336	C	S	.	.	I	π-helix	trans	-66.9	-30.4	-162.4	-52.1	-23.4	0	0	0	113.7	M149 K256 Y257 S263 M265	M149-D261 HydrophobicContact CE-CB 3.43Å; M149-D261 VanDerWaalsContact CE-CB 3.43Å; M149-D261 VanDerWaalsContact CE-CG 3.45Å; M149-D261 WeakPolarHBondContact CE-OD2 3.37Å; M149-D261 HydrophobicContact SD-CB 3.99Å; K256-D261 IonicContact NZ-OD1 2.99Å; K256-D261 PolarHBondContact NZ-OD1 2.87Å; K256-D261 IonicContact NZ-OD2 2.66Å; K256-D261 PolarHBondContact NZ-OD2 3.03Å; K256-D261 PolarHBondContact O-N 2.95Å; Y257-D261 HydrophobicContact CD2-CB 4.22Å; Y257-D261 PolarHBondContact O-N 3.47Å; D261-S263 VanDerWaalsContact C-N 3.32Å; D261-M265 VanDerWaalsContact O-CB 3.23Å; D261-M265 WeakPolarHBondContact O-CB 3.48Å; D261-M265 PolarHBondContact O-N 2.76Å
262	V	95.6	Very high	95.6	Very high	30 Å²	30	58.2 Å²	58.2	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-65.6	-34.6	171.7	171.5	0	0	0	0	111.9	Y257 H260 I266	Y257-V262 HydrophobicContact CD1-CG2 3.91Å; Y257-V262 HydrophobicContact CD2-CG2 4.29Å; Y257-V262 HydrophobicContact CE1-CG2 3.4Å; Y257-V262 HydrophobicContact CE2-CG2 3.83Å; Y257-V262 HydrophobicContact CG-CG2 4.32Å; Y257-V262 WeakPolarHBondContact O-CG2 3.46Å; Y257-V262 PolarHBondContact O-N 3.2Å; H260-V262 VanDerWaalsContact C-N 3.3Å; H260-V262 PolarHBondContact O-N 3.43Å; V262-I266 HydrophobicContact CG1-CD1 4.31Å; V262-I266 WeakPolarHBondContact O-CD1 3.35Å; V262-I266 VanDerWaalsContact O-CG1 3.31Å; V262-I266 WeakPolarHBondContact O-CG1 3.06Å; V262-I266 PolarHBondContact O-N 3.16Å
263	S	96.1	Very high	95.6	Very high	61 Å²	61	56.1 Å²	56.1	43%	0.427	31%	0.311	S	S	.	.	H	α-helix	trans	-70.2	-50.5	175	-162.8	0	0	0	0	110.5	H260 D261 M265 I266 D267	H260-S263 WeakPolarHBondContact O-CA 3.36Å; H260-S263 VanDerWaalsContact O-CB 3.25Å; H260-S263 WeakPolarHBondContact O-CB 3.27Å; H260-S263 PolarHBondContact O-N 2.91Å; D261-S263 VanDerWaalsContact C-N 3.32Å; S263-M265 PolarHBondContact O-N 3.49Å; S263-I266 WeakPolarHBondContact O-CA 3.35Å; S263-I266 WeakPolarHBondContact O-CB 3.19Å; S263-I266 PolarHBondContact O-N 3.21Å; S263-D267 PolarHBondContact O-N 2.92Å
264	D	95.9	Very high	95.6	Very high	91 Å²	91	58.5 Å²	58.5	49%	0.487	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-35.2	179.4	-60.9	-9.5	0	0	0	111.4	H260 D267 C268	H260-D264 PolarHBondContact O-N 2.87Å; D264-D267 PolarHBondContact O-N 3.42Å; D264-C268 PolarHBondContact O-N 2.92Å; D264-C268 PolarHBondContact O-SG 3.15Å
265	M	94.6	Very high	95.7	Very high	9 Å²	9	59.6 Å²	59.6	4%	0.044	33%	0.331	C	S	.	.	H	α-helix	trans	-68.7	-35.3	174.6	179.7	172.1	53.1	0	0	113.1	F31 L34 D261 S263 C268 C269	F31-M265 HydrophobicContact CE1-SD 4.42Å; L34-M265 HydrophobicContact CD1-CE 3.9Å; L34-M265 HydrophobicContact CD1-SD 4.3Å; D261-M265 VanDerWaalsContact O-CB 3.23Å; D261-M265 WeakPolarHBondContact O-CB 3.48Å; D261-M265 PolarHBondContact O-N 2.76Å; S263-M265 PolarHBondContact O-N 3.49Å; M265-C268 PolarHBondContact O-N 3.04Å; M265-C269 PolarHBondContact O-N 2.67Å; M265-C269 VanDerWaalsContact O-N 3.14Å; M265-C269 PolarHBondContact O-SG 2.85Å; M265-C269 VanDerWaalsContact O-SG 3.41Å
266	I	94.7	Very high	95.7	Very high	56 Å²	56	58.7 Å²	58.7	29%	0.287	32%	0.321	S	S	.	.	H	α-helix	trans	-66.1	-47.2	172.8	-69.9	160.6	0	0	0	109.7	L34 V262 S263 C268 C269 D270	L34-I266 HydrophobicContact CD2-CG1 3.78Å; V262-I266 HydrophobicContact CG1-CD1 4.31Å; V262-I266 WeakPolarHBondContact O-CD1 3.35Å; V262-I266 VanDerWaalsContact O-CG1 3.31Å; V262-I266 WeakPolarHBondContact O-CG1 3.06Å; V262-I266 PolarHBondContact O-N 3.16Å; S263-I266 WeakPolarHBondContact O-CA 3.35Å; S263-I266 WeakPolarHBondContact O-CB 3.19Å; S263-I266 PolarHBondContact O-N 3.21Å; I266-C268 PolarHBondContact O-N 3.49Å; I266-C269 WeakPolarHBondContact O-CA 3.39Å; I266-C269 WeakPolarHBondContact O-CB 3.42Å; I266-C269 PolarHBondContact O-N 2.9Å; I266-D270 PolarHBondContact O-N 2.83Å
267	D	94.6	Very high	95.8	Very high	99 Å²	99	54.4 Å²	54.4	53%	0.529	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-32.7	177.1	-70.6	-32.1	0	0	0	112.1	S263 D264 D270 L271	S263-D267 PolarHBondContact O-N 2.92Å; D264-D267 PolarHBondContact O-N 3.42Å; D267-D270 PolarHBondContact O-N 3.08Å; D267-L271 PolarHBondContact O-N 2.75Å; D267-L271 VanDerWaalsContact O-N 3.1Å
268	C	93	Very high	95.8	Very high	57 Å²	57	56 Å²	56	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-35.1	171.9	-70.7	0	0	0	0	113.8	D264 M265 I266 D270	D264-C268 PolarHBondContact O-N 2.92Å; D264-C268 PolarHBondContact O-SG 3.15Å; M265-C268 PolarHBondContact O-N 3.04Å; I266-C268 PolarHBondContact O-N 3.49Å; C268-D270 VanDerWaalsContact C-N 3.35Å
269	C	93	Very high	95.9	Very high	11 Å²	11	59.5 Å²	59.5	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-69	-33.5	172.1	-70.8	0	0	0	0	112.4	S142 M265 I266	S142-C269 WeakPolarHBondContact CB-SG 3.43Å; S142-C269 PolarHBondContact OG-N 2.83Å; S142-C269 PolarHBondContact OG-SG 3.46Å; M265-C269 PolarHBondContact O-N 2.67Å; M265-C269 VanDerWaalsContact O-N 3.14Å; M265-C269 PolarHBondContact O-SG 2.85Å; M265-C269 VanDerWaalsContact O-SG 3.41Å; I266-C269 WeakPolarHBondContact O-CA 3.39Å; I266-C269 WeakPolarHBondContact O-CB 3.42Å; I266-C269 PolarHBondContact O-N 2.9Å
270	D	90.8	Very high	96	Very high	31 Å²	31	54.3 Å²	54.3	17%	0.166	30%	0.304	C	S	.	.	H	α-helix	trans	-90.3	-6.4	-172.8	-74	26.2	0	0	0	113.3	R41 I266 D267 C268 G272 Y273	R41-D270 IonicContact CZ-OD1 2.7Å; R41-D270 VanDerWaalsContact CZ-OD1 3.25Å; R41-D270 IonicContact CZ-OD2 2.84Å; R41-D270 IonicContact NH1-OD1 3.85Å; R41-D270 PolarHBondContact NH1-OD1 2.88Å; R41-D270 IonicContact NH1-OD2 2.66Å; R41-D270 IonicContact NH2-OD1 2.61Å; R41-D270 PolarHBondContact NH2-OD1 2.83Å; R41-D270 IonicContact NH2-OD2 3.78Å; R41-D270 PolarHBondContact NH2-OD2 3.44Å; I266-D270 PolarHBondContact O-N 2.83Å; D267-D270 PolarHBondContact O-N 3.08Å; C268-D270 VanDerWaalsContact C-N 3.35Å; D270-G272 PolarHBondContact O-N 3.24Å; D270-Y273 WeakPolarHBondContact O-CB 3.3Å; D270-Y273 PolarHBondContact O-N 2.97Å
271	L	94.7	Very high	96.1	Very high	115 Å²	115	52.8 Å²	52.8	60%	0.602	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	103.3	-169.9	-175.6	63.3	0	0	0	113.3	L138 D267 Y273	L138-L271 HydrophobicContact CD1-CB 4.27Å; L138-L271 VanDerWaalsContact CD1-O 3.24Å; L138-L271 WeakPolarHBondContact CD1-O 3.41Å; L138-L271 HydrophobicContact CD2-CD2 4.42Å; D267-L271 PolarHBondContact O-N 2.75Å; D267-L271 VanDerWaalsContact O-N 3.1Å; L271-Y273 VanDerWaalsContact C-N 3.31Å; L271-Y273 PolarHBondContact O-N 3.18Å
272	G	95.1	Very high	96.2	Very high	39 Å²	39	59.8 Å²	59.8	40%	0.402	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-8.6	177.3	0	0	0	0	0	115.8	D270 A275 S276	D270-G272 PolarHBondContact O-N 3.24Å; G272-A275 PolarHBondContact O-N 3.15Å; G272-S276 WeakPolarHBondContact O-CB 3.29Å; G272-S276 PolarHBondContact O-N 3.15Å; G272-S276 PolarHBondContact O-OG 3.1Å
273	Y	97.6	Very high	96.3	Very high	16 Å²	16	60.3 Å²	60.3	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-55	-58	-179.6	168.1	-110.2	0	0	0	111.7	R41 L45 I131 V135 D270 L271 A275 S276 L277	R41-Y273 HydrophobicContact CB-CE2 4.37Å; R41-Y273 HydrophobicContact CG-CE1 4.15Å; R41-Y273 HydrophobicContact CG-CE2 4.44Å; L45-Y273 HydrophobicContact CD1-CE2 4.04Å; L45-Y273 HydrophobicContact CD2-CE2 4.25Å; L45-Y273 HydrophobicContact CG-CE2 4.29Å; I131-Y273 HydrophobicContact CG2-CD2 3.75Å; I131-Y273 HydrophobicContact CG2-CE2 4.15Å; V135-Y273 HydrophobicContact CG2-CD2 3.68Å; V135-Y273 HydrophobicContact CG2-CE2 4.34Å; V135-Y273 HydrophobicContact CG2-CG 4.38Å; D270-Y273 WeakPolarHBondContact O-CB 3.3Å; D270-Y273 PolarHBondContact O-N 2.97Å; L271-Y273 VanDerWaalsContact C-N 3.31Å; L271-Y273 PolarHBondContact O-N 3.18Å; Y273-A275 VanDerWaalsContact C-N 3.32Å; Y273-A275 PolarHBondContact O-N 3.19Å; Y273-S276 PolarHBondContact O-N 2.98Å; Y273-L277 HydrophobicContact CE1-CD2 4.49Å; Y273-L277 HydrophobicContact CE2-CD2 4.4Å; Y273-L277 WeakPolarHBondContact O-CB 3.22Å; Y273-L277 PolarHBondContact O-N 3.48Å
274	H	97.3	Very high	96.4	Very high	111 Å²	111	60.1 Å²	60.1	51%	0.514	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-37.2	-179.7	-70	-78.2	0	0	0	112.7	A278	H274-A278 WeakPolarHBondContact O-CB 3.49Å; H274-A278 PolarHBondContact O-N 3.46Å
275	A	97.9	Very high	96.6	Very high	58 Å²	58	59.6 Å²	59.6	48%	0.479	31%	0.311	S	S	.	.	H	α-helix	trans	-69	-40.8	179.4	0	0	0	0	0	112.4	G272 Y273 R279	G272-A275 PolarHBondContact O-N 3.15Å; Y273-A275 VanDerWaalsContact C-N 3.32Å; Y273-A275 PolarHBondContact O-N 3.19Å; A275-R279 WeakPolarHBondContact O-CG 3.26Å; A275-R279 PolarHBondContact O-N 2.72Å
276	S	98.1	Very high	96.8	Very high	21 Å²	21	62.3 Å²	62.3	15%	0.147	33%	0.331	C	S	.	.	H	α-helix	trans	-73.4	-39.4	177.4	-65.2	0	0	0	0	112.4	G272 Y273 R279 T280	G272-S276 WeakPolarHBondContact O-CB 3.29Å; G272-S276 PolarHBondContact O-N 3.15Å; G272-S276 PolarHBondContact O-OG 3.1Å; Y273-S276 PolarHBondContact O-N 2.98Å; S276-R279 PolarHBondContact O-N 2.81Å; S276-R279 PolarHBondContact OG-NH2 2.99Å; S276-T280 PolarHBondContact O-N 3.1Å; S276-T280 PolarHBondContact O-OG1 3.29Å
277	L	98.3	Very high	96.9	Very high	19 Å²	19	60 Å²	60	10%	0.099	32%	0.321	C	S	.	.	H	α-helix	trans	-63.7	-44.3	173.7	-174.5	60.8	0	0	0	111.3	L45 L48 L128 Y273 R279 T280 F281	L45-L277 HydrophobicContact CD2-CD1 4.24Å; L48-L277 HydrophobicContact CD1-CD1 4.08Å; L128-L277 HydrophobicContact CD2-CD1 3.81Å; Y273-L277 HydrophobicContact CE1-CD2 4.49Å; Y273-L277 HydrophobicContact CE2-CD2 4.4Å; Y273-L277 WeakPolarHBondContact O-CB 3.22Å; Y273-L277 PolarHBondContact O-N 3.48Å; L277-R279 VanDerWaalsContact C-N 3.32Å; L277-R279 PolarHBondContact O-N 2.87Å; L277-T280 WeakPolarHBondContact O-CB 3.16Å; L277-T280 PolarHBondContact O-N 3.3Å; L277-T280 VanDerWaalsContact O-N 3.11Å; L277-F281 HydrophobicContact CD1-CD2 4.05Å; L277-F281 HydrophobicContact CD1-CE2 3.62Å; L277-F281 HydrophobicContact CD1-CZ 4.46Å; L277-F281 HydrophobicContact CD2-CE2 4.31Å; L277-F281 HydrophobicContact CG-CD2 3.99Å; L277-F281 HydrophobicContact CG-CE2 3.76Å; L277-F281 WeakPolarHBondContact O-CD2 3.36Å; L277-F281 PolarHBondContact O-N 3.07Å
278	A	98.6	Very high	97.1	Very high	37 Å²	37	57.6 Å²	57.6	31%	0.306	31%	0.306	S	S	.	.	H	α-helix	trans	-71.5	-21.6	177.8	0	0	0	0	0	113.9	H274 R282	H274-A278 WeakPolarHBondContact O-CB 3.49Å; H274-A278 PolarHBondContact O-N 3.46Å; A278-R282 WeakPolarHBondContact O-CG 3.17Å; A278-R282 PolarHBondContact O-N 3.01Å; A278-R282 PolarHBondContact O-NH1 2.87Å
279	R	98.4	Very high	97.3	Very high	148 Å²	148	62.6 Å²	62.6	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-71.5	-43.2	165.3	-77.6	-177.6	-62.8	162	2.4	110.9	A275 S276 L277 F281 R282 T283	A275-R279 WeakPolarHBondContact O-CG 3.26Å; A275-R279 PolarHBondContact O-N 2.72Å; S276-R279 PolarHBondContact O-N 2.81Å; S276-R279 PolarHBondContact OG-NH2 2.99Å; L277-R279 VanDerWaalsContact C-N 3.32Å; L277-R279 PolarHBondContact O-N 2.87Å; R279-F281 PolarHBondContact O-N 2.94Å; R279-R282 WeakPolarHBondContact O-CA 3.45Å; R279-R282 WeakPolarHBondContact O-CB 3.43Å; R279-R282 PolarHBondContact O-N 3.48Å; R279-R282 VanDerWaalsContact O-N 3.07Å; R279-T283 PolarHBondContact O-N 3.3Å; R279-T283 PolarHBondContact O-OG1 3.33Å
280	T	98.5	Very high	97.6	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-43.6	-179.2	-55	0	0	0	0	112.2	V124 R127 L128 S276 L277 R282 T283 Y284	V124-T280 HydrophobicContact CG1-CG2 3.85Å; R127-T280 HydrophobicContact CB-CG2 4.07Å; L128-T280 HydrophobicContact CD2-CG2 4.15Å; L128-T280 HydrophobicContact CG-CG2 4.06Å; S276-T280 PolarHBondContact O-N 3.1Å; S276-T280 PolarHBondContact O-OG1 3.29Å; L277-T280 WeakPolarHBondContact O-CB 3.16Å; L277-T280 PolarHBondContact O-N 3.3Å; L277-T280 VanDerWaalsContact O-N 3.11Å; T280-R282 VanDerWaalsContact C-N 3.32Å; T280-R282 PolarHBondContact O-N 3.31Å; T280-T283 WeakPolarHBondContact O-CB 3.35Å; T280-T283 PolarHBondContact O-N 3.05Å; T280-Y284 PolarHBondContact O-N 3.1Å; T280-Y284 VanDerWaalsContact O-N 3.13Å
281	F	98.7	Very high	97.9	Very high	77 Å²	77	66.4 Å²	66.4	34%	0.338	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-29.3	172	-77.8	-63.2	0	0	0	113.7	L48 F52 L277 R279 Y284 L285	L48-F281 HydrophobicContact CD1-CE2 4.47Å; L48-F281 HydrophobicContact CD1-CZ 4.05Å; L48-F281 HydrophobicContact CD2-CE1 4.35Å; L48-F281 HydrophobicContact CD2-CZ 3.87Å; F52-F281 HydrophobicContact CE2-CE1 4.34Å; F52-F281 HydrophobicContact CZ-CE1 4.5Å; L277-F281 HydrophobicContact CD1-CD2 4.05Å; L277-F281 HydrophobicContact CD1-CE2 3.62Å; L277-F281 HydrophobicContact CD1-CZ 4.46Å; L277-F281 HydrophobicContact CD2-CE2 4.31Å; L277-F281 HydrophobicContact CG-CD2 3.99Å; L277-F281 HydrophobicContact CG-CE2 3.76Å; L277-F281 WeakPolarHBondContact O-CD2 3.36Å; L277-F281 PolarHBondContact O-N 3.07Å; R279-F281 PolarHBondContact O-N 2.94Å; F281-Y284 WeakPolarHBondContact O-CB 3.4Å; F281-Y284 PolarHBondContact O-N 2.91Å; F281-L285 WeakPolarHBondContact O-CG 3Å; F281-L285 PolarHBondContact O-N 3.08Å
282	R	98.5	Very high	98.1	Very high	165 Å²	165	65.8 Å²	65.8	62%	0.623	33%	0.332	S	S	*	.	H	α-helix	trans	-69.5	-34.6	171.2	-76.9	178.5	-176.3	91.3	-9.5	112.3	A278 R279 T280 L285 S286	A278-R282 WeakPolarHBondContact O-CG 3.17Å; A278-R282 PolarHBondContact O-N 3.01Å; A278-R282 PolarHBondContact O-NH1 2.87Å; R279-R282 WeakPolarHBondContact O-CA 3.45Å; R279-R282 WeakPolarHBondContact O-CB 3.43Å; R279-R282 PolarHBondContact O-N 3.48Å; R279-R282 VanDerWaalsContact O-N 3.07Å; T280-R282 VanDerWaalsContact C-N 3.32Å; T280-R282 PolarHBondContact O-N 3.31Å; R282-L285 PolarHBondContact O-N 2.77Å; R282-S286 VanDerWaalsContact O-CB 3.24Å; R282-S286 WeakPolarHBondContact O-CB 3.49Å; R282-S286 PolarHBondContact O-N 2.79Å
283	T	98.5	Very high	98.2	Very high	40 Å²	40	67.4 Å²	67.4	25%	0.245	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-43.6	171.2	-55.3	0	0	0	0	111.3	I119 N123 V124 R279 T280 A287	I119-T283 HydrophobicContact CG2-CG2 4.21Å; N123-T283 HydrophobicContact CB-CG2 4.22Å; V124-T283 HydrophobicContact CG2-CG2 4.47Å; R279-T283 PolarHBondContact O-N 3.3Å; R279-T283 PolarHBondContact O-OG1 3.33Å; T280-T283 WeakPolarHBondContact O-CB 3.35Å; T280-T283 PolarHBondContact O-N 3.05Å; T283-A287 PolarHBondContact O-N 3.4Å; T283-A287 VanDerWaalsContact O-N 3.13Å
284	Y	98.4	Very high	98.3	Very high	57 Å²	57	67.8 Å²	67.8	22%	0.224	34%	0.339	C	S	.	.	H	α-helix	trans	-58.1	-54.7	172.5	163.2	-101.9	0	0	0	112.2	F52 K55 Y120 T280 F281 S286 A287 E288	F52-Y284 AromaticContact CE1-CD2 3.4Å; F52-Y284 HydrophobicContact CE1-CD2 3.4Å; F52-Y284 VanDerWaalsContact CE1-CD2 3.4Å; F52-Y284 AromaticContact CE1-CE2 3.81Å; F52-Y284 HydrophobicContact CE1-CE2 3.81Å; F52-Y284 HydrophobicContact CE1-CG 4.05Å; F52-Y284 AromaticContact CZ-CD2 3.83Å; F52-Y284 HydrophobicContact CZ-CD2 3.83Å; F52-Y284 HydrophobicContact CZ-CE2 4.32Å; F52-Y284 HydrophobicContact CZ-CG 4Å; K55-Y284 HydrophobicContact CD-CE2 4.49Å; Y120-Y284 AromaticContact CE1-CD2 3.67Å; Y120-Y284 HydrophobicContact CE1-CD2 3.67Å; Y120-Y284 HydrophobicContact CE1-CE2 4.2Å; Y120-Y284 WeakPolarHBondContact OH-CE2 3.42Å; T280-Y284 PolarHBondContact O-N 3.1Å; T280-Y284 VanDerWaalsContact O-N 3.13Å; F281-Y284 WeakPolarHBondContact O-CB 3.4Å; F281-Y284 PolarHBondContact O-N 2.91Å; Y284-S286 VanDerWaalsContact C-N 3.31Å; Y284-S286 PolarHBondContact O-N 2.84Å; Y284-A287 PolarHBondContact O-N 2.84Å; Y284-A287 VanDerWaalsContact O-N 3.1Å; Y284-E288 HydrophobicContact CD2-CG 4.21Å; Y284-E288 HydrophobicContact CE1-CG 4.34Å; Y284-E288 HydrophobicContact CE2-CG 3.75Å; Y284-E288 WeakPolarHBondContact CE2-OE1 3.49Å; Y284-E288 PolarHBondContact O-N 3.45Å; Y284-E288 VanDerWaalsContact O-N 3.12Å; Y284-E288 PolarHBondContact OH-OE1 2.91Å
285	L	98.6	Very high	98.3	Very high	81 Å²	81	66.8 Å²	66.8	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-59.5	-41.4	-179.9	-71.8	169.6	0	0	0	112	F281 R282 A287 E288 Y289	F281-L285 WeakPolarHBondContact O-CG 3Å; F281-L285 PolarHBondContact O-N 3.08Å; R282-L285 PolarHBondContact O-N 2.77Å; L285-A287 VanDerWaalsContact C-N 3.28Å; L285-A287 PolarHBondContact O-N 3.04Å; L285-E288 PolarHBondContact O-N 3.49Å; L285-Y289 HydrophobicContact CB-CD2 4.41Å; L285-Y289 HydrophobicContact CB-CE2 4.28Å; L285-Y289 WeakPolarHBondContact O-CD2 3.32Å; L285-Y289 PolarHBondContact O-N 3.36Å
286	S	98.6	Very high	98.3	Very high	65 Å²	65	70.2 Å²	70.2	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-60	-39	176.7	-168.9	0	0	0	0	111.9	R282 Y284 N290	R282-S286 VanDerWaalsContact O-CB 3.24Å; R282-S286 WeakPolarHBondContact O-CB 3.49Å; R282-S286 PolarHBondContact O-N 2.79Å; Y284-S286 VanDerWaalsContact C-N 3.31Å; Y284-S286 PolarHBondContact O-N 2.84Å; S286-N290 PolarHBondContact O-N 2.66Å; S286-N290 VanDerWaalsContact O-N 3.12Å; S286-N290 PolarHBondContact O-ND2 3.47Å
287	A	98.3	Very high	98.3	Very high	9 Å²	9	74.3 Å²	74.3	7%	0.074	35%	0.353	C	S	.	.	H	α-helix	trans	-69.3	-44.6	179.4	0	0	0	0	0	111.8	L116 I119 T283 Y284 L285 Y289 N290 L291	L116-A287 HydrophobicContact CD1-CB 3.46Å; L116-A287 VanDerWaalsContact CD1-CB 3.46Å; I119-A287 HydrophobicContact CD1-CB 3.94Å; I119-A287 HydrophobicContact CG2-CB 3.98Å; T283-A287 PolarHBondContact O-N 3.4Å; T283-A287 VanDerWaalsContact O-N 3.13Å; Y284-A287 PolarHBondContact O-N 2.84Å; Y284-A287 VanDerWaalsContact O-N 3.1Å; L285-A287 VanDerWaalsContact C-N 3.28Å; L285-A287 PolarHBondContact O-N 3.04Å; A287-Y289 PolarHBondContact O-N 3.49Å; A287-N290 PolarHBondContact O-N 3.35Å; A287-L291 PolarHBondContact O-N 3.21Å
288	E	97.9	Very high	98.2	Very high	48 Å²	48	73.4 Å²	73.4	22%	0.224	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-42.3	175.1	-62.5	-76.2	-164.4	0	0	111.7	K55 Y120 Y284 L285 N290 L291 E292	K55-E288 WeakPolarHBondContact CE-OE1 3.16Å; K55-E288 IonicContact NZ-OE1 3.28Å; K55-E288 PolarHBondContact NZ-OE1 3.03Å; Y120-E288 PolarHBondContact OH-OE1 2.97Å; Y284-E288 HydrophobicContact CD2-CG 4.21Å; Y284-E288 HydrophobicContact CE1-CG 4.34Å; Y284-E288 HydrophobicContact CE2-CG 3.75Å; Y284-E288 WeakPolarHBondContact CE2-OE1 3.49Å; Y284-E288 PolarHBondContact O-N 3.45Å; Y284-E288 VanDerWaalsContact O-N 3.12Å; Y284-E288 PolarHBondContact OH-OE1 2.91Å; L285-E288 PolarHBondContact O-N 3.49Å; E288-N290 PolarHBondContact O-N 3.07Å; E288-L291 PolarHBondContact O-N 3.37Å; E288-E292 PolarHBondContact O-N 2.87Å
289	Y	98.4	Very high	98.2	Very high	162 Å²	162	75.4 Å²	75.4	64%	0.635	35%	0.354	S	S	*	.	H	α-helix	trans	-63.7	-37.7	176	-76.9	-56.1	0	0	0	113	L285 A287 T293	L285-Y289 HydrophobicContact CB-CD2 4.41Å; L285-Y289 HydrophobicContact CB-CE2 4.28Å; L285-Y289 WeakPolarHBondContact O-CD2 3.32Å; L285-Y289 PolarHBondContact O-N 3.36Å; A287-Y289 PolarHBondContact O-N 3.49Å; Y289-T293 WeakPolarHBondContact O-CB 3.47Å; Y289-T293 PolarHBondContact O-N 3.21Å; Y289-T293 PolarHBondContact O-OG1 3.16Å
290	N	98.1	Very high	98.2	Very high	105 Å²	105	72 Å²	72	56%	0.561	35%	0.347	S	S	*	.	H	α-helix	trans	-72.2	-35.6	178.4	-80.9	-102.6	0	0	0	111.8	S286 A287 E288 T293 S294	S286-N290 PolarHBondContact O-N 2.66Å; S286-N290 VanDerWaalsContact O-N 3.12Å; S286-N290 PolarHBondContact O-ND2 3.47Å; A287-N290 PolarHBondContact O-N 3.35Å; E288-N290 PolarHBondContact O-N 3.07Å; N290-T293 PolarHBondContact O-N 3.47Å; N290-S294 WeakPolarHBondContact O-CB 3.44Å; N290-S294 PolarHBondContact O-N 3.32Å
291	L	97.9	Very high	98.1	Very high	17 Å²	17	75.1 Å²	75.1	9%	0.089	36%	0.362	C	S	.	.	H	α-helix	trans	-58.5	-52.3	170.6	172.7	65	0	0	0	110.9	D112 L116 A287 E288 T293 S294 R295	D112-L291 HydrophobicContact CB-CD1 3.5Å; D112-L291 VanDerWaalsContact CB-CD1 3.5Å; L116-L291 HydrophobicContact CD2-CD2 3.75Å; A287-L291 PolarHBondContact O-N 3.21Å; E288-L291 PolarHBondContact O-N 3.37Å; L291-T293 VanDerWaalsContact C-N 3.28Å; L291-T293 PolarHBondContact O-N 3.09Å; L291-S294 PolarHBondContact O-N 3.31Å; L291-R295 VanDerWaalsContact O-CB 3.25Å; L291-R295 WeakPolarHBondContact O-CB 3.23Å; L291-R295 PolarHBondContact O-N 3.32Å
292	E	98	Very high	98.1	Very high	102 Å²	102	72.8 Å²	72.8	48%	0.477	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-30	-178.4	-165.3	62.5	-159.3	0	0	112.3	E288 R295 H296	E288-E292 PolarHBondContact O-N 2.87Å; E292-R295 IonicContact OE1-NH1 3.89Å; E292-R295 IonicContact OE2-NH1 2.9Å; E292-H296 WeakPolarHBondContact O-CB 3.48Å; E292-H296 PolarHBondContact O-N 2.6Å
293	T	98.3	Very high	98	Very high	73 Å²	73	70.7 Å²	70.7	45%	0.448	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-52.5	172.7	-53.8	0	0	0	0	111.7	Y289 N290 L291 R295 H296 E297	Y289-T293 WeakPolarHBondContact O-CB 3.47Å; Y289-T293 PolarHBondContact O-N 3.21Å; Y289-T293 PolarHBondContact O-OG1 3.16Å; N290-T293 PolarHBondContact O-N 3.47Å; L291-T293 VanDerWaalsContact C-N 3.28Å; L291-T293 PolarHBondContact O-N 3.09Å; T293-R295 PolarHBondContact O-N 3.03Å; T293-H296 PolarHBondContact O-N 3.16Å; T293-H296 VanDerWaalsContact O-N 3.11Å; T293-E297 WeakPolarHBondContact O-CG 3.05Å; T293-E297 PolarHBondContact O-N 2.95Å
294	S	98.3	Very high	97.9	Very high	24 Å²	24	72.7 Å²	72.7	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-56.6	-35.3	176	178.1	0	0	0	0	112.4	R108 D112 N290 L291 G298	R108-S294 WeakPolarHBondContact CD-O 3.34Å; R108-S294 VanDerWaalsContact CD-OG 3.26Å; R108-S294 WeakPolarHBondContact CD-OG 3.39Å; R108-S294 PolarHBondContact NH1-O 2.81Å; R108-S294 VanDerWaalsContact NH1-O 3.15Å; D112-S294 VanDerWaalsContact OD2-CB 3.32Å; D112-S294 WeakPolarHBondContact OD2-CB 3.33Å; D112-S294 PolarHBondContact OD2-OG 2.95Å; N290-S294 WeakPolarHBondContact O-CB 3.44Å; N290-S294 PolarHBondContact O-N 3.32Å; L291-S294 PolarHBondContact O-N 3.31Å; S294-G298 PolarHBondContact O-N 2.88Å; S294-G298 VanDerWaalsContact O-N 3.15Å
295	R	97.8	Very high	97.8	Very high	90 Å²	90	70.3 Å²	70.3	34%	0.34	35%	0.352	S	S	.	.	H	α-helix	trans	-68.3	-47.7	175.5	-170.5	172.2	-171.1	-123.1	-4.2	112.5	Q105 E109 L291 E292 T293 G298 L299	Q105-R295 PolarHBondContact NE2-O 2.87Å; E109-R295 WeakPolarHBondContact OE1-CG 3.46Å; E109-R295 IonicContact OE1-CZ 2.66Å; E109-R295 IonicContact OE1-NE 2.67Å; E109-R295 PolarHBondContact OE1-NE 3.03Å; E109-R295 IonicContact OE1-NH2 2.7Å; L291-R295 VanDerWaalsContact O-CB 3.25Å; L291-R295 WeakPolarHBondContact O-CB 3.23Å; L291-R295 PolarHBondContact O-N 3.32Å; E292-R295 IonicContact OE1-NH1 3.89Å; E292-R295 IonicContact OE2-NH1 2.9Å; T293-R295 PolarHBondContact O-N 3.03Å; R295-G298 WeakPolarHBondContact O-CA 3.25Å; R295-G298 PolarHBondContact O-N 3.25Å; R295-G298 VanDerWaalsContact O-N 3.08Å; R295-L299 HydrophobicContact CG-CD1 4.46Å; R295-L299 WeakPolarHBondContact O-CG 3.18Å; R295-L299 PolarHBondContact O-N 2.77Å
296	H	98.3	Very high	97.7	Very high	129 Å²	129	69.9 Å²	69.9	60%	0.597	35%	0.353	S	S	*	.	H	α-helix	trans	-62.5	-46.8	177.8	-174.8	45.3	0	0	0	111.8	E292 T293 G298 L299 D300	E292-H296 WeakPolarHBondContact O-CB 3.48Å; E292-H296 PolarHBondContact O-N 2.6Å; T293-H296 PolarHBondContact O-N 3.16Å; T293-H296 VanDerWaalsContact O-N 3.11Å; H296-G298 PolarHBondContact O-N 2.82Å; H296-G298 VanDerWaalsContact O-N 3.16Å; H296-L299 PolarHBondContact O-N 3.4Å; H296-L299 VanDerWaalsContact O-N 3.09Å; H296-D300 PolarHBondContact O-N 3.23Å
297	E	97.9	Very high	97.6	Very high	107 Å²	107	73.2 Å²	73.2	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-55.9	-30.3	171.5	-69.8	172.8	-169.9	0	0	112.9	T293 I301	T293-E297 WeakPolarHBondContact O-CG 3.05Å; T293-E297 PolarHBondContact O-N 2.95Å; E297-I301 VanDerWaalsContact O-CD1 3.28Å; E297-I301 WeakPolarHBondContact O-CD1 3.49Å; E297-I301 VanDerWaalsContact O-CG1 3.28Å; E297-I301 WeakPolarHBondContact O-CG1 3.25Å; E297-I301 PolarHBondContact O-N 3.03Å
298	G	96.8	Very high	97.4	Very high	1 Å²	1	78.4 Å²	78.4	1%	0.01	39%	0.392	C	S	.	.	H	α-helix	trans	-81	-28.9	179.1	0	0	0	0	0	114.2	Q105 R108 S294 R295 H296 I302	Q105-G298 VanDerWaalsContact OE1-CA 3.27Å; R108-G298 VanDerWaalsContact NH1-N 3.2Å; S294-G298 PolarHBondContact O-N 2.88Å; S294-G298 VanDerWaalsContact O-N 3.15Å; R295-G298 WeakPolarHBondContact O-CA 3.25Å; R295-G298 PolarHBondContact O-N 3.25Å; R295-G298 VanDerWaalsContact O-N 3.08Å; H296-G298 PolarHBondContact O-N 2.82Å; H296-G298 VanDerWaalsContact O-N 3.16Å; G298-I302 WeakPolarHBondContact O-CG1 3.49Å
299	L	98	Very high	97.3	Very high	78 Å²	78	80.2 Å²	80.2	41%	0.408	40%	0.403	S	S	.	.	H	α-helix	trans	-77.7	-41.8	173.5	-67.3	171.9	0	0	0	111	R295 H296 I301 I302 E303	R295-L299 HydrophobicContact CG-CD1 4.46Å; R295-L299 WeakPolarHBondContact O-CG 3.18Å; R295-L299 PolarHBondContact O-N 2.77Å; H296-L299 PolarHBondContact O-N 3.4Å; H296-L299 VanDerWaalsContact O-N 3.09Å; L299-I301 VanDerWaalsContact C-N 3.31Å; L299-I301 PolarHBondContact O-N 3.37Å; L299-I302 CarbonylContact O-C 3.56Å; L299-I302 WeakPolarHBondContact O-CA 3.36Å; L299-I302 WeakPolarHBondContact O-CB 3.44Å; L299-I302 PolarHBondContact O-N 2.78Å; L299-E303 PolarHBondContact O-N 2.85Å
300	D	98.2	Very high	97	Very high	78 Å²	78	75.9 Å²	75.9	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-55.6	-43.1	174.2	174.5	93.5	0	0	0	111.9	H296 I302 E303 N304	H296-D300 PolarHBondContact O-N 3.23Å; D300-I302 PolarHBondContact O-N 3.03Å; D300-E303 PolarHBondContact O-N 3.11Å; D300-N304 WeakPolarHBondContact O-CB 3.46Å; D300-N304 PolarHBondContact O-N 3.15Å; D300-N304 PolarHBondContact O-ND2 2.99Å; D300-N304 PolarHBondContact OD2-ND2 3.1Å; D300-N304 VanDerWaalsContact OD2-ND2 3.08Å
301	I	97.3	Very high	96.8	Very high	69 Å²	69	75.6 Å²	75.6	35%	0.354	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-30	174.8	-71.6	165.7	0	0	0	112.5	L101 E297 L299 A305	L101-I301 HydrophobicContact CD1-CG2 4.24Å; L101-I301 HydrophobicContact CD2-CG2 3.95Å; E297-I301 VanDerWaalsContact O-CD1 3.28Å; E297-I301 WeakPolarHBondContact O-CD1 3.49Å; E297-I301 VanDerWaalsContact O-CG1 3.28Å; E297-I301 WeakPolarHBondContact O-CG1 3.25Å; E297-I301 PolarHBondContact O-N 3.03Å; L299-I301 VanDerWaalsContact C-N 3.31Å; L299-I301 PolarHBondContact O-N 3.37Å; I301-A305 WeakPolarHBondContact O-CB 3.25Å; I301-A305 PolarHBondContact O-N 3.46Å
302	I	97.2	Very high	96.6	Very high	28 Å²	28	83.1 Å²	83.1	14%	0.144	42%	0.424	C	S	.	.	H	α-helix	trans	-80.6	-39.8	176.2	-66.4	168.2	0	0	0	110.6	L101 L102 Q105 G298 L299 D300 A305 V306	L101-I302 HydrophobicContact CB-CG1 4.17Å; L102-I302 HydrophobicContact CD1-CD1 4.13Å; Q105-I302 HydrophobicContact CB-CD1 3.74Å; Q105-I302 HydrophobicContact CG-CD1 4.09Å; G298-I302 WeakPolarHBondContact O-CG1 3.49Å; L299-I302 CarbonylContact O-C 3.56Å; L299-I302 WeakPolarHBondContact O-CA 3.36Å; L299-I302 WeakPolarHBondContact O-CB 3.44Å; L299-I302 PolarHBondContact O-N 2.78Å; D300-I302 PolarHBondContact O-N 3.03Å; I302-A305 WeakPolarHBondContact O-CB 3.44Å; I302-A305 PolarHBondContact O-N 2.98Å; I302-A305 VanDerWaalsContact O-N 3.1Å; I302-V306 HydrophobicContact CG2-CG2 4.48Å; I302-V306 WeakPolarHBondContact O-CG2 3.33Å; I302-V306 PolarHBondContact O-N 3.37Å
303	E	97.8	Very high	96.4	Very high	122 Å²	122	80.6 Å²	80.6	57%	0.57	42%	0.418	S	S	*	.	H	α-helix	trans	-60.1	-51.1	175.8	-171.6	164.2	-159.9	0	0	110.7	L299 D300 A305 V306 D307	L299-E303 PolarHBondContact O-N 2.85Å; D300-E303 PolarHBondContact O-N 3.11Å; E303-A305 PolarHBondContact O-N 2.86Å; E303-A305 VanDerWaalsContact O-N 3.16Å; E303-V306 WeakPolarHBondContact O-CB 3.42Å; E303-V306 PolarHBondContact O-N 2.91Å; E303-D307 PolarHBondContact O-N 2.84Å
304	N	96.8	Very high	96.2	Very high	82 Å²	82	77.8 Å²	77.8	44%	0.439	40%	0.4	S	S	.	.	H	α-helix	trans	-55	-33.8	171	-80.3	-84.9	0	0	0	112.9	D300 N308	D300-N304 WeakPolarHBondContact O-CB 3.46Å; D300-N304 PolarHBondContact O-N 3.15Å; D300-N304 PolarHBondContact O-ND2 2.99Å; D300-N304 PolarHBondContact OD2-ND2 3.1Å; D300-N304 VanDerWaalsContact OD2-ND2 3.08Å; N304-N308 PolarHBondContact O-N 3.47Å; N304-N308 PolarHBondContact O-ND2 2.7Å
305	A	95.3	Very high	96	Very high	7 Å²	7	81.7 Å²	81.7	6%	0.058	41%	0.414	C	S	.	.	H	α-helix	trans	-75.7	-34.4	176.9	0	0	0	0	0	112.7	C98 L101 I301 I302 E303 N308	C98-A305 PolarHBondContact SG-O 3.09Å; L101-A305 HydrophobicContact CD1-CB 3.48Å; L101-A305 VanDerWaalsContact CD1-CB 3.48Å; I301-A305 WeakPolarHBondContact O-CB 3.25Å; I301-A305 PolarHBondContact O-N 3.46Å; I302-A305 WeakPolarHBondContact O-CB 3.44Å; I302-A305 PolarHBondContact O-N 2.98Å; I302-A305 VanDerWaalsContact O-N 3.1Å; E303-A305 PolarHBondContact O-N 2.86Å; E303-A305 VanDerWaalsContact O-N 3.16Å; A305-N308 PolarHBondContact O-N 3.3Å
306	V	96.8	Very high	95.7	Very high	72 Å²	72	81 Å²	81	44%	0.436	41%	0.414	S	S	.	.	H	α-helix	trans	-65.7	-42.3	174	168.6	0	0	0	0	110.9	I302 E303 N308 L309	I302-V306 HydrophobicContact CG2-CG2 4.48Å; I302-V306 WeakPolarHBondContact O-CG2 3.33Å; I302-V306 PolarHBondContact O-N 3.37Å; E303-V306 WeakPolarHBondContact O-CB 3.42Å; E303-V306 PolarHBondContact O-N 2.91Å; V306-N308 PolarHBondContact O-N 3.25Å; V306-L309 HydrophobicContact CB-CD1 4.43Å; V306-L309 HydrophobicContact CG1-CD1 4.16Å; V306-L309 VanDerWaalsContact O-CB 3.25Å; V306-L309 WeakPolarHBondContact O-CB 3.24Å; V306-L309 WeakPolarHBondContact O-CD1 3.34Å; V306-L309 WeakPolarHBondContact O-CG 3.38Å; V306-L309 PolarHBondContact O-N 3.24Å; V306-L309 VanDerWaalsContact O-N 3.11Å
307	D	96.4	Very high	95.3	Very high	134 Å²	134	77.3 Å²	77.3	72%	0.717	40%	0.397	S	S	*	.	H	α-helix	trans	-62.5	-25.2	174.2	-76.7	-10.5	0	0	0	113	E303 L309	E303-D307 PolarHBondContact O-N 2.84Å; D307-L309 VanDerWaalsContact C-N 3.35Å
308	N	94.1	Very high	94.9	Very high	118 Å²	118	75.2 Å²	75.2	63%	0.631	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	16.6	176.7	-79.2	-80.1	0	0	0	114.1	S94 N304 A305 V306 D310	S94-N308 WeakPolarHBondContact CB-O 3.2Å; N304-N308 PolarHBondContact O-N 3.47Å; N304-N308 PolarHBondContact O-ND2 2.7Å; A305-N308 PolarHBondContact O-N 3.3Å; V306-N308 PolarHBondContact O-N 3.25Å; N308-D310 VanDerWaalsContact C-N 3.35Å; N308-D310 PolarHBondContact O-N 3.09Å
309	L	95.4	Very high	94.7	Very high	87 Å²	87	78.9 Å²	78.9	46%	0.455	41%	0.406	S	S	.	.			trans	-73.1	76.8	174.6	-73.6	172.8	0	0	0	113.1	V306 D307	V306-L309 HydrophobicContact CB-CD1 4.43Å; V306-L309 HydrophobicContact CG1-CD1 4.16Å; V306-L309 VanDerWaalsContact O-CB 3.25Å; V306-L309 WeakPolarHBondContact O-CB 3.24Å; V306-L309 WeakPolarHBondContact O-CD1 3.34Å; V306-L309 WeakPolarHBondContact O-CG 3.38Å; V306-L309 PolarHBondContact O-N 3.24Å; V306-L309 VanDerWaalsContact O-N 3.11Å; D307-L309 VanDerWaalsContact C-N 3.35Å
310	D	93.4	Very high	94.2	Very high	70 Å²	70	80.1 Å²	80.1	37%	0.374	41%	0.413	S	S	.	.			trans	-99.4	106.1	176.6	-177.6	24.5	0	0	0	114.3	N308 R312 S313 D314	N308-D310 VanDerWaalsContact C-N 3.35Å; N308-D310 PolarHBondContact O-N 3.09Å; D310-R312 PolarHBondContact O-N 3.33Å; D310-R312 WeakPolarHBondContact OD1-CA 3.43Å; D310-R312 VanDerWaalsContact OD1-CB 3.25Å; D310-R312 WeakPolarHBondContact OD1-CB 3.32Å; D310-R312 PolarHBondContact OD1-N 3.12Å; D310-S313 VanDerWaalsContact CG-N 3.32Å; D310-S313 PolarHBondContact O-N 3.47Å; D310-S313 WeakPolarHBondContact OD2-CB 3.39Å; D310-S313 PolarHBondContact OD2-N 3Å; D310-D314 PolarHBondContact O-N 2.55Å
311	S	93.1	Very high	93.5	Very high	100 Å²	100	81.1 Å²	81.1	70%	0.699	42%	0.416	S	S	*	.	H	α-helix	trans	-58.5	-26.6	170.6	68	0	0	0	0	114.2	K315	S311-K315 VanDerWaalsContact O-CB 3.25Å; S311-K315 WeakPolarHBondContact O-CB 3.39Å; S311-K315 PolarHBondContact O-N 2.95Å; S311-K315 VanDerWaalsContact O-N 3.08Å
312	R	94.6	Very high	93	Very high	174 Å²	174	81.9 Å²	81.9	66%	0.657	42%	0.418	S	S	*	.	H	α-helix	trans	-74.6	-49.6	176.7	-179.4	-179	174.7	161.6	-0.6	110.3	D310 K315 H316	D310-R312 PolarHBondContact O-N 3.33Å; D310-R312 WeakPolarHBondContact OD1-CA 3.43Å; D310-R312 VanDerWaalsContact OD1-CB 3.25Å; D310-R312 WeakPolarHBondContact OD1-CB 3.32Å; D310-R312 PolarHBondContact OD1-N 3.12Å; R312-K315 PolarHBondContact O-N 3.3Å; R312-H316 PolarHBondContact O-N 2.87Å; R312-H316 VanDerWaalsContact O-N 3.1Å; R312-H316 PolarHBondContact O-ND1 3.41Å
313	S	92.9	Very high	92.6	Very high	50 Å²	50	85 Å²	85	35%	0.35	44%	0.435	S	S	.	.	H	α-helix	trans	-54.7	-51.9	173.9	-178.6	0	0	0	0	110.7	D310 K315 H316 K317	D310-S313 VanDerWaalsContact CG-N 3.32Å; D310-S313 PolarHBondContact O-N 3.47Å; D310-S313 WeakPolarHBondContact OD2-CB 3.39Å; D310-S313 PolarHBondContact OD2-N 3Å; S313-K315 VanDerWaalsContact C-N 3.3Å; S313-K315 PolarHBondContact O-N 3.46Å; S313-H316 PolarHBondContact O-N 3.1Å; S313-K317 PolarHBondContact O-N 3.35Å
314	D	93.6	Very high	92.1	Very high	13 Å²	13	84.6 Å²	84.6	7%	0.07	43%	0.433	C	S	.	.	H	α-helix	trans	-61.2	-36.4	179	-76.4	-6.4	0	0	0	112.9	L93 S94 D310 H316 K317 I318	L93-D314 WeakPolarHBondContact CA-OD1 3.34Å; L93-D314 HydrophobicContact CD2-CB 4.02Å; S94-D314 WeakPolarHBondContact CB-OD2 3.37Å; S94-D314 PolarHBondContact N-OD1 3.48Å; S94-D314 PolarHBondContact N-OD2 3.1Å; S94-D314 PolarHBondContact OG-OD2 2.77Å; D310-D314 PolarHBondContact O-N 2.55Å; D314-H316 PolarHBondContact O-N 3.03Å; D314-K317 PolarHBondContact O-N 3.02Å; D314-K317 IonicContact OD1-NZ 3.12Å; D314-K317 PolarHBondContact OD1-NZ 3.28Å; D314-I318 WeakPolarHBondContact O-CD1 3.43Å; D314-I318 VanDerWaalsContact O-CG1 3.25Å; D314-I318 WeakPolarHBondContact O-CG1 3.41Å; D314-I318 PolarHBondContact O-N 3.31Å
315	K	94.4	Very high	92	Very high	106 Å²	106	85.8 Å²	85.8	46%	0.461	44%	0.443	S	S	.	.	H	α-helix	trans	-64.4	-36.4	172.8	-171	-142.5	67.8	172	0	112.6	S311 R312 S313 M319	S311-K315 VanDerWaalsContact O-CB 3.25Å; S311-K315 WeakPolarHBondContact O-CB 3.39Å; S311-K315 PolarHBondContact O-N 2.95Å; S311-K315 VanDerWaalsContact O-N 3.08Å; R312-K315 PolarHBondContact O-N 3.3Å; S313-K315 VanDerWaalsContact C-N 3.3Å; S313-K315 PolarHBondContact O-N 3.46Å; K315-M319 HydrophobicContact CD-SD 4.43Å; K315-M319 VanDerWaalsContact O-CG 3.3Å; K315-M319 WeakPolarHBondContact O-CG 3.46Å; K315-M319 PolarHBondContact O-N 3.43Å; K315-M319 VanDerWaalsContact O-N 3.1Å
316	H	92.2	Very high	91.8	Very high	75 Å²	75	90.5 Å²	90.5	35%	0.347	46%	0.463	S	S	.	.	H	α-helix	trans	-69.2	-48.4	174	-65.5	85.9	0	0	0	110.2	R312 S313 D314 I318 M319 D320	R312-H316 PolarHBondContact O-N 2.87Å; R312-H316 VanDerWaalsContact O-N 3.1Å; R312-H316 PolarHBondContact O-ND1 3.41Å; S313-H316 PolarHBondContact O-N 3.1Å; D314-H316 PolarHBondContact O-N 3.03Å; H316-I318 VanDerWaalsContact C-N 3.26Å; H316-I318 PolarHBondContact O-N 2.97Å; H316-I318 VanDerWaalsContact O-N 3.16Å; H316-M319 CarbonylContact O-C 3.34Å; H316-M319 WeakPolarHBondContact O-CA 3.4Å; H316-M319 PolarHBondContact O-N 3.34Å; H316-D320 PolarHBondContact O-N 3.36Å; H316-D320 VanDerWaalsContact O-OD2 3.1Å
317	K	89.6	Confident	91.5	Very high	53 Å²	53	90.8 Å²	90.8	23%	0.23	47%	0.467	C	S	.	.	H	α-helix	trans	-49.8	-44.9	173.6	-63.7	174.4	-167	161.4	0	112.6	L92 L93 S313 D314 D320 M321	L92-K317 PolarHBondContact O-NZ 3.12Å; L93-K317 HydrophobicContact CD2-CB 4.06Å; L93-K317 HydrophobicContact CD2-CD 4.13Å; S313-K317 PolarHBondContact O-N 3.35Å; D314-K317 PolarHBondContact O-N 3.02Å; D314-K317 IonicContact OD1-NZ 3.12Å; D314-K317 PolarHBondContact OD1-NZ 3.28Å; K317-D320 PolarHBondContact O-N 3.1Å; K317-M321 WeakPolarHBondContact O-CB 3.48Å; K317-M321 PolarHBondContact O-N 3.16Å
318	I	89.6	Confident	91.3	Very high	62 Å²	62	90.1 Å²	90.1	32%	0.318	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-40	177.1	-68.8	164.5	0	0	0	111.9	L93 D314 H316 H322 F326	L93-I318 HydrophobicContact CD1-CD1 4.12Å; L93-I318 HydrophobicContact CD1-CG1 4.29Å; L93-I318 HydrophobicContact CD2-CD1 4.25Å; L93-I318 HydrophobicContact CD2-CG1 3.89Å; D314-I318 WeakPolarHBondContact O-CD1 3.43Å; D314-I318 VanDerWaalsContact O-CG1 3.25Å; D314-I318 WeakPolarHBondContact O-CG1 3.41Å; D314-I318 PolarHBondContact O-N 3.31Å; H316-I318 VanDerWaalsContact C-N 3.26Å; H316-I318 PolarHBondContact O-N 2.97Å; H316-I318 VanDerWaalsContact O-N 3.16Å; I318-H322 WeakPolarHBondContact O-CB 3.33Å; I318-H322 PolarHBondContact O-N 2.89Å; I318-F326 HydrophobicContact CG2-CE2 4.25Å
319	M	91.7	Very high	91.1	Very high	78 Å²	78	90 Å²	90	38%	0.384	48%	0.476	S	S	.	.	H	α-helix	trans	-68.8	-36.4	176.8	-73.4	-179.4	65.8	0	0	112.4	K315 H316 H322 N323 F326	K315-M319 HydrophobicContact CD-SD 4.43Å; K315-M319 VanDerWaalsContact O-CG 3.3Å; K315-M319 WeakPolarHBondContact O-CG 3.46Å; K315-M319 PolarHBondContact O-N 3.43Å; K315-M319 VanDerWaalsContact O-N 3.1Å; H316-M319 CarbonylContact O-C 3.34Å; H316-M319 WeakPolarHBondContact O-CA 3.4Å; H316-M319 PolarHBondContact O-N 3.34Å; M319-H322 CarbonylContact O-C 3.6Å; M319-N323 WeakPolarHBondContact O-CA 3.35Å; M319-N323 PolarHBondContact O-N 3.26Å; M319-F326 HydrophobicContact CB-CD2 4.44Å; M319-F326 HydrophobicContact CG-CD2 4.25Å; M319-F326 HydrophobicContact CG-CG 4.37Å
320	D	87.3	Confident	90.8	Very high	105 Å²	105	94.4 Å²	94.4	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-77.2	-43.8	-178.8	-57	-31.1	0	0	0	111	H316 K317 H322 N323	H316-D320 PolarHBondContact O-N 3.36Å; H316-D320 VanDerWaalsContact O-OD2 3.1Å; K317-D320 PolarHBondContact O-N 3.1Å; D320-H322 PolarHBondContact O-N 2.94Å; D320-N323 WeakPolarHBondContact O-CB 3.22Å; D320-N323 PolarHBondContact O-N 3.37Å; D320-N323 PolarHBondContact O-ND2 3.24Å
321	M	84.6	Confident	90.8	Very high	99 Å²	99	102.1 Å²	102.1	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-21.1	174.9	-176.6	175.2	67.2	0	0	113.3	K317	K317-M321 WeakPolarHBondContact O-CB 3.48Å; K317-M321 PolarHBondContact O-N 3.16Å
322	H	85.5	Confident	90.7	Very high	85 Å²	85	107.4 Å²	107.4	39%	0.394	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	38.8	176.7	-58.7	-28.9	0	0	0	111.3	I318 M319 D320 Q324 V325 F326	I318-H322 WeakPolarHBondContact O-CB 3.33Å; I318-H322 PolarHBondContact O-N 2.89Å; M319-H322 CarbonylContact O-C 3.6Å; D320-H322 PolarHBondContact O-N 2.94Å; H322-Q324 VanDerWaalsContact C-N 3.26Å; H322-Q324 PolarHBondContact O-N 2.96Å; H322-V325 HydrophobicContact CB-CB 4.3Å; H322-V325 HydrophobicContact CB-CG2 4.21Å; H322-V325 WeakPolarHBondContact O-CB 3.43Å; H322-V325 PolarHBondContact O-N 3.28Å; H322-F326 HydrophobicContact CB-CD2 3.98Å; H322-F326 HydrophobicContact CB-CE2 3.85Å; H322-F326 WeakPolarHBondContact O-CD2 3.4Å; H322-F326 PolarHBondContact O-N 3.23Å
323	N	88.9	Confident	90.7	Very high	93 Å²	93	107.1 Å²	107.1	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-53	-41	-175.1	58.9	71.1	0	0	0	112.9	M319 D320 V325 F326 C327	M319-N323 WeakPolarHBondContact O-CA 3.35Å; M319-N323 PolarHBondContact O-N 3.26Å; D320-N323 WeakPolarHBondContact O-CB 3.22Å; D320-N323 PolarHBondContact O-N 3.37Å; D320-N323 PolarHBondContact O-ND2 3.24Å; N323-V325 PolarHBondContact O-N 3.08Å; N323-V325 VanDerWaalsContact O-N 3.14Å; N323-F326 CarbonylContact O-C 3.5Å; N323-F326 PolarHBondContact O-N 2.82Å; N323-C327 VanDerWaalsContact O-CB 3.31Å; N323-C327 WeakPolarHBondContact O-CB 3.41Å; N323-C327 PolarHBondContact O-N 2.89Å
324	Q	88.9	Confident	90.6	Very high	113 Å²	113	109.8 Å²	109.8	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-50.6	-33.8	172.6	-52.6	175.9	-38.7	0	0	114	H322 C327 D570	H322-Q324 VanDerWaalsContact C-N 3.26Å; H322-Q324 PolarHBondContact O-N 2.96Å; Q324-C327 PolarHBondContact O-SG 3.01Å; Q324-C327 VanDerWaalsContact O-SG 3.4Å; Q324-D570 WeakPolarHBondContact CB-OD2 3.35Å; Q324-D570 VanDerWaalsContact CD-OD2 3.3Å; Q324-D570 HydrophobicContact CG-CB 4.43Å; Q324-D570 WeakPolarHBondContact CG-OD2 3.41Å; Q324-D570 VanDerWaalsContact NE2-CG 3.31Å; Q324-D570 PolarHBondContact NE2-OD1 3.01Å; Q324-D570 PolarHBondContact NE2-OD2 3.42Å
325	V	93.3	Very high	90.5	Very high	108 Å²	108	116.4 Å²	116.4	66%	0.655	57%	0.574	S	S	*	*	H	α-helix	trans	-86.1	-25.8	-177.3	-175.5	0	0	0	0	111.7	H322 N323	H322-V325 HydrophobicContact CB-CB 4.3Å; H322-V325 HydrophobicContact CB-CG2 4.21Å; H322-V325 WeakPolarHBondContact O-CB 3.43Å; H322-V325 PolarHBondContact O-N 3.28Å; N323-V325 PolarHBondContact O-N 3.08Å; N323-V325 VanDerWaalsContact O-N 3.14Å
326	F	92	Very high	90.3	Very high	106 Å²	106	114.8 Å²	114.8	47%	0.465	58%	0.575	S	S	.	*	H	α-helix	trans	-113	-5.4	-172.5	-63.3	-63.7	0	0	0	114.4	I318 M319 H322 N323	I318-F326 HydrophobicContact CG2-CE2 4.25Å; M319-F326 HydrophobicContact CB-CD2 4.44Å; M319-F326 HydrophobicContact CG-CD2 4.25Å; M319-F326 HydrophobicContact CG-CG 4.37Å; H322-F326 HydrophobicContact CB-CD2 3.98Å; H322-F326 HydrophobicContact CB-CE2 3.85Å; H322-F326 WeakPolarHBondContact O-CD2 3.4Å; H322-F326 PolarHBondContact O-N 3.23Å; N323-F326 CarbonylContact O-C 3.5Å; N323-F326 PolarHBondContact O-N 2.82Å
327	C	91.1	Very high	90.3	Very high	77 Å²	77	118.5 Å²	118.5	52%	0.52	59%	0.592	S	S	.	*	S	Bend	trans	-65	136.1	178.2	62.4	0	0	0	0	111.6	N323 Q324	N323-C327 VanDerWaalsContact O-CB 3.31Å; N323-C327 WeakPolarHBondContact O-CB 3.41Å; N323-C327 PolarHBondContact O-N 2.89Å; Q324-C327 PolarHBondContact O-SG 3.01Å; Q324-C327 VanDerWaalsContact O-SG 3.4Å
328	P	90.3	Very high	90.3	Very high	121 Å²	121	124.2 Å²	124.2	79%	0.786	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-65.2	130.1	175.5	-21.6	33.6	0	0	0	111.6
329	P	90.4	Very high	90.2	Very high	116 Å²	116	124.1 Å²	124.1	75%	0.753	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-67.4	160.8	178.1	28.7	-35.9	0	0	0	112
330	M	90.2	Very high	90.3	Very high	179 Å²	179	124 Å²	124	88%	0.882	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-53.6	144.5	175.5	-65.9	-168	79.4	0	0	112.1
331	R	91.8	Very high	90.3	Very high	231 Å²	231	127.9 Å²	127.9	87%	0.872	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-71.7	133.4	179.5	-64.9	-178.7	-180	179.7	1.2	110.3	E333	R331-E333 PolarHBondContact O-N 3.17Å
332	F	92.8	Very high	90.4	Very high	211 Å²	211	127.3 Å²	127.3	93%	0.925	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-62.8	124.8	171.1	-58.8	-73.5	0	0	0	110.9
333	E	92.6	Very high	90.4	Very high	168 Å²	168	127.3 Å²	127.3	79%	0.785	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-97.4	163.6	173.8	-57.4	-155.6	145.9	0	0	111.8	R331 L335	R331-E333 PolarHBondContact O-N 3.17Å; E333-L335 PolarHBondContact O-N 2.95Å
334	Y	91.1	Very high	90.4	Very high	107 Å²	107	130.5 Å²	130.5	42%	0.42	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-73.2	120.5	169.8	165.9	-91	0	0	0	109.2	P336 D340 C343	Y334-P336 HydrophobicContact CD1-CG 4.21Å; Y334-P336 HydrophobicContact CE1-CB 4.06Å; Y334-P336 HydrophobicContact CE1-CG 3.81Å; Y334-P336 WeakPolarHBondContact O-CD 3.42Å; Y334-D340 WeakPolarHBondContact OH-CB 3.46Å; Y334-D340 VanDerWaalsContact OH-CG 3.29Å; Y334-D340 PolarHBondContact OH-OD2 2.95Å; Y334-C343 HydrophobicContact CD1-CB 3.83Å; Y334-C343 HydrophobicContact CE1-CB 3.99Å
335	L	92.1	Very high	90.5	Very high	151 Å²	151	127.8 Å²	127.8	79%	0.791	67%	0.665	S	S	*	*			trans	-96.2	112.8	176.5	-60.5	179.4	0	0	0	109.5	E333 H337	E333-L335 PolarHBondContact O-N 2.95Å; L335-H337 PolarHBondContact O-N 3.35Å
336	P	91.3	Very high	90.3	Very high	73 Å²	73	125.6 Å²	125.6	47%	0.474	65%	0.654	S	S	.	*			trans	-62.4	121.4	-178.6	-23.3	33.5	0	0	0	112.6	Y334	Y334-P336 HydrophobicContact CD1-CG 4.21Å; Y334-P336 HydrophobicContact CE1-CB 4.06Å; Y334-P336 HydrophobicContact CE1-CG 3.81Å; Y334-P336 WeakPolarHBondContact O-CD 3.42Å
337	H	91.8	Very high	90.1	Very high	152 Å²	152	121.5 Å²	121.5	70%	0.704	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-78.4	126.4	172.4	-173.7	66.8	0	0	0	109.8	L335 G339 D340	L335-H337 PolarHBondContact O-N 3.35Å; H337-G339 PolarHBondContact O-N 3.06Å; H337-D340 WeakPolarHBondContact O-CB 3.37Å; H337-D340 PolarHBondContact O-N 2.93Å; H337-D340 VanDerWaalsContact O-N 3.07Å
338	M	89.1	Confident	89.9	Confident	174 Å²	174	124.8 Å²	124.8	86%	0.857	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	53.6	24	177.5	-60.7	-63.7	-70.4	0	0	115.4
339	G	87.9	Confident	89.8	Confident	59 Å²	59	125.6 Å²	125.6	61%	0.608	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	85.3	21	-179.5	0	0	0	0	0	115.3	H337 E341	H337-G339 PolarHBondContact O-N 3.06Å; G339-E341 PolarHBondContact O-N 3.3Å
340	D	93.6	Very high	89.4	Confident	75 Å²	75	124.7 Å²	124.7	40%	0.401	64%	0.635	S	S	.	*			trans	-50.5	119.6	173.4	-175.6	5.7	0	0	0	112.5	Y334 H337 V342	Y334-D340 WeakPolarHBondContact OH-CB 3.46Å; Y334-D340 VanDerWaalsContact OH-CG 3.29Å; Y334-D340 PolarHBondContact OH-OD2 2.95Å; H337-D340 WeakPolarHBondContact O-CB 3.37Å; H337-D340 PolarHBondContact O-N 2.93Å; H337-D340 VanDerWaalsContact O-N 3.07Å; D340-V342 VanDerWaalsContact C-N 3.29Å; D340-V342 WeakPolarHBondContact OD1-CB 3.4Å; D340-V342 PolarHBondContact OD1-N 3.21Å
341	E	86.8	Confident	89.4	Confident	188 Å²	188	119.4 Å²	119.4	88%	0.879	61%	0.613	S	S	*	*			trans	-79.9	-9.9	179.7	-58.9	-169.9	157.7	0	0	112.6	G339 C343	G339-E341 PolarHBondContact O-N 3.3Å; E341-C343 PolarHBondContact O-N 3.03Å
342	V	87.2	Confident	89.3	Confident	87 Å²	87	111.7 Å²	111.7	53%	0.527	59%	0.587	S	S	.	*			trans	-91.1	75.9	-172.4	-169.7	0	0	0	0	111.8	D340 Q344	D340-V342 VanDerWaalsContact C-N 3.29Å; D340-V342 WeakPolarHBondContact OD1-CB 3.4Å; D340-V342 PolarHBondContact OD1-N 3.21Å; V342-Q344 PolarHBondContact O-N 3.19Å
343	C	86.3	Confident	89.1	Confident	85 Å²	85	105.2 Å²	105.2	57%	0.574	56%	0.564	S	S	*	*			trans	-82.1	17.5	178	70.4	0	0	0	0	115	Y334 E341	Y334-C343 HydrophobicContact CD1-CB 3.83Å; Y334-C343 HydrophobicContact CE1-CB 3.99Å; E341-C343 PolarHBondContact O-N 3.03Å
344	Q	88.4	Confident	89.2	Confident	160 Å²	160	104 Å²	104	75%	0.748	56%	0.559	S	S	*	*	S	Bend	trans	-141.2	158.1	-175.5	-63.7	-174.7	3.7	0	0	111.7	V342 S346	V342-Q344 PolarHBondContact O-N 3.19Å; Q344-S346 PolarHBondContact O-N 2.95Å
345	V	90.8	Very high	89.3	Confident	55 Å²	55	99.8 Å²	99.8	33%	0.333	54%	0.544	S	S	.	.			trans	-69	118.8	178.6	-177.2	0	0	0	0	109.8	L355 L462 L463 T466	V345-L355 HydrophobicContact CG1-CD1 3.98Å; V345-L462 HydrophobicContact CG2-CD2 3.9Å; V345-L462 HydrophobicContact CG2-CG 4.05Å; V345-L463 HydrophobicContact CG1-CD2 4.37Å; V345-T466 HydrophobicContact CB-CG2 3.95Å; V345-T466 HydrophobicContact CG1-CG2 4.07Å; V345-T466 WeakPolarHBondContact O-CG2 3.27Å
346	S	88.1	Confident	89.3	Confident	62 Å²	62	96.4 Å²	96.4	43%	0.434	53%	0.526	S	S	.	.			trans	-83.4	117.9	173.9	-175.4	0	0	0	0	111	Q344	Q344-S346 PolarHBondContact O-N 2.95Å
347	A	88.3	Confident	89.4	Confident	20 Å²	20	99.5 Å²	99.5	17%	0.165	54%	0.536	C	S	.	.			trans	-106.8	41.2	175.9	0	0	0	0	0	112.5	Q352 L355 T466 L467	A347-Q352 HydrophobicContact CB-CG 4.49Å; A347-Q352 VanDerWaalsContact O-CB 3.29Å; A347-Q352 WeakPolarHBondContact O-CB 3.49Å; A347-Q352 WeakPolarHBondContact O-CG 3.33Å; A347-L355 HydrophobicContact CB-CD1 4.15Å; A347-T466 HydrophobicContact CB-CG2 3.67Å; A347-L467 HydrophobicContact CB-CD2 4.13Å
348	Q	86.6	Confident	89.6	Confident	146 Å²	146	99.3 Å²	99.3	68%	0.682	53%	0.529	S	S	*	.			trans	-85.3	159.1	174.3	-63.2	-177.3	3.4	0	0	111.8	V351 Q352	Q348-V351 PolarHBondContact O-N 3.3Å; Q348-Q352 PolarHBondContact O-N 3.09Å
349	Q	88.6	Confident	89.9	Confident	138 Å²	138	92.5 Å²	92.5	65%	0.645	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	139.2	171.2	-75.5	-78.4	-26.2	0	0	110.6
350	P	82.5	Confident	90.2	Very high	97 Å²	97	94.2 Å²	94.2	63%	0.63	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.9	-16.2	2.1	33.9	-36.1	0	0	0	114.6	Q352 T353	P350-Q352 VanDerWaalsContact C-N 3.25Å; P350-Q352 PolarHBondContact O-N 2.85Å; P350-T353 PolarHBondContact O-N 2.86Å
351	V	89.6	Confident	90.3	Very high	69 Å²	69	97.4 Å²	97.4	42%	0.418	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-28.9	-167.8	-175.4	0	0	0	0	113.1	Q348 T353 E354 L355	Q348-V351 PolarHBondContact O-N 3.3Å; V351-T353 PolarHBondContact O-N 2.77Å; V351-T353 VanDerWaalsContact O-N 3.12Å; V351-E354 PolarHBondContact O-N 3.08Å; V351-E354 VanDerWaalsContact O-N 3.09Å; V351-L355 HydrophobicContact CG1-CD1 4.14Å; V351-L355 HydrophobicContact CG1-CG 4.06Å; V351-L355 WeakPolarHBondContact O-CG 3.47Å; V351-L355 PolarHBondContact O-N 3.37Å; V351-L355 VanDerWaalsContact O-N 3.1Å
352	Q	90.4	Very high	90.8	Very high	68 Å²	68	89.3 Å²	89.3	32%	0.318	46%	0.461	S	S	.	.	H	α-helix	trans	-44.9	-43.4	175.6	-166.5	178.8	26.4	0	0	113.8	A347 Q348 P350 L355 L356 L467	A347-Q352 HydrophobicContact CB-CG 4.49Å; A347-Q352 VanDerWaalsContact O-CB 3.29Å; A347-Q352 WeakPolarHBondContact O-CB 3.49Å; A347-Q352 WeakPolarHBondContact O-CG 3.33Å; Q348-Q352 PolarHBondContact O-N 3.09Å; P350-Q352 VanDerWaalsContact C-N 3.25Å; P350-Q352 PolarHBondContact O-N 2.85Å; Q352-L355 PolarHBondContact O-N 2.67Å; Q352-L356 WeakPolarHBondContact O-CB 3.5Å; Q352-L356 PolarHBondContact O-N 3.32Å; Q352-L467 HydrophobicContact CG-CD2 4.42Å
353	T	88.9	Confident	91.2	Very high	75 Å²	75	89.2 Å²	89.2	46%	0.46	46%	0.455	S	S	.	.	H	α-helix	trans	-67.2	-41.8	-176.8	-50.5	0	0	0	0	111.8	P350 V351 L356 M357	P350-T353 PolarHBondContact O-N 2.86Å; V351-T353 PolarHBondContact O-N 2.77Å; V351-T353 VanDerWaalsContact O-N 3.12Å; T353-L356 PolarHBondContact O-N 3.39Å; T353-M357 WeakPolarHBondContact O-CG 3.07Å; T353-M357 PolarHBondContact O-N 2.71Å
354	E	93.3	Very high	91.7	Very high	142 Å²	142	89 Å²	89	66%	0.664	45%	0.454	S	S	*	.	H	α-helix	trans	-66.4	-40.2	176.6	-63.6	-177.1	-163.9	0	0	111.4	V351 M357 R358	V351-E354 PolarHBondContact O-N 3.08Å; V351-E354 VanDerWaalsContact O-N 3.09Å; E354-M357 PolarHBondContact O-N 2.79Å; E354-R358 VanDerWaalsContact O-CB 3.24Å; E354-R358 WeakPolarHBondContact O-CB 3.39Å; E354-R358 PolarHBondContact O-N 2.69Å
355	L	93.1	Very high	92.1	Very high	20 Å²	20	88.2 Å²	88.2	11%	0.105	44%	0.444	C	S	.	.	H	α-helix	trans	-64.2	-39	175.9	-63.6	-180	0	0	0	112	V345 A347 V351 Q352 R358 Y359 L463 L467	V345-L355 HydrophobicContact CG1-CD1 3.98Å; A347-L355 HydrophobicContact CB-CD1 4.15Å; V351-L355 HydrophobicContact CG1-CD1 4.14Å; V351-L355 HydrophobicContact CG1-CG 4.06Å; V351-L355 WeakPolarHBondContact O-CG 3.47Å; V351-L355 PolarHBondContact O-N 3.37Å; V351-L355 VanDerWaalsContact O-N 3.1Å; Q352-L355 PolarHBondContact O-N 2.67Å; L355-R358 PolarHBondContact O-N 3.24Å; L355-Y359 WeakPolarHBondContact O-CB 3.4Å; L355-Y359 PolarHBondContact O-N 2.9Å; L355-L463 HydrophobicContact CB-CD2 4.34Å; L355-L463 HydrophobicContact CD2-CD2 3.94Å; L355-L467 HydrophobicContact CB-CD2 4.23Å
356	L	93	Very high	92.5	Very high	79 Å²	79	85.9 Å²	85.9	41%	0.414	43%	0.43	S	S	.	.	H	α-helix	trans	-67.3	-43.4	176.5	-175.2	63.3	0	0	0	112.3	Q352 T353 R358 Y359 H360 L467	Q352-L356 WeakPolarHBondContact O-CB 3.5Å; Q352-L356 PolarHBondContact O-N 3.32Å; T353-L356 PolarHBondContact O-N 3.39Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 3.33Å; L356-Y359 HydrophobicContact CD1-CD1 4.44Å; L356-Y359 PolarHBondContact O-N 2.77Å; L356-H360 PolarHBondContact O-CD2 3.11Å; L356-H360 PolarHBondContact O-N 2.88Å; L356-H360 VanDerWaalsContact O-N 3.17Å; L356-L467 HydrophobicContact CB-CD1 4.44Å; L356-L467 HydrophobicContact CD1-CD1 4.2Å
357	M	93.1	Very high	92.9	Very high	139 Å²	139	85.6 Å²	85.6	69%	0.685	43%	0.431	S	S	*	.	H	α-helix	trans	-60.3	-42.6	172.1	-71.5	-174.2	71	0	0	111.5	T353 E354 H360 Q361	T353-M357 WeakPolarHBondContact O-CG 3.07Å; T353-M357 PolarHBondContact O-N 2.71Å; E354-M357 PolarHBondContact O-N 2.79Å; M357-H360 PolarHBondContact O-N 2.69Å; M357-Q361 WeakPolarHBondContact O-CB 3.5Å; M357-Q361 PolarHBondContact O-N 3.41Å
358	R	95.6	Very high	93.3	Very high	147 Å²	147	88 Å²	88	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-65.4	-37.9	177.9	-167.5	177.7	-164.1	168.9	7.5	112.5	E354 L355 L356 Q361 L362 L463	E354-R358 VanDerWaalsContact O-CB 3.24Å; E354-R358 WeakPolarHBondContact O-CB 3.39Å; E354-R358 PolarHBondContact O-N 2.69Å; L355-R358 PolarHBondContact O-N 3.24Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 3.33Å; R358-Q361 PolarHBondContact O-N 2.84Å; R358-L362 HydrophobicContact CG-CD1 4.4Å; R358-L362 WeakPolarHBondContact O-CB 3.43Å; R358-L362 VanDerWaalsContact O-CG 3.29Å; R358-L362 WeakPolarHBondContact O-CG 3.2Å; R358-L362 PolarHBondContact O-N 2.97Å; R358-L463 HydrophobicContact CB-CD1 4.47Å; R358-L463 HydrophobicContact CG-CD1 4.28Å
359	Y	95.1	Very high	93.9	Very high	32 Å²	32	82.3 Å²	82.3	13%	0.125	42%	0.418	C	S	.	.	H	α-helix	trans	-59.3	-53.1	174	166.5	-104.3	0	0	0	111.3	L355 L356 Q361 L362 Q363 H460 L463 K464 L467	L355-Y359 WeakPolarHBondContact O-CB 3.4Å; L355-Y359 PolarHBondContact O-N 2.9Å; L356-Y359 HydrophobicContact CD1-CD1 4.44Å; L356-Y359 PolarHBondContact O-N 2.77Å; Y359-Q361 VanDerWaalsContact C-N 3.33Å; Y359-Q361 PolarHBondContact O-N 3.5Å; Y359-L362 PolarHBondContact O-N 2.87Å; Y359-Q363 WeakPolarHBondContact O-CB 3.28Å; Y359-Q363 PolarHBondContact O-N 3.44Å; Y359-H460 AromaticContact CD2-CD2 3.87Å; Y359-H460 AromaticContact CE2-CD2 3.59Å; Y359-H460 AromaticContact CE2-CE1 3.82Å; Y359-H460 AromaticContact CE2-NE2 3.34Å; Y359-H460 VanDerWaalsContact CE2-NE2 3.34Å; Y359-H460 WeakPolarHBondContact CE2-NE2 3.28Å; Y359-H460 AromaticContact CZ-NE2 3.89Å; Y359-L463 HydrophobicContact CD2-CB 4.39Å; Y359-K464 HydrophobicContact CD2-CB 4.31Å; Y359-K464 HydrophobicContact CE2-CB 3.69Å; Y359-K464 HydrophobicContact CE2-CG 3.93Å; Y359-L467 HydrophobicContact CG-CD1 4.13Å
360	H	94.6	Very high	94.3	Very high	95 Å²	95	80.4 Å²	80.4	44%	0.44	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-35	178.3	-68.6	-54.3	0	0	0	113.2	L356 M357 Q363 S364	L356-H360 PolarHBondContact O-CD2 3.11Å; L356-H360 PolarHBondContact O-N 2.88Å; L356-H360 VanDerWaalsContact O-N 3.17Å; M357-H360 PolarHBondContact O-N 2.69Å; H360-Q363 PolarHBondContact ND1-OE1 2.58Å; H360-Q363 VanDerWaalsContact ND1-OE1 3.14Å; H360-Q363 PolarHBondContact O-N 3.16Å; H360-S364 WeakPolarHBondContact O-CB 3.4Å; H360-S364 PolarHBondContact O-N 3.47Å
361	Q	95.9	Very high	95	Very high	141 Å²	141	80.8 Å²	80.8	66%	0.659	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-42.7	173.7	-169.6	-174.1	43.3	0	0	111.9	M357 R358 Y359 R365	M357-Q361 WeakPolarHBondContact O-CB 3.5Å; M357-Q361 PolarHBondContact O-N 3.41Å; R358-Q361 PolarHBondContact O-N 2.84Å; Y359-Q361 VanDerWaalsContact C-N 3.33Å; Y359-Q361 PolarHBondContact O-N 3.5Å; Q361-R365 WeakPolarHBondContact O-CB 3.43Å; Q361-R365 PolarHBondContact O-N 2.8Å; Q361-R365 VanDerWaalsContact O-N 3.14Å
362	L	96.9	Very high	95.4	Very high	19 Å²	19	82.3 Å²	82.3	10%	0.099	41%	0.406	C	S	.	.	H	α-helix	trans	-66.4	-43.7	174.3	-71.9	169.6	0	0	0	111.6	R358 Y359 S364 R365 L366 L456 K459 H460 L463	R358-L362 HydrophobicContact CG-CD1 4.4Å; R358-L362 WeakPolarHBondContact O-CB 3.43Å; R358-L362 VanDerWaalsContact O-CG 3.29Å; R358-L362 WeakPolarHBondContact O-CG 3.2Å; R358-L362 PolarHBondContact O-N 2.97Å; Y359-L362 PolarHBondContact O-N 2.87Å; L362-S364 PolarHBondContact O-N 3.17Å; L362-R365 PolarHBondContact O-N 3.11Å; L362-L366 VanDerWaalsContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CB 3.49Å; L362-L366 WeakPolarHBondContact O-CD1 3.25Å; L362-L366 VanDerWaalsContact O-CG 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.44Å; L362-L366 PolarHBondContact O-N 3.21Å; L362-L456 HydrophobicContact CD2-CB 4.31Å; L362-L456 HydrophobicContact CD2-CD2 3.71Å; L362-K459 HydrophobicContact CD1-CB 4.13Å; L362-H460 HydrophobicContact CB-CB 4.18Å; L362-L463 HydrophobicContact CD1-CD1 3.95Å
363	Q	96.1	Very high	95.7	Very high	84 Å²	84	79.9 Å²	79.9	39%	0.393	40%	0.395	S	S	.	.	H	α-helix	trans	-57.8	-48.6	179.4	-171.2	-175.7	11	0	0	111.5	Y359 H360 L366 A367	Y359-Q363 WeakPolarHBondContact O-CB 3.28Å; Y359-Q363 PolarHBondContact O-N 3.44Å; H360-Q363 PolarHBondContact ND1-OE1 2.58Å; H360-Q363 VanDerWaalsContact ND1-OE1 3.14Å; H360-Q363 PolarHBondContact O-N 3.16Å; Q363-L366 PolarHBondContact O-N 3.03Å; Q363-A367 PolarHBondContact O-N 3.47Å
364	S	96.8	Very high	96.1	Very high	81 Å²	81	79.3 Å²	79.3	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-62.1	-49.2	176.5	178.4	0	0	0	0	111.8	H360 L362 L366 A367 T368	H360-S364 WeakPolarHBondContact O-CB 3.4Å; H360-S364 PolarHBondContact O-N 3.47Å; L362-S364 PolarHBondContact O-N 3.17Å; S364-L366 VanDerWaalsContact C-N 3.32Å; S364-L366 PolarHBondContact O-N 2.99Å; S364-A367 WeakPolarHBondContact O-CB 3.47Å; S364-A367 PolarHBondContact O-N 3.15Å; S364-A367 VanDerWaalsContact O-N 3.16Å; S364-T368 PolarHBondContact O-N 3.15Å
365	R	97.4	Very high	96.4	Very high	144 Å²	144	78.4 Å²	78.4	54%	0.543	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-35.5	-180	-173.2	172.3	-177.2	159.6	3.7	113.1	Q361 L362 L369 L456	Q361-R365 WeakPolarHBondContact O-CB 3.43Å; Q361-R365 PolarHBondContact O-N 2.8Å; Q361-R365 VanDerWaalsContact O-N 3.14Å; L362-R365 PolarHBondContact O-N 3.11Å; R365-L369 HydrophobicContact CG-CD1 3.89Å; R365-L369 HydrophobicContact CG-CG 4.39Å; R365-L369 WeakPolarHBondContact O-CB 3.21Å; R365-L369 WeakPolarHBondContact O-CG 3.42Å; R365-L369 PolarHBondContact O-N 2.83Å; R365-L369 VanDerWaalsContact O-N 3.1Å; R365-L456 HydrophobicContact CG-CD1 4.24Å
366	L	98	Very high	96.6	Very high	5 Å²	5	78.2 Å²	78.2	3%	0.026	38%	0.383	C	S	.	.	H	α-helix	trans	-66.5	-36.6	175.3	-82	164.6	0	0	0	112.4	L362 Q363 S364 K370 I453 L456 Q457 H460	L362-L366 VanDerWaalsContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CB 3.49Å; L362-L366 WeakPolarHBondContact O-CD1 3.25Å; L362-L366 VanDerWaalsContact O-CG 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.44Å; L362-L366 PolarHBondContact O-N 3.21Å; Q363-L366 PolarHBondContact O-N 3.03Å; S364-L366 VanDerWaalsContact C-N 3.32Å; S364-L366 PolarHBondContact O-N 2.99Å; L366-K370 WeakPolarHBondContact O-CB 3.36Å; L366-K370 VanDerWaalsContact O-CG 3.23Å; L366-K370 WeakPolarHBondContact O-CG 3.42Å; L366-K370 PolarHBondContact O-N 2.97Å; L366-K370 VanDerWaalsContact O-N 3.12Å; L366-I453 HydrophobicContact CD2-CG2 3.85Å; L366-L456 HydrophobicContact CD1-CB 4.48Å; L366-L456 HydrophobicContact CD2-CB 3.8Å; L366-L456 HydrophobicContact CG-CB 4.08Å; L366-Q457 HydrophobicContact CD2-CB 4.1Å; L366-H460 HydrophobicContact CD1-CB 3.51Å
367	A	97	Very high	96.8	Very high	56 Å²	56	78.4 Å²	78.4	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-46.5	177.1	0	0	0	0	0	111.4	Q363 S364 I371	Q363-A367 PolarHBondContact O-N 3.47Å; S364-A367 WeakPolarHBondContact O-CB 3.47Å; S364-A367 PolarHBondContact O-N 3.15Å; S364-A367 VanDerWaalsContact O-N 3.16Å; A367-I371 WeakPolarHBondContact O-CG1 3.46Å
368	T	97.4	Very high	97.1	Very high	72 Å²	72	77.2 Å²	77.2	44%	0.442	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-54.4	176.7	-53	0	0	0	0	112	S364 K370 I371 E372	S364-T368 PolarHBondContact O-N 3.15Å; T368-K370 VanDerWaalsContact C-N 3.26Å; T368-K370 PolarHBondContact O-N 3.21Å; T368-I371 PolarHBondContact O-N 3.09Å; T368-E372 HydrophobicContact CG2-CG 4.46Å; T368-E372 WeakPolarHBondContact CG2-OE1 3.47Å; T368-E372 PolarHBondContact O-N 3.35Å; T368-E372 VanDerWaalsContact O-N 3.15Å
369	L	97.6	Very high	97.2	Very high	25 Å²	25	72.8 Å²	72.8	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-35.8	-176.2	-73.6	169.9	0	0	0	112.7	R365 I371 E372 N373 L452 I453 L456	R365-L369 HydrophobicContact CG-CD1 3.89Å; R365-L369 HydrophobicContact CG-CG 4.39Å; R365-L369 WeakPolarHBondContact O-CB 3.21Å; R365-L369 WeakPolarHBondContact O-CG 3.42Å; R365-L369 PolarHBondContact O-N 2.83Å; R365-L369 VanDerWaalsContact O-N 3.1Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.08Å; L369-E372 PolarHBondContact O-N 3Å; L369-N373 VanDerWaalsContact O-CB 3.26Å; L369-N373 WeakPolarHBondContact O-CB 3.48Å; L369-N373 PolarHBondContact O-N 3.11Å; L369-L452 HydrophobicContact CD1-CD2 3.81Å; L369-L452 HydrophobicContact CD1-CG 3.97Å; L369-L452 HydrophobicContact CD2-CD2 4.04Å; L369-I453 HydrophobicContact CB-CD1 4.27Å; L369-I453 HydrophobicContact CB-CG1 3.8Å; L369-L456 HydrophobicContact CD1-CD1 3.62Å
370	K	97.9	Very high	97.3	Very high	98 Å²	98	71.8 Å²	71.8	43%	0.426	36%	0.355	S	S	.	.	H	α-helix	trans	-65.1	-35	177.4	-78.3	176.9	-177.3	-176.7	0	113	L366 T368 E374 I453 Q457	L366-K370 WeakPolarHBondContact O-CB 3.36Å; L366-K370 VanDerWaalsContact O-CG 3.23Å; L366-K370 WeakPolarHBondContact O-CG 3.42Å; L366-K370 PolarHBondContact O-N 2.97Å; L366-K370 VanDerWaalsContact O-N 3.12Å; T368-K370 VanDerWaalsContact C-N 3.26Å; T368-K370 PolarHBondContact O-N 3.21Å; K370-E374 WeakPolarHBondContact O-CB 3.43Å; K370-E374 PolarHBondContact O-N 2.99Å; K370-E374 VanDerWaalsContact O-N 3.16Å; K370-I453 HydrophobicContact CG-CD1 4.04Å; K370-I453 HydrophobicContact CG-CG1 4.4Å; K370-I453 HydrophobicContact CG-CG2 4.02Å; K370-Q457 VanDerWaalsContact CE-OE1 3.26Å
371	I	97.5	Very high	97.5	Very high	105 Å²	105	69.9 Å²	69.9	54%	0.538	35%	0.348	S	S	.	.	H	α-helix	trans	-70.7	-49.9	176.6	-63.4	166.1	0	0	0	109.4	A367 T368 L369 N373 E374 E375	A367-I371 WeakPolarHBondContact O-CG1 3.46Å; T368-I371 PolarHBondContact O-N 3.09Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.08Å; I371-N373 VanDerWaalsContact C-N 3.34Å; I371-N373 PolarHBondContact O-N 3.16Å; I371-E374 PolarHBondContact O-N 2.84Å; I371-E375 PolarHBondContact O-N 3.26Å
372	E	97.2	Very high	97.6	Very high	101 Å²	101	65.9 Å²	65.9	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-55.8	-47.1	177.8	-65.3	170.5	167.9	0	0	111.7	T368 L369 E374 E375 V376	T368-E372 HydrophobicContact CG2-CG 4.46Å; T368-E372 WeakPolarHBondContact CG2-OE1 3.47Å; T368-E372 PolarHBondContact O-N 3.35Å; T368-E372 VanDerWaalsContact O-N 3.15Å; L369-E372 PolarHBondContact O-N 3Å; E372-E374 PolarHBondContact O-N 2.78Å; E372-E375 PolarHBondContact O-N 3.44Å; E372-V376 WeakPolarHBondContact O-CG2 3.46Å; E372-V376 PolarHBondContact O-N 2.8Å; E372-V376 VanDerWaalsContact O-N 3.16Å
373	N	97.8	Very high	97.6	Very high	17 Å²	17	65.5 Å²	65.5	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-70.8	-29.7	-178.4	-168.5	-124	0	0	0	113.5	L369 I371 V376 R377 Y446 S450 I453	L369-N373 VanDerWaalsContact O-CB 3.26Å; L369-N373 WeakPolarHBondContact O-CB 3.48Å; L369-N373 PolarHBondContact O-N 3.11Å; I371-N373 VanDerWaalsContact C-N 3.34Å; I371-N373 PolarHBondContact O-N 3.16Å; N373-V376 PolarHBondContact O-N 2.93Å; N373-R377 WeakPolarHBondContact O-CB 3.34Å; N373-R377 PolarHBondContact O-N 3.37Å; N373-Y446 PolarHBondContact ND2-O 2.63Å; N373-Y446 WeakPolarHBondContact OD1-CE2 3.49Å; N373-S450 PolarHBondContact ND2-N 2.98Å; N373-I453 HydrophobicContact CB-CD1 3.57Å
374	E	97.8	Very high	97.7	Very high	63 Å²	63	65.1 Å²	65.1	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-71.8	-32.7	174.4	170	63.8	-173.2	0	0	112.4	K370 I371 E372 R377 K378	K370-E374 WeakPolarHBondContact O-CB 3.43Å; K370-E374 PolarHBondContact O-N 2.99Å; K370-E374 VanDerWaalsContact O-N 3.16Å; I371-E374 PolarHBondContact O-N 2.84Å; E372-E374 PolarHBondContact O-N 2.78Å; E374-R377 VanDerWaalsContact CD-NH2 3.25Å; E374-R377 PolarHBondContact O-N 3.05Å; E374-R377 IonicContact OE1-CZ 2.75Å; E374-R377 IonicContact OE1-NH2 3.89Å; E374-R377 PolarHBondContact OE1-NH2 2.72Å; E374-R377 IonicContact OE2-CZ 3.8Å; E374-R377 VanDerWaalsContact OE2-CZ 3.27Å; E374-R377 IonicContact OE2-NE 3.61Å; E374-R377 PolarHBondContact OE2-NE 3.49Å; E374-R377 IonicContact OE2-NH2 2.65Å; E374-R377 PolarHBondContact OE2-NH2 3.44Å; E374-K378 WeakPolarHBondContact O-CG 3.49Å; E374-K378 PolarHBondContact O-N 3.45Å; E374-K378 WeakPolarHBondContact OE1-CE 3.31Å; E374-K378 IonicContact OE1-NZ 3.25Å; E374-K378 PolarHBondContact OE1-NZ 2.95Å
375	E	97.8	Very high	97.7	Very high	123 Å²	123	66 Å²	66	58%	0.575	33%	0.332	S	S	*	.	H	α-helix	trans	-69.1	-40.6	171.3	-69.9	178.1	174.8	0	0	111.6	I371 E372 K378 T379	I371-E375 PolarHBondContact O-N 3.26Å; E372-E375 PolarHBondContact O-N 3.44Å; E375-K378 PolarHBondContact O-N 2.86Å; E375-T379 PolarHBondContact O-N 2.9Å; E375-T379 VanDerWaalsContact O-N 3.09Å; E375-T379 PolarHBondContact O-OG1 3.12Å
376	V	98.1	Very high	97.6	Very high	16 Å²	16	62.3 Å²	62.3	10%	0.097	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-41.9	172.1	179.7	0	0	0	0	111.1	E372 N373 T379 L380 K442 E445	E372-V376 WeakPolarHBondContact O-CG2 3.46Å; E372-V376 PolarHBondContact O-N 2.8Å; E372-V376 VanDerWaalsContact O-N 3.16Å; N373-V376 PolarHBondContact O-N 2.93Å; V376-T379 WeakPolarHBondContact O-CB 3.41Å; V376-T379 PolarHBondContact O-N 3.09Å; V376-L380 WeakPolarHBondContact O-CB 3.47Å; V376-L380 PolarHBondContact O-N 3.14Å; V376-K442 HydrophobicContact CG1-CD 4.03Å; V376-E445 HydrophobicContact CG1-CB 3.96Å; V376-E445 HydrophobicContact CG1-CG 3.95Å; V376-E445 HydrophobicContact CG2-CG 4.1Å; V376-E445 VanDerWaalsContact CG2-OE1 3.22Å; V376-E445 WeakPolarHBondContact CG2-OE1 3.3Å
377	R	97.8	Very high	97.6	Very high	84 Å²	84	63 Å²	63	32%	0.317	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-47.9	175.9	-169.7	-169.9	62.6	85	-7.3	112	N373 E374 T379 L380 D381 Y446	N373-R377 WeakPolarHBondContact O-CB 3.34Å; N373-R377 PolarHBondContact O-N 3.37Å; E374-R377 VanDerWaalsContact CD-NH2 3.25Å; E374-R377 PolarHBondContact O-N 3.05Å; E374-R377 IonicContact OE1-CZ 2.75Å; E374-R377 IonicContact OE1-NH2 3.89Å; E374-R377 PolarHBondContact OE1-NH2 2.72Å; E374-R377 IonicContact OE2-CZ 3.8Å; E374-R377 VanDerWaalsContact OE2-CZ 3.27Å; E374-R377 IonicContact OE2-NE 3.61Å; E374-R377 PolarHBondContact OE2-NE 3.49Å; E374-R377 IonicContact OE2-NH2 2.65Å; E374-R377 PolarHBondContact OE2-NH2 3.44Å; R377-T379 VanDerWaalsContact C-N 3.26Å; R377-T379 PolarHBondContact O-N 3.01Å; R377-L380 WeakPolarHBondContact O-CB 3.26Å; R377-L380 PolarHBondContact O-N 3.27Å; R377-L380 VanDerWaalsContact O-N 3.09Å; R377-D381 IonicContact CZ-OD2 2.78Å; R377-D381 IonicContact NH1-OD2 2.62Å; R377-D381 PolarHBondContact NH1-OD2 3.33Å; R377-D381 VanDerWaalsContact O-CG 3.24Å; R377-D381 PolarHBondContact O-N 3.02Å; R377-Y446 HydrophobicContact CB-CD2 3.91Å; R377-Y446 HydrophobicContact CB-CE2 3.92Å; R377-Y446 HydrophobicContact CG-CD2 4.33Å; R377-Y446 HydrophobicContact CG-CE2 4.03Å
378	K	98.2	Very high	97.5	Very high	114 Å²	114	64.9 Å²	64.9	50%	0.496	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-38.1	175.7	-75.5	166.7	178.5	141	0	112.8	E374 E375 A382	E374-K378 WeakPolarHBondContact O-CG 3.49Å; E374-K378 PolarHBondContact O-N 3.45Å; E374-K378 WeakPolarHBondContact OE1-CE 3.31Å; E374-K378 IonicContact OE1-NZ 3.25Å; E374-K378 PolarHBondContact OE1-NZ 2.95Å; E375-K378 PolarHBondContact O-N 2.86Å; K378-A382 WeakPolarHBondContact O-CB 3.5Å; K378-A382 PolarHBondContact O-N 2.68Å; K378-A382 VanDerWaalsContact O-N 3.1Å
379	T	98	Very high	97.3	Very high	54 Å²	54	66.1 Å²	66.1	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-65.5	-42.7	175.4	-51.6	0	0	0	0	111.1	E375 V376 R377 T383 F438 K442	E375-T379 PolarHBondContact O-N 2.9Å; E375-T379 VanDerWaalsContact O-N 3.09Å; E375-T379 PolarHBondContact O-OG1 3.12Å; V376-T379 WeakPolarHBondContact O-CB 3.41Å; V376-T379 PolarHBondContact O-N 3.09Å; R377-T379 VanDerWaalsContact C-N 3.26Å; R377-T379 PolarHBondContact O-N 3.01Å; T379-T383 WeakPolarHBondContact O-CB 3.35Å; T379-T383 PolarHBondContact O-N 2.66Å; T379-T383 VanDerWaalsContact O-N 3.08Å; T379-T383 PolarHBondContact O-OG1 3.04Å; T379-F438 HydrophobicContact CG2-CE1 3.89Å; T379-F438 HydrophobicContact CG2-CZ 3.93Å; T379-K442 HydrophobicContact CG2-CD 4Å; T379-K442 HydrophobicContact CG2-CG 4.13Å
380	L	98	Very high	97.1	Very high	10 Å²	10	67.7 Å²	67.7	5%	0.052	34%	0.34	C	S	.	.	H	α-helix	trans	-62	-50.3	176.2	178.6	69	0	0	0	111.6	V376 R377 A382 T383 M384 Y439 K442 F443 Y446	V376-L380 WeakPolarHBondContact O-CB 3.47Å; V376-L380 PolarHBondContact O-N 3.14Å; R377-L380 WeakPolarHBondContact O-CB 3.26Å; R377-L380 PolarHBondContact O-N 3.27Å; R377-L380 VanDerWaalsContact O-N 3.09Å; L380-A382 PolarHBondContact O-N 3.3Å; L380-T383 WeakPolarHBondContact O-CB 3.48Å; L380-T383 PolarHBondContact O-N 3.22Å; L380-T383 VanDerWaalsContact O-N 3.15Å; L380-M384 PolarHBondContact O-N 2.72Å; L380-Y439 HydrophobicContact CD1-CD2 3.44Å; L380-Y439 VanDerWaalsContact CD1-CD2 3.44Å; L380-Y439 HydrophobicContact CD1-CE2 3.38Å; L380-Y439 HydrophobicContact CD1-CG 4.11Å; L380-Y439 HydrophobicContact CG-CD2 4.42Å; L380-Y439 HydrophobicContact CG-CE2 4.06Å; L380-K442 HydrophobicContact CB-CB 4.46Å; L380-K442 HydrophobicContact CD1-CB 4.26Å; L380-F443 HydrophobicContact CD1-CB 3.85Å; L380-F443 HydrophobicContact CD2-CB 4.49Å; L380-F443 HydrophobicContact CD2-CD2 3.94Å; L380-Y446 HydrophobicContact CD2-CD1 4.31Å; L380-Y446 HydrophobicContact CD2-CG 4.39Å
381	D	97.8	Very high	96.7	Very high	55 Å²	55	68.1 Å²	68.1	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-42.8	-177.9	-62.5	-27.8	0	0	0	111.6	R377 T383 M384 Q385	R377-D381 IonicContact CZ-OD2 2.78Å; R377-D381 IonicContact NH1-OD2 2.62Å; R377-D381 PolarHBondContact NH1-OD2 3.33Å; R377-D381 VanDerWaalsContact O-CG 3.24Å; R377-D381 PolarHBondContact O-N 3.02Å; D381-T383 VanDerWaalsContact C-N 3.33Å; D381-T383 PolarHBondContact O-N 3.35Å; D381-M384 WeakPolarHBondContact O-CB 3.41Å; D381-M384 PolarHBondContact O-N 3.46Å; D381-Q385 PolarHBondContact O-N 3.27Å
382	A	98	Very high	96.5	Very high	57 Å²	57	68.1 Å²	68.1	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-35.9	174.8	0	0	0	0	0	112.7	K378 L380 M384 T386	K378-A382 WeakPolarHBondContact O-CB 3.5Å; K378-A382 PolarHBondContact O-N 2.68Å; K378-A382 VanDerWaalsContact O-N 3.1Å; L380-A382 PolarHBondContact O-N 3.3Å; A382-M384 VanDerWaalsContact C-N 3.35Å; A382-T386 PolarHBondContact O-N 3.36Å; A382-T386 VanDerWaalsContact O-N 3.09Å; A382-T386 PolarHBondContact O-OG1 3.44Å
383	T	97.8	Very high	96.2	Very high	12 Å²	12	65.9 Å²	65.9	7%	0.074	34%	0.344	C	S	.	.	H	α-helix	trans	-68.1	-37.4	173.6	-49.9	0	0	0	0	110.9	T379 L380 D381 T386 L387 T435 F438	T379-T383 WeakPolarHBondContact O-CB 3.35Å; T379-T383 PolarHBondContact O-N 2.66Å; T379-T383 VanDerWaalsContact O-N 3.08Å; T379-T383 PolarHBondContact O-OG1 3.04Å; L380-T383 WeakPolarHBondContact O-CB 3.48Å; L380-T383 PolarHBondContact O-N 3.22Å; L380-T383 VanDerWaalsContact O-N 3.15Å; D381-T383 VanDerWaalsContact C-N 3.33Å; D381-T383 PolarHBondContact O-N 3.35Å; T383-T386 PolarHBondContact O-N 3.45Å; T383-L387 WeakPolarHBondContact O-CG 3.44Å; T383-L387 PolarHBondContact O-N 3.4Å; T383-T435 HydrophobicContact CG2-CG2 3.75Å; T383-F438 HydrophobicContact CG2-CD1 3.87Å
384	M	97.3	Very high	95.8	Very high	75 Å²	75	73.1 Å²	73.1	37%	0.369	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-44.1	177.6	-162.6	163.8	60.7	0	0	111.8	L380 D381 A382 L387 Q388 Y439	L380-M384 PolarHBondContact O-N 2.72Å; D381-M384 WeakPolarHBondContact O-CB 3.41Å; D381-M384 PolarHBondContact O-N 3.46Å; A382-M384 VanDerWaalsContact C-N 3.35Å; M384-L387 WeakPolarHBondContact O-CB 3.46Å; M384-L387 PolarHBondContact O-N 2.85Å; M384-Q388 WeakPolarHBondContact O-CG 3.47Å; M384-Q388 PolarHBondContact O-N 3.37Å; M384-Y439 HydrophobicContact CB-CD2 4.2Å; M384-Y439 HydrophobicContact CB-CE2 3.79Å; M384-Y439 HydrophobicContact CG-CE2 3.86Å; M384-Y439 HydrophobicContact SD-CE2 3.91Å
385	Q	97.2	Very high	95.2	Very high	101 Å²	101	74.2 Å²	74.2	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-59.6	-46.9	172.3	-172.9	66	61.5	0	0	110.9	D381 L387 Q388 D389	D381-Q385 PolarHBondContact O-N 3.27Å; Q385-L387 PolarHBondContact O-N 2.93Å; Q385-Q388 PolarHBondContact O-N 3.14Å; Q385-D389 PolarHBondContact NE2-OD1 2.95Å; Q385-D389 PolarHBondContact O-N 3.3Å
386	T	96.6	Very high	94.7	Very high	66 Å²	66	75.9 Å²	75.9	41%	0.405	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-34	177.5	-51.4	0	0	0	0	112.3	A382 T383 M390 T435	A382-T386 PolarHBondContact O-N 3.36Å; A382-T386 VanDerWaalsContact O-N 3.09Å; A382-T386 PolarHBondContact O-OG1 3.44Å; T383-T386 PolarHBondContact O-N 3.45Å; T386-M390 HydrophobicContact CG2-CE 4.44Å; T386-M390 WeakPolarHBondContact O-CG 3.48Å; T386-M390 PolarHBondContact O-N 3.2Å; T386-T435 HydrophobicContact CG2-CG2 4.42Å
387	L	95.9	Very high	94.3	Very high	18 Å²	18	80.8 Å²	80.8	9%	0.094	42%	0.416	C	S	.	.	H	α-helix	trans	-71.4	-41.8	173.2	-74.2	168.9	0	0	0	112.2	T383 M384 Q385 M390 L391 T435 E436 Y439	T383-L387 WeakPolarHBondContact O-CG 3.44Å; T383-L387 PolarHBondContact O-N 3.4Å; M384-L387 WeakPolarHBondContact O-CB 3.46Å; M384-L387 PolarHBondContact O-N 2.85Å; Q385-L387 PolarHBondContact O-N 2.93Å; L387-M390 HydrophobicContact CD2-CE 3.95Å; L387-M390 PolarHBondContact O-N 3.47Å; L387-L391 WeakPolarHBondContact O-CB 3.44Å; L387-L391 WeakPolarHBondContact O-CD1 3.47Å; L387-L391 VanDerWaalsContact O-CG 3.23Å; L387-L391 WeakPolarHBondContact O-CG 3.37Å; L387-L391 PolarHBondContact O-N 3.23Å; L387-L391 VanDerWaalsContact O-N 3.09Å; L387-T435 HydrophobicContact CD2-CG2 3.69Å; L387-T435 HydrophobicContact CG-CG2 3.81Å; L387-E436 HydrophobicContact CD2-CG 3.74Å; L387-Y439 HydrophobicContact CD1-CD1 4.47Å; L387-Y439 HydrophobicContact CD1-CD2 4.09Å; L387-Y439 HydrophobicContact CD1-CG 3.82Å
388	Q	95.1	Very high	93.8	Very high	96 Å²	96	81 Å²	81	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-61.7	-47.7	175.1	-70.4	179.4	-72.6	0	0	111	M384 Q385 M390 L391 T392	M384-Q388 WeakPolarHBondContact O-CG 3.47Å; M384-Q388 PolarHBondContact O-N 3.37Å; Q385-Q388 PolarHBondContact O-N 3.14Å; Q388-M390 PolarHBondContact O-N 3.44Å; Q388-M390 VanDerWaalsContact O-N 3.12Å; Q388-L391 PolarHBondContact O-N 2.99Å; Q388-T392 PolarHBondContact O-N 3.31Å; Q388-T392 PolarHBondContact O-OG1 2.79Å; Q388-T392 VanDerWaalsContact O-OG1 3.14Å
389	D	94.5	Very high	93.4	Very high	99 Å²	99	78.8 Å²	78.8	53%	0.529	43%	0.426	S	S	.	.	H	α-helix	trans	-57.9	-27.7	177.9	-59	-12.6	0	0	0	113.1	Q385	Q385-D389 PolarHBondContact NE2-OD1 2.95Å; Q385-D389 PolarHBondContact O-N 3.3Å
390	M	93.2	Very high	92.7	Very high	58 Å²	58	81.8 Å²	81.8	29%	0.286	44%	0.44	S	S	.	.	H	α-helix	trans	-86.9	-19.9	174.4	-73	-168.8	-62.6	0	0	114.3	T386 L387 Q388 N431 T435	T386-M390 HydrophobicContact CG2-CE 4.44Å; T386-M390 WeakPolarHBondContact O-CG 3.48Å; T386-M390 PolarHBondContact O-N 3.2Å; L387-M390 HydrophobicContact CD2-CE 3.95Å; L387-M390 PolarHBondContact O-N 3.47Å; Q388-M390 PolarHBondContact O-N 3.44Å; Q388-M390 VanDerWaalsContact O-N 3.12Å; M390-N431 PolarHBondContact SD-ND2 3.42Å; M390-N431 VanDerWaalsContact SD-ND2 3.4Å; M390-T435 HydrophobicContact CE-CG2 4Å
391	L	90.3	Very high	91.9	Very high	107 Å²	107	84.9 Å²	84.9	56%	0.56	47%	0.467	S	S	*	.	H	α-helix	trans	-98.5	-27.9	-177	-73.4	169.8	0	0	0	113.1	L387 Q388 V393	L387-L391 WeakPolarHBondContact O-CB 3.44Å; L387-L391 WeakPolarHBondContact O-CD1 3.47Å; L387-L391 VanDerWaalsContact O-CG 3.23Å; L387-L391 WeakPolarHBondContact O-CG 3.37Å; L387-L391 PolarHBondContact O-N 3.23Å; L387-L391 VanDerWaalsContact O-N 3.09Å; Q388-L391 PolarHBondContact O-N 2.99Å; L391-V393 VanDerWaalsContact C-N 3.32Å; L391-V393 PolarHBondContact O-N 2.88Å
392	T	91.8	Very high	91.1	Very high	105 Å²	105	89.4 Å²	89.4	64%	0.644	48%	0.484	S	S	*	.	S	Bend	trans	-97.4	40	178.8	66.6	0	0	0	0	111.9	Q388	Q388-T392 PolarHBondContact O-N 3.31Å; Q388-T392 PolarHBondContact O-OG1 2.79Å; Q388-T392 VanDerWaalsContact O-OG1 3.14Å
393	V	91.1	Very high	90.4	Very high	53 Å²	53	92.8 Å²	92.8	32%	0.321	49%	0.49	S	S	.	.			trans	-81.2	130.4	174.2	60.1	0	0	0	0	109.7	L391 D395	L391-V393 VanDerWaalsContact C-N 3.32Å; L391-V393 PolarHBondContact O-N 2.88Å; V393-D395 VanDerWaalsContact C-N 3.3Å; V393-D395 HydrophobicContact CG1-CB 4.42Å; V393-D395 HydrophobicContact CG2-CB 4.44Å; V393-D395 PolarHBondContact O-N 3.32Å
394	E	89.4	Confident	89.1	Confident	169 Å²	169	99.3 Å²	99.3	79%	0.79	52%	0.52	S	S	*	.			trans	-78.6	77.1	179.1	-63.5	176	156.5	0	0	110.1	F396	E394-F396 HydrophobicContact CB-CE1 4.01Å; E394-F396 HydrophobicContact CB-CZ 4.38Å; E394-F396 HydrophobicContact CG-CE1 4.11Å; E394-F396 HydrophobicContact CG-CZ 4.42Å
395	D	86.4	Confident	87.2	Confident	86 Å²	86	100 Å²	100	46%	0.46	53%	0.532	S	S	.	.			trans	-111.1	16	-176.3	71.8	3.2	0	0	0	114.8	V393 M420	V393-D395 VanDerWaalsContact C-N 3.3Å; V393-D395 HydrophobicContact CG1-CB 4.42Å; V393-D395 HydrophobicContact CG2-CB 4.44Å; V393-D395 PolarHBondContact O-N 3.32Å; D395-M420 HydrophobicContact CB-CE 3.53Å; D395-M420 WeakPolarHBondContact OD2-CE 3.23Å
396	F	87.3	Confident	85.2	Confident	159 Å²	159	107.8 Å²	107.8	70%	0.697	56%	0.557	S	S	*	*			trans	-94.1	-11.6	-177.2	55.1	-98.1	0	0	0	115.3	E394 V398	E394-F396 HydrophobicContact CB-CE1 4.01Å; E394-F396 HydrophobicContact CB-CZ 4.38Å; E394-F396 HydrophobicContact CG-CE1 4.11Å; E394-F396 HydrophobicContact CG-CZ 4.42Å; F396-V398 PolarHBondContact O-N 3.1Å
397	D	89.1	Confident	83.2	Confident	118 Å²	118	107.9 Å²	107.9	63%	0.631	56%	0.561	S	S	*	*			trans	-69.4	123.1	173.2	-176.7	10.8	0	0	0	110.6	S399	D397-S399 WeakPolarHBondContact OD1-CB 3.43Å; D397-S399 PolarHBondContact OD1-N 3.23Å; D397-S399 PolarHBondContact OD1-OG 3.15Å
398	V	87.8	Confident	81	Confident	88 Å²	88	114.2 Å²	114.2	53%	0.533	60%	0.6	S	S	.	*			trans	-117.2	14.9	-179.1	-65.6	0	0	0	0	112.7	F396 D400 A401 F402	F396-V398 PolarHBondContact O-N 3.1Å; V398-D400 PolarHBondContact O-N 2.93Å; V398-A401 VanDerWaalsContact O-CB 3.25Å; V398-A401 WeakPolarHBondContact O-CB 3.37Å; V398-A401 PolarHBondContact O-N 2.8Å; V398-F402 HydrophobicContact CG2-CE2 4.11Å
399	S	88.4	Confident	78.7	Confident	68 Å²	68	117.2 Å²	117.2	48%	0.476	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-53.5	-37.8	-177.6	-63.6	0	0	0	0	113.4	D397 A401 F402	D397-S399 WeakPolarHBondContact OD1-CB 3.43Å; D397-S399 PolarHBondContact OD1-N 3.23Å; D397-S399 PolarHBondContact OD1-OG 3.15Å; S399-A401 PolarHBondContact O-N 3.24Å; S399-F402 PolarHBondContact O-N 2.95Å; S399-F402 VanDerWaalsContact O-N 3.09Å
400	D	83.3	Confident	76.5	Confident	117 Å²	117	116.7 Å²	116.7	63%	0.626	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-58.2	-30.7	174.4	-79.7	-8.3	0	0	0	113.3	V398 F402 Q403	V398-D400 PolarHBondContact O-N 2.93Å; D400-F402 PolarHBondContact O-N 2.87Å; D400-Q403 PolarHBondContact O-N 2.76Å; D400-Q403 PolarHBondContact OD1-NE2 3.42Å
401	A	80.9	Confident	74.4	Confident	76 Å²	76	121.9 Å²	121.9	63%	0.628	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-70	-18.7	178.7	0	0	0	0	0	113.2	V398 S399	V398-A401 VanDerWaalsContact O-CB 3.25Å; V398-A401 WeakPolarHBondContact O-CB 3.37Å; V398-A401 PolarHBondContact O-N 2.8Å; S399-A401 PolarHBondContact O-N 3.24Å
402	F	82	Confident	72.5	Confident	149 Å²	149	125.4 Å²	125.4	65%	0.654	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-100.9	1.8	177.6	-63.9	-87.4	0	0	0	113.1	V398 S399 D400 H404	V398-F402 HydrophobicContact CG2-CE2 4.11Å; S399-F402 PolarHBondContact O-N 2.95Å; S399-F402 VanDerWaalsContact O-N 3.09Å; D400-F402 PolarHBondContact O-N 2.87Å; F402-H404 PolarHBondContact O-N 3.01Å; F402-H404 PolarHBondContact O-ND1 3.35Å
403	Q	83.2	Confident	70.5	Confident	128 Å²	128	124.5 Å²	124.5	60%	0.598	65%	0.654	S	S	*	*			trans	-74.9	84.2	175.2	-69.7	-179.5	29.7	0	0	111.7	D400 S405	D400-Q403 PolarHBondContact O-N 2.76Å; D400-Q403 PolarHBondContact OD1-NE2 3.42Å; Q403-S405 PolarHBondContact O-N 3.12Å
404	H	70	Confident	68.4	Low	149 Å²	149	127.7 Å²	127.7	69%	0.69	67%	0.673	S	S	*	*			trans	-69.9	100.2	175.5	-67.4	74.8	0	0	0	110.5	F402 R406	F402-H404 PolarHBondContact O-N 3.01Å; F402-H404 PolarHBondContact O-ND1 3.35Å; H404-R406 PolarHBondContact O-N 3.38Å
405	S	58.4	Low	66.5	Low	91 Å²	91	123.5 Å²	123.5	64%	0.636	67%	0.668	S	S	*	*			trans	-52.5	135.1	168	-80.7	0	0	0	0	110.5	Q403 S407	Q403-S405 PolarHBondContact O-N 3.12Å; S405-S407 PolarHBondContact O-N 3.06Å
406	R	55.7	Low	64.6	Low	263 Å²	263	123 Å²	123	99%	0.992	67%	0.671	S	S	*	*	S	Bend	trans	-71.9	13	-178.6	-67.1	-173	177.4	-173.5	-0.4	114.7	H404	H404-R406 PolarHBondContact O-N 3.38Å
407	S	53.6	Low	62.7	Low	69 Å²	69	124.3 Å²	124.3	48%	0.483	68%	0.68	S	S	.	*	S	Bend	trans	-95.8	138	169.9	-172.3	0	0	0	0	109.4	S405 E409	S405-S407 PolarHBondContact O-N 3.06Å; S407-E409 PolarHBondContact O-N 3.01Å; S407-E409 PolarHBondContact OG-N 3.45Å
408	T	50.5	Low	61.1	Low	150 Å²	150	121.5 Å²	121.5	92%	0.92	67%	0.669	S	S	*	*	S	Bend	trans	-78.8	5.3	176.6	48.3	0	0	0	0	113.4
409	E	46.3	Very low	59.5	Low	160 Å²	160	123.2 Å²	123.2	75%	0.748	67%	0.667	S	S	*	*	S	Bend	trans	-93.8	124.2	176.9	-66.9	-172.8	121.4	0	0	112.2	S407	S407-E409 PolarHBondContact O-N 3.01Å; S407-E409 PolarHBondContact OG-N 3.45Å
410	S	47.2	Very low	58.1	Low	87 Å²	87	123.7 Å²	123.7	61%	0.608	66%	0.663	S	S	*	*			trans	51.1	94	164.8	-166.6	0	0	0	0	118	K412	S410-K412 PolarHBondContact O-N 3.27Å; S410-K412 VanDerWaalsContact O-N 3.08Å; S410-K412 WeakPolarHBondContact OG-CB 3.43Å; S410-K412 PolarHBondContact OG-N 2.77Å; S410-K412 PolarHBondContact OG-O 2.91Å
411	I	50.7	Low	57.4	Low	168 Å²	168	119.9 Å²	119.9	86%	0.862	65%	0.645	S	S	*	*	S	Bend	trans	-61.9	-10.1	159.6	-64.5	170.4	0	0	0	112
412	K	50.1	Low	56.7	Low	180 Å²	180	125.5 Å²	125.5	78%	0.783	66%	0.655	S	S	*	*	S	Bend	trans	-83.5	127.5	172.1	-62.7	175.5	-179.2	173.4	0	110.3	S410	S410-K412 PolarHBondContact O-N 3.27Å; S410-K412 VanDerWaalsContact O-N 3.08Å; S410-K412 WeakPolarHBondContact OG-CB 3.43Å; S410-K412 PolarHBondContact OG-N 2.77Å; S410-K412 PolarHBondContact OG-O 2.91Å
413	S	49.4	Very low	55.9	Low	87 Å²	87	125 Å²	125	61%	0.608	66%	0.659	S	S	*	*	S	Bend	trans	88.5	60.8	166.2	-157	0	0	0	0	119.4	S416	S413-S416 VanDerWaalsContact CA-OG 3.32Å; S413-S416 WeakPolarHBondContact CA-OG 3.47Å; S413-S416 WeakPolarHBondContact CB-OG 3.32Å; S413-S416 PolarHBondContact OG-OG 2.85Å
414	V	47	Very low	55.6	Low	119 Å²	119	122.5 Å²	122.5	72%	0.721	65%	0.649	S	S	*	*	S	Bend	trans	-110.3	-45.2	146.8	-178.8	0	0	0	0	110.7	S416	V414-S416 PolarHBondContact O-N 3.45Å
415	A	48.6	Very low	56.2	Low	82 Å²	82	119 Å²	119	68%	0.678	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-64.8	-9.9	179.8	0	0	0	0	0	115.8	E417	A415-E417 PolarHBondContact O-N 2.95Å
416	S	46.8	Very low	57.5	Low	74 Å²	74	117.4 Å²	117.4	52%	0.517	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-67.5	-32.2	-170.9	-42.9	0	0	0	0	115	S413 V414	S413-S416 VanDerWaalsContact CA-OG 3.32Å; S413-S416 WeakPolarHBondContact CA-OG 3.47Å; S413-S416 WeakPolarHBondContact CB-OG 3.32Å; S413-S416 PolarHBondContact OG-OG 2.85Å; V414-S416 PolarHBondContact O-N 3.45Å
417	E	47.7	Very low	59.1	Low	188 Å²	188	112.7 Å²	112.7	88%	0.879	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-101.3	9	-174.5	-66.1	-168.5	121.8	0	0	113.1	A415	A415-E417 PolarHBondContact O-N 2.95Å
418	S	56.3	Low	60.7	Low	59 Å²	59	113.9 Å²	113.9	41%	0.413	61%	0.608	S	S	.	*	S	Bend	trans	-66.9	165.1	-178.3	-176.8	0	0	0	0	113.6	M420 S421	S418-M420 PolarHBondContact O-N 3.29Å; S418-S421 PolarHBondContact O-N 3.08Å; S418-S421 VanDerWaalsContact O-N 3.07Å
419	Y	53.8	Low	62.6	Low	124 Å²	124	114.1 Å²	114.1	49%	0.486	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-42.9	-22.1	168.3	-174.8	-96	0	0	0	114.4	R428	Y419-R428 VanDerWaalsContact CD1-NH1 3.29Å; Y419-R428 VanDerWaalsContact CE1-CZ 3.41Å; Y419-R428 VanDerWaalsContact CZ-CZ 3.48Å; Y419-R428 PolarHBondContact O-NH1 2.94Å; Y419-R428 VanDerWaalsContact O-NH1 3.14Å; Y419-R428 PolarHBondContact O-NH2 3Å
420	M	59.4	Low	64.8	Low	78 Å²	78	109.2 Å²	109.2	38%	0.384	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96	25.8	179	-67.8	-55.3	-177.8	0	0	115.9	D395 S418 K422 I425	D395-M420 HydrophobicContact CB-CE 3.53Å; D395-M420 WeakPolarHBondContact OD2-CE 3.23Å; S418-M420 PolarHBondContact O-N 3.29Å; M420-K422 PolarHBondContact O-N 2.88Å; M420-I425 HydrophobicContact CB-CD1 4.19Å; M420-I425 VanDerWaalsContact O-CD1 3.25Å; M420-I425 WeakPolarHBondContact O-CD1 3.41Å; M420-I425 HydrophobicContact SD-CD1 4.02Å; M420-I425 HydrophobicContact SD-CG1 4.05Å
421	S	67.4	Low	67.1	Low	37 Å²	37	109.1 Å²	109.1	26%	0.259	57%	0.568	S	S	.	*			trans	-59.5	139.1	171.3	94.5	0	0	0	0	111.6	S418 L423 N424 I425	S418-S421 PolarHBondContact O-N 3.08Å; S418-S421 VanDerWaalsContact O-N 3.07Å; S421-L423 PolarHBondContact O-N 2.91Å; S421-L423 VanDerWaalsContact O-N 3.09Å; S421-N424 PolarHBondContact O-N 2.95Å; S421-N424 VanDerWaalsContact OG-CG 3.25Å; S421-N424 PolarHBondContact OG-N 3.1Å; S421-N424 PolarHBondContact OG-ND2 3.4Å; S421-N424 VanDerWaalsContact OG-ND2 3.15Å; S421-I425 PolarHBondContact O-N 3.41Å
422	K	67.7	Low	69.2	Low	194 Å²	194	103.6 Å²	103.6	84%	0.843	54%	0.539	S	S	*	.	H	α-helix	trans	-55.1	-33.7	-174.5	-68.8	-176.2	178.1	179.8	0	113.7	M420 A426	M420-K422 PolarHBondContact O-N 2.88Å; K422-A426 PolarHBondContact O-N 2.96Å
423	L	64	Low	71.4	Confident	138 Å²	138	99.3 Å²	99.3	72%	0.723	52%	0.521	S	S	*	.	H	α-helix	trans	-72.8	-38.6	178.5	-175	61.6	0	0	0	111.9	S421 K427	S421-L423 PolarHBondContact O-N 2.91Å; S421-L423 VanDerWaalsContact O-N 3.09Å; L423-K427 PolarHBondContact O-N 2.9Å; L423-K427 VanDerWaalsContact O-N 3.14Å
424	N	76.3	Confident	73.6	Confident	75 Å²	75	100.7 Å²	100.7	40%	0.401	52%	0.518	S	S	.	.	H	α-helix	trans	-68.5	-42.3	176.5	-70.5	-17.9	0	0	0	111.3	S421 A426 K427 R428	S421-N424 PolarHBondContact O-N 2.95Å; S421-N424 VanDerWaalsContact OG-CG 3.25Å; S421-N424 PolarHBondContact OG-N 3.1Å; S421-N424 PolarHBondContact OG-ND2 3.4Å; S421-N424 VanDerWaalsContact OG-ND2 3.15Å; N424-A426 PolarHBondContact O-N 3.06Å; N424-K427 PolarHBondContact O-N 3.16Å; N424-R428 PolarHBondContact O-N 2.99Å
425	I	83.3	Confident	76	Confident	75 Å²	75	96.1 Å²	96.1	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-58.1	-48.8	175	-66.1	171	0	0	0	110.7	M420 S421 K427 R428 R429	M420-I425 HydrophobicContact CB-CD1 4.19Å; M420-I425 VanDerWaalsContact O-CD1 3.25Å; M420-I425 WeakPolarHBondContact O-CD1 3.41Å; M420-I425 HydrophobicContact SD-CD1 4.02Å; M420-I425 HydrophobicContact SD-CG1 4.05Å; S421-I425 PolarHBondContact O-N 3.41Å; I425-K427 VanDerWaalsContact C-N 3.33Å; I425-K427 PolarHBondContact O-N 2.64Å; I425-R428 PolarHBondContact O-N 3.49Å; I425-R429 WeakPolarHBondContact O-CB 3.42Å; I425-R429 PolarHBondContact O-N 3.08Å
426	A	86.9	Confident	78.4	Confident	59 Å²	59	95 Å²	95	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-59.7	-42	178.9	0	0	0	0	0	112.4	K422 N424 R429 S430	K422-A426 PolarHBondContact O-N 2.96Å; N424-A426 PolarHBondContact O-N 3.06Å; A426-R429 PolarHBondContact O-N 3.29Å; A426-S430 PolarHBondContact O-N 3.13Å; A426-S430 VanDerWaalsContact O-N 3.11Å
427	K	88.8	Confident	80.8	Confident	163 Å²	163	96.2 Å²	96.2	71%	0.709	48%	0.476	S	S	*	.	H	α-helix	trans	-66.5	-42.6	177.7	-172.8	177.4	178.2	-177.5	0	112.7	L423 N424 I425 S430 N431	L423-K427 PolarHBondContact O-N 2.9Å; L423-K427 VanDerWaalsContact O-N 3.14Å; N424-K427 PolarHBondContact O-N 3.16Å; I425-K427 VanDerWaalsContact C-N 3.33Å; I425-K427 PolarHBondContact O-N 2.64Å; K427-S430 PolarHBondContact O-N 2.88Å; K427-N431 PolarHBondContact O-N 2.99Å
428	R	86.3	Confident	83.2	Confident	95 Å²	95	91.9 Å²	91.9	36%	0.358	45%	0.454	S	S	.	.	H	α-helix	trans	-60.4	-45.4	174.7	-73.2	-174.4	-169.2	132.3	6.7	111.3	Y419 N424 I425 S430 N431 Q432	Y419-R428 VanDerWaalsContact CD1-NH1 3.29Å; Y419-R428 VanDerWaalsContact CE1-CZ 3.41Å; Y419-R428 VanDerWaalsContact CZ-CZ 3.48Å; Y419-R428 PolarHBondContact O-NH1 2.94Å; Y419-R428 VanDerWaalsContact O-NH1 3.14Å; Y419-R428 PolarHBondContact O-NH2 3Å; N424-R428 PolarHBondContact O-N 2.99Å; I425-R428 PolarHBondContact O-N 3.49Å; R428-S430 VanDerWaalsContact C-N 3.33Å; R428-S430 PolarHBondContact O-N 2.87Å; R428-N431 PolarHBondContact O-N 3.07Å; R428-Q432 WeakPolarHBondContact O-CB 3.35Å; R428-Q432 PolarHBondContact O-N 2.99Å
429	R	90.4	Very high	85.2	Confident	155 Å²	155	91.2 Å²	91.2	59%	0.585	44%	0.443	S	S	*	.	H	α-helix	trans	-61.6	-37.3	179.6	-171.6	173.5	-178.5	150.8	4.4	113	I425 A426 Q433	I425-R429 WeakPolarHBondContact O-CB 3.42Å; I425-R429 PolarHBondContact O-N 3.08Å; A426-R429 PolarHBondContact O-N 3.29Å; R429-Q433 WeakPolarHBondContact O-CB 3.39Å; R429-Q433 VanDerWaalsContact O-CG 3.26Å; R429-Q433 WeakPolarHBondContact O-CG 3.45Å; R429-Q433 PolarHBondContact O-N 3.39Å
430	S	92.9	Very high	87.3	Confident	57 Å²	57	91.7 Å²	91.7	40%	0.399	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-53.2	172.1	-161.4	0	0	0	0	111	A426 K427 R428 Q432 Q433 E434	A426-S430 PolarHBondContact O-N 3.13Å; A426-S430 VanDerWaalsContact O-N 3.11Å; K427-S430 PolarHBondContact O-N 2.88Å; R428-S430 VanDerWaalsContact C-N 3.33Å; R428-S430 PolarHBondContact O-N 2.87Å; S430-Q432 VanDerWaalsContact C-N 3.29Å; S430-Q432 PolarHBondContact O-N 3.47Å; S430-Q433 PolarHBondContact O-N 3.45Å; S430-Q433 VanDerWaalsContact O-N 3.08Å; S430-E434 VanDerWaalsContact C-OE1 3.24Å; S430-E434 WeakPolarHBondContact CB-OE1 3.4Å; S430-E434 WeakPolarHBondContact O-CB 3.19Å; S430-E434 VanDerWaalsContact O-CG 3.3Å; S430-E434 WeakPolarHBondContact O-CG 3.41Å; S430-E434 PolarHBondContact O-N 2.83Å; S430-E434 PolarHBondContact OG-OE1 3.26Å
431	N	94.6	Very high	89.2	Confident	84 Å²	84	91.3 Å²	91.3	45%	0.449	45%	0.453	S	S	.	.	H	α-helix	trans	-58.6	-39.6	179.6	-174.9	80.6	0	0	0	112.7	M390 K427 R428 T435	M390-N431 PolarHBondContact SD-ND2 3.42Å; M390-N431 VanDerWaalsContact SD-ND2 3.4Å; K427-N431 PolarHBondContact O-N 2.99Å; R428-N431 PolarHBondContact O-N 3.07Å; N431-T435 WeakPolarHBondContact O-CB 3.42Å; N431-T435 PolarHBondContact O-N 3.49Å; N431-T435 PolarHBondContact O-OG1 2.84Å
432	Q	95	Very high	90.7	Very high	53 Å²	53	91.3 Å²	91.3	25%	0.248	45%	0.448	C	S	.	.	H	α-helix	trans	-60.5	-52.9	172.8	-177.1	-168.4	-21.4	0	0	110.8	R428 S430 E434 T435 E436	R428-Q432 WeakPolarHBondContact O-CB 3.35Å; R428-Q432 PolarHBondContact O-N 2.99Å; S430-Q432 VanDerWaalsContact C-N 3.29Å; S430-Q432 PolarHBondContact O-N 3.47Å; Q432-E434 VanDerWaalsContact C-N 3.32Å; Q432-E434 PolarHBondContact O-N 3.21Å; Q432-T435 CarbonylContact O-C 3.54Å; Q432-T435 WeakPolarHBondContact O-CA 3.36Å; Q432-T435 WeakPolarHBondContact O-CB 3.12Å; Q432-T435 PolarHBondContact O-N 3.07Å; Q432-E436 HydrophobicContact CG-CG 4.44Å; Q432-E436 WeakPolarHBondContact CG-OE1 3.24Å; Q432-E436 PolarHBondContact NE2-OE1 3.32Å; Q432-E436 WeakPolarHBondContact O-CG 3.21Å; Q432-E436 PolarHBondContact O-N 2.89Å
433	Q	96.3	Very high	92.1	Very high	89 Å²	89	85.7 Å²	85.7	42%	0.416	42%	0.424	S	S	.	.	H	α-helix	trans	-64.3	-33.8	-178.8	-72.6	178.4	-29.1	0	0	113.2	R429 S430 T437	R429-Q433 WeakPolarHBondContact O-CB 3.39Å; R429-Q433 VanDerWaalsContact O-CG 3.26Å; R429-Q433 WeakPolarHBondContact O-CG 3.45Å; R429-Q433 PolarHBondContact O-N 3.39Å; S430-Q433 PolarHBondContact O-N 3.45Å; S430-Q433 VanDerWaalsContact O-N 3.08Å; Q433-T437 VanDerWaalsContact O-CB 3.32Å; Q433-T437 WeakPolarHBondContact O-CB 3.32Å; Q433-T437 PolarHBondContact O-N 3.13Å; Q433-T437 PolarHBondContact O-OG1 3.46Å
434	E	97.3	Very high	93.7	Very high	116 Å²	116	86 Å²	86	54%	0.542	42%	0.419	S	S	.	.	H	α-helix	trans	-64.7	-41.6	171.4	-70.8	163.1	-121.9	0	0	111	S430 Q432 T437 F438	S430-E434 VanDerWaalsContact C-OE1 3.24Å; S430-E434 WeakPolarHBondContact CB-OE1 3.4Å; S430-E434 WeakPolarHBondContact O-CB 3.19Å; S430-E434 VanDerWaalsContact O-CG 3.3Å; S430-E434 WeakPolarHBondContact O-CG 3.41Å; S430-E434 PolarHBondContact O-N 2.83Å; S430-E434 PolarHBondContact OG-OE1 3.26Å; Q432-E434 VanDerWaalsContact C-N 3.32Å; Q432-E434 PolarHBondContact O-N 3.21Å; E434-T437 PolarHBondContact O-N 3.2Å; E434-F438 PolarHBondContact O-N 2.86Å
435	T	97.3	Very high	94.8	Very high	23 Å²	23	86.3 Å²	86.3	14%	0.141	42%	0.418	C	S	.	.	H	α-helix	trans	-69.9	-40.8	176.6	-51.7	0	0	0	0	112.2	T383 T386 L387 M390 N431 Q432 T437 F438 Y439	T383-T435 HydrophobicContact CG2-CG2 3.75Å; T386-T435 HydrophobicContact CG2-CG2 4.42Å; L387-T435 HydrophobicContact CD2-CG2 3.69Å; L387-T435 HydrophobicContact CG-CG2 3.81Å; M390-T435 HydrophobicContact CE-CG2 4Å; N431-T435 WeakPolarHBondContact O-CB 3.42Å; N431-T435 PolarHBondContact O-N 3.49Å; N431-T435 PolarHBondContact O-OG1 2.84Å; Q432-T435 CarbonylContact O-C 3.54Å; Q432-T435 WeakPolarHBondContact O-CA 3.36Å; Q432-T435 WeakPolarHBondContact O-CB 3.12Å; Q432-T435 PolarHBondContact O-N 3.07Å; T435-T437 VanDerWaalsContact C-N 3.34Å; T435-T437 PolarHBondContact O-N 2.97Å; T435-F438 PolarHBondContact O-N 3.38Å; T435-Y439 WeakPolarHBondContact O-CB 3.47Å; T435-Y439 PolarHBondContact O-N 3.12Å
436	E	97.6	Very high	95.5	Very high	59 Å²	59	85.6 Å²	85.6	28%	0.276	41%	0.411	S	S	.	.	H	α-helix	trans	-59.2	-45.2	172.3	-71.9	168.3	178.2	0	0	110.8	L387 Q432 F438 Y439 F440	L387-E436 HydrophobicContact CD2-CG 3.74Å; Q432-E436 HydrophobicContact CG-CG 4.44Å; Q432-E436 WeakPolarHBondContact CG-OE1 3.24Å; Q432-E436 PolarHBondContact NE2-OE1 3.32Å; Q432-E436 WeakPolarHBondContact O-CG 3.21Å; Q432-E436 PolarHBondContact O-N 2.89Å; E436-F438 VanDerWaalsContact C-N 3.33Å; E436-F438 PolarHBondContact O-N 3.48Å; E436-Y439 WeakPolarHBondContact O-CB 3.49Å; E436-Y439 PolarHBondContact O-N 2.75Å; E436-F440 WeakPolarHBondContact O-CD2 3.25Å; E436-F440 PolarHBondContact O-N 3.39Å
437	T	97.9	Very high	96	Very high	100 Å²	100	86 Å²	86	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-62	-41	177.3	-59.5	0	0	0	0	111.4	Q433 E434 T435 S441	Q433-T437 VanDerWaalsContact O-CB 3.32Å; Q433-T437 WeakPolarHBondContact O-CB 3.32Å; Q433-T437 PolarHBondContact O-N 3.13Å; Q433-T437 PolarHBondContact O-OG1 3.46Å; E434-T437 PolarHBondContact O-N 3.2Å; T435-T437 VanDerWaalsContact C-N 3.34Å; T435-T437 PolarHBondContact O-N 2.97Å; T437-S441 WeakPolarHBondContact O-CB 3.43Å; T437-S441 PolarHBondContact O-N 3.1Å
438	F	98.4	Very high	96.4	Very high	97 Å²	97	83.1 Å²	83.1	43%	0.425	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-43	174.8	-174	-107.7	0	0	0	112.3	T379 T383 E434 T435 E436 S441 K442	T379-F438 HydrophobicContact CG2-CE1 3.89Å; T379-F438 HydrophobicContact CG2-CZ 3.93Å; T383-F438 HydrophobicContact CG2-CD1 3.87Å; E434-F438 PolarHBondContact O-N 2.86Å; T435-F438 PolarHBondContact O-N 3.38Å; E436-F438 VanDerWaalsContact C-N 3.33Å; E436-F438 PolarHBondContact O-N 3.48Å; F438-S441 WeakPolarHBondContact O-CB 3.48Å; F438-S441 PolarHBondContact O-N 3.36Å; F438-K442 HydrophobicContact CE1-CG 4.13Å; F438-K442 HydrophobicContact CE2-CG 4.29Å; F438-K442 HydrophobicContact CZ-CG 3.98Å; F438-K442 PolarHBondContact O-N 3.49Å
439	Y	98.4	Very high	96.9	Very high	45 Å²	45	79.5 Å²	79.5	18%	0.176	39%	0.389	C	S	.	.	H	α-helix	trans	-56.5	-53.2	174.3	173.1	-91.8	0	0	0	111.6	L380 M384 L387 T435 E436 S441 K442 F443	L380-Y439 HydrophobicContact CD1-CD2 3.44Å; L380-Y439 VanDerWaalsContact CD1-CD2 3.44Å; L380-Y439 HydrophobicContact CD1-CE2 3.38Å; L380-Y439 HydrophobicContact CD1-CG 4.11Å; L380-Y439 HydrophobicContact CG-CD2 4.42Å; L380-Y439 HydrophobicContact CG-CE2 4.06Å; M384-Y439 HydrophobicContact CB-CD2 4.2Å; M384-Y439 HydrophobicContact CB-CE2 3.79Å; M384-Y439 HydrophobicContact CG-CE2 3.86Å; M384-Y439 HydrophobicContact SD-CE2 3.91Å; L387-Y439 HydrophobicContact CD1-CD1 4.47Å; L387-Y439 HydrophobicContact CD1-CD2 4.09Å; L387-Y439 HydrophobicContact CD1-CG 3.82Å; T435-Y439 WeakPolarHBondContact O-CB 3.47Å; T435-Y439 PolarHBondContact O-N 3.12Å; E436-Y439 WeakPolarHBondContact O-CB 3.49Å; E436-Y439 PolarHBondContact O-N 2.75Å; Y439-S441 VanDerWaalsContact C-N 3.3Å; Y439-S441 PolarHBondContact O-N 2.95Å; Y439-K442 CarbonylContact O-C 3.6Å; Y439-K442 PolarHBondContact O-N 3.44Å; Y439-K442 VanDerWaalsContact O-N 3.17Å; Y439-F443 WeakPolarHBondContact O-CB 3.26Å; Y439-F443 PolarHBondContact O-N 2.99Å
440	F	98.3	Very high	97.3	Very high	134 Å²	134	73.4 Å²	73.4	59%	0.588	37%	0.37	S	S	*	.	H	α-helix	trans	-65.1	-33	-180	-76.7	-64.7	0	0	0	112.9	E436 K444	E436-F440 WeakPolarHBondContact O-CD2 3.25Å; E436-F440 PolarHBondContact O-N 3.39Å; F440-K444 WeakPolarHBondContact O-CB 3.42Å; F440-K444 PolarHBondContact O-N 3.11Å
441	S	98.3	Very high	97.5	Very high	69 Å²	69	74.2 Å²	74.2	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-60.9	-49.8	171.5	-168.7	0	0	0	0	111.3	T437 F438 Y439 K444 E445	T437-S441 WeakPolarHBondContact O-CB 3.43Å; T437-S441 PolarHBondContact O-N 3.1Å; F438-S441 WeakPolarHBondContact O-CB 3.48Å; F438-S441 PolarHBondContact O-N 3.36Å; Y439-S441 VanDerWaalsContact C-N 3.3Å; Y439-S441 PolarHBondContact O-N 2.95Å; S441-K444 PolarHBondContact O-N 3.39Å; S441-E445 PolarHBondContact O-N 3.32Å
442	K	98.1	Very high	97.7	Very high	38 Å²	38	73.2 Å²	73.2	17%	0.165	37%	0.365	C	S	.	.	H	α-helix	trans	-69.8	-31.6	178.2	-74.2	-72.5	165.9	-163.2	0	113.4	V376 T379 L380 F438 Y439 E445 Y446	V376-K442 HydrophobicContact CG1-CD 4.03Å; T379-K442 HydrophobicContact CG2-CD 4Å; T379-K442 HydrophobicContact CG2-CG 4.13Å; L380-K442 HydrophobicContact CB-CB 4.46Å; L380-K442 HydrophobicContact CD1-CB 4.26Å; F438-K442 HydrophobicContact CE1-CG 4.13Å; F438-K442 HydrophobicContact CE2-CG 4.29Å; F438-K442 HydrophobicContact CZ-CG 3.98Å; F438-K442 PolarHBondContact O-N 3.49Å; Y439-K442 CarbonylContact O-C 3.6Å; Y439-K442 PolarHBondContact O-N 3.44Å; Y439-K442 VanDerWaalsContact O-N 3.17Å; K442-E445 WeakPolarHBondContact CD-OE2 3.48Å; K442-E445 WeakPolarHBondContact CE-OE2 3.05Å; K442-E445 IonicContact NZ-OE1 2.62Å; K442-E445 PolarHBondContact NZ-OE1 3.4Å; K442-E445 IonicContact NZ-OE2 2.71Å; K442-E445 PolarHBondContact NZ-OE2 3.38Å; K442-E445 PolarHBondContact O-N 2.62Å; K442-Y446 WeakPolarHBondContact O-CB 3.36Å; K442-Y446 PolarHBondContact O-N 2.86Å
443	F	98.4	Very high	97.8	Very high	76 Å²	76	71.6 Å²	71.6	33%	0.333	36%	0.358	S	S	.	.	H	α-helix	trans	-65.1	-43.7	173.7	-176.9	-123	0	0	0	111.2	L380 Y439 Y446 L447	L380-F443 HydrophobicContact CD1-CB 3.85Å; L380-F443 HydrophobicContact CD2-CB 4.49Å; L380-F443 HydrophobicContact CD2-CD2 3.94Å; Y439-F443 WeakPolarHBondContact O-CB 3.26Å; Y439-F443 PolarHBondContact O-N 2.99Å; F443-Y446 PolarHBondContact O-N 3.36Å; F443-L447 HydrophobicContact CD1-CD1 4.01Å; F443-L447 HydrophobicContact CD2-CG 4.37Å; F443-L447 HydrophobicContact CE1-CD1 3.59Å; F443-L447 HydrophobicContact CE1-CG 4.39Å; F443-L447 HydrophobicContact CE2-CD1 4.15Å; F443-L447 HydrophobicContact CE2-CD2 4.3Å; F443-L447 HydrophobicContact CE2-CG 4.1Å; F443-L447 HydrophobicContact CG-CD1 4.47Å; F443-L447 HydrophobicContact CZ-CD1 3.67Å; F443-L447 HydrophobicContact CZ-CD2 4.33Å; F443-L447 HydrophobicContact CZ-CG 4.12Å; F443-L447 WeakPolarHBondContact O-CB 3.18Å; F443-L447 WeakPolarHBondContact O-CG 3.18Å; F443-L447 PolarHBondContact O-N 3.14Å
444	K	98.1	Very high	97.9	Very high	143 Å²	143	72.5 Å²	72.5	62%	0.622	36%	0.364	S	S	*	.	H	α-helix	trans	-63.1	-40.5	174.1	-177.3	178.7	-180	179.6	0	112.1	F440 S441 N448	F440-K444 WeakPolarHBondContact O-CB 3.42Å; F440-K444 PolarHBondContact O-N 3.11Å; S441-K444 PolarHBondContact O-N 3.39Å; K444-N448 WeakPolarHBondContact O-CB 3.24Å; K444-N448 PolarHBondContact O-N 3.19Å; K444-N448 VanDerWaalsContact O-N 3.1Å; K444-N448 PolarHBondContact O-ND2 3.43Å
445	E	98	Very high	97.9	Very high	82 Å²	82	73.3 Å²	73.3	38%	0.383	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-47.1	174.5	-168.3	179.3	152.8	0	0	111.4	V376 S441 K442 N448 G449	V376-E445 HydrophobicContact CG1-CB 3.96Å; V376-E445 HydrophobicContact CG1-CG 3.95Å; V376-E445 HydrophobicContact CG2-CG 4.1Å; V376-E445 VanDerWaalsContact CG2-OE1 3.22Å; V376-E445 WeakPolarHBondContact CG2-OE1 3.3Å; S441-E445 PolarHBondContact O-N 3.32Å; K442-E445 WeakPolarHBondContact CD-OE2 3.48Å; K442-E445 WeakPolarHBondContact CE-OE2 3.05Å; K442-E445 IonicContact NZ-OE1 2.62Å; K442-E445 PolarHBondContact NZ-OE1 3.4Å; K442-E445 IonicContact NZ-OE2 2.71Å; K442-E445 PolarHBondContact NZ-OE2 3.38Å; K442-E445 PolarHBondContact O-N 2.62Å; E445-N448 PolarHBondContact O-N 2.97Å; E445-G449 PolarHBondContact O-N 2.82Å
446	Y	98.3	Very high	98	Very high	60 Å²	60	73.4 Å²	73.4	24%	0.235	37%	0.365	C	S	.	.	H	α-helix	trans	-58.6	-50.8	176.1	171.8	-106.7	0	0	0	112.2	N373 R377 L380 K442 F443 N448 G449 S450	N373-Y446 PolarHBondContact ND2-O 2.63Å; N373-Y446 WeakPolarHBondContact OD1-CE2 3.49Å; R377-Y446 HydrophobicContact CB-CD2 3.91Å; R377-Y446 HydrophobicContact CB-CE2 3.92Å; R377-Y446 HydrophobicContact CG-CD2 4.33Å; R377-Y446 HydrophobicContact CG-CE2 4.03Å; L380-Y446 HydrophobicContact CD2-CD1 4.31Å; L380-Y446 HydrophobicContact CD2-CG 4.39Å; K442-Y446 WeakPolarHBondContact O-CB 3.36Å; K442-Y446 PolarHBondContact O-N 2.86Å; F443-Y446 PolarHBondContact O-N 3.36Å; Y446-N448 VanDerWaalsContact C-N 3.33Å; Y446-N448 PolarHBondContact O-N 3.21Å; Y446-G449 PolarHBondContact O-N 3.26Å; Y446-S450 VanDerWaalsContact O-CB 3.29Å; Y446-S450 WeakPolarHBondContact O-CB 3.38Å; Y446-S450 PolarHBondContact O-N 3.23Å
447	L	97.8	Very high	98	Very high	69 Å²	69	72.5 Å²	72.5	36%	0.361	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-40.4	178.7	-75.1	179.1	0	0	0	112	F443 N451	F443-L447 HydrophobicContact CD1-CD1 4.01Å; F443-L447 HydrophobicContact CD2-CG 4.37Å; F443-L447 HydrophobicContact CE1-CD1 3.59Å; F443-L447 HydrophobicContact CE1-CG 4.39Å; F443-L447 HydrophobicContact CE2-CD1 4.15Å; F443-L447 HydrophobicContact CE2-CD2 4.3Å; F443-L447 HydrophobicContact CE2-CG 4.1Å; F443-L447 HydrophobicContact CG-CD1 4.47Å; F443-L447 HydrophobicContact CZ-CD1 3.67Å; F443-L447 HydrophobicContact CZ-CD2 4.33Å; F443-L447 HydrophobicContact CZ-CG 4.12Å; F443-L447 WeakPolarHBondContact O-CB 3.18Å; F443-L447 WeakPolarHBondContact O-CG 3.18Å; F443-L447 PolarHBondContact O-N 3.14Å; L447-N451 WeakPolarHBondContact O-CB 3.43Å; L447-N451 VanDerWaalsContact O-CG 3.31Å; L447-N451 PolarHBondContact O-N 2.73Å; L447-N451 PolarHBondContact O-ND2 3.39Å
448	N	97.1	Very high	97.9	Very high	102 Å²	102	70.8 Å²	70.8	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-42.4	178.3	-77.9	-48.8	0	0	0	112.1	K444 E445 Y446 L452	K444-N448 WeakPolarHBondContact O-CB 3.24Å; K444-N448 PolarHBondContact O-N 3.19Å; K444-N448 VanDerWaalsContact O-N 3.1Å; K444-N448 PolarHBondContact O-ND2 3.43Å; E445-N448 PolarHBondContact O-N 2.97Å; Y446-N448 VanDerWaalsContact C-N 3.33Å; Y446-N448 PolarHBondContact O-N 3.21Å; N448-L452 PolarHBondContact O-N 3.31Å
449	G	97.6	Very high	97.8	Very high	18 Å²	18	72.3 Å²	72.3	19%	0.186	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-48.1	174.6	0	0	0	0	0	112.7	E445 Y446 N451 L452 I453	E445-G449 PolarHBondContact O-N 2.82Å; Y446-G449 PolarHBondContact O-N 3.26Å; G449-N451 VanDerWaalsContact C-N 3.35Å; G449-N451 PolarHBondContact O-N 3.08Å; G449-L452 WeakPolarHBondContact O-CB 3.25Å; G449-L452 PolarHBondContact O-N 3.45Å; G449-I453 WeakPolarHBondContact O-CA 3.24Å; G449-I453 WeakPolarHBondContact O-CG1 3.37Å; G449-I453 PolarHBondContact O-N 3.48Å
450	S	98.1	Very high	97.7	Very high	27 Å²	27	71 Å²	71	19%	0.189	36%	0.359	C	S	.	.	H	α-helix	trans	-64.2	-35.8	179.4	-176.8	0	0	0	0	112.7	N373 Y446 L452 I453 I454	N373-S450 PolarHBondContact ND2-N 2.98Å; Y446-S450 VanDerWaalsContact O-CB 3.29Å; Y446-S450 WeakPolarHBondContact O-CB 3.38Å; Y446-S450 PolarHBondContact O-N 3.23Å; S450-L452 VanDerWaalsContact C-N 3.33Å; S450-L452 PolarHBondContact O-N 3.05Å; S450-I453 VanDerWaalsContact O-CA 3.28Å; S450-I453 WeakPolarHBondContact O-CA 3.38Å; S450-I454 WeakPolarHBondContact O-CD1 3.45Å; S450-I454 WeakPolarHBondContact O-CG1 3.36Å; S450-I454 PolarHBondContact O-N 3.21Å
451	N	97.8	Very high	97.6	Very high	75 Å²	75	67.8 Å²	67.8	40%	0.401	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-31.5	170.9	-83.7	-57.5	0	0	0	113.1	L447 G449 K455	L447-N451 WeakPolarHBondContact O-CB 3.43Å; L447-N451 VanDerWaalsContact O-CG 3.31Å; L447-N451 PolarHBondContact O-N 2.73Å; L447-N451 PolarHBondContact O-ND2 3.39Å; G449-N451 VanDerWaalsContact C-N 3.35Å; G449-N451 PolarHBondContact O-N 3.08Å; N451-K455 WeakPolarHBondContact O-CB 3.26Å; N451-K455 VanDerWaalsContact O-CD 3.28Å; N451-K455 WeakPolarHBondContact O-CD 3.48Å; N451-K455 WeakPolarHBondContact O-CG 3.42Å; N451-K455 PolarHBondContact O-N 3.33Å
452	L	97.7	Very high	97.4	Very high	63 Å²	63	68.9 Å²	68.9	33%	0.33	35%	0.348	S	S	.	.	H	α-helix	trans	-76.9	-58.6	178	-179.7	60.5	0	0	0	111.9	L369 N448 G449 S450 K455 L456	L369-L452 HydrophobicContact CD1-CD2 3.81Å; L369-L452 HydrophobicContact CD1-CG 3.97Å; L369-L452 HydrophobicContact CD2-CD2 4.04Å; N448-L452 PolarHBondContact O-N 3.31Å; G449-L452 WeakPolarHBondContact O-CB 3.25Å; G449-L452 PolarHBondContact O-N 3.45Å; S450-L452 VanDerWaalsContact C-N 3.33Å; S450-L452 PolarHBondContact O-N 3.05Å; L452-K455 PolarHBondContact O-N 3.35Å; L452-L456 HydrophobicContact CD1-CD1 3.95Å; L452-L456 HydrophobicContact CD1-CG 4.04Å; L452-L456 HydrophobicContact CG-CD1 4Å; L452-L456 HydrophobicContact CG-CG 4.43Å; L452-L456 WeakPolarHBondContact O-CG 3.45Å; L452-L456 PolarHBondContact O-N 3.37Å
453	I	97.9	Very high	97.3	Very high	19 Å²	19	67.8 Å²	67.8	10%	0.097	34%	0.344	C	S	.	.	H	α-helix		24	-108.6	124.6	-4.5	143.3	0	0	0	118.6	L366 L369 K370 N373 G449 S450 K455 L456 Q457	L366-I453 HydrophobicContact CD2-CG2 3.85Å; L369-I453 HydrophobicContact CB-CD1 4.27Å; L369-I453 HydrophobicContact CB-CG1 3.8Å; K370-I453 HydrophobicContact CG-CD1 4.04Å; K370-I453 HydrophobicContact CG-CG1 4.4Å; K370-I453 HydrophobicContact CG-CG2 4.02Å; N373-I453 HydrophobicContact CB-CD1 3.57Å; G449-I453 WeakPolarHBondContact O-CA 3.24Å; G449-I453 WeakPolarHBondContact O-CG1 3.37Å; G449-I453 PolarHBondContact O-N 3.48Å; S450-I453 VanDerWaalsContact O-CA 3.28Å; S450-I453 WeakPolarHBondContact O-CA 3.38Å; I453-K455 VanDerWaalsContact C-N 3.3Å; I453-K455 PolarHBondContact O-N 2.96Å; I453-L456 PolarHBondContact O-N 2.92Å; I453-L456 VanDerWaalsContact O-N 3.16Å; I453-Q457 WeakPolarHBondContact O-CB 3.32Å; I453-Q457 PolarHBondContact O-N 3.39Å
454	I	97.9	Very high	97	Very high	107 Å²	107	69.7 Å²	69.7	55%	0.549	35%	0.352	S	S	.	.	H	α-helix	trans	-52.4	-43.9	-179.7	-65.4	161.9	0	0	0	111.5	S450 L456 Q457 A458	S450-I454 WeakPolarHBondContact O-CD1 3.45Å; S450-I454 WeakPolarHBondContact O-CG1 3.36Å; S450-I454 PolarHBondContact O-N 3.21Å; I454-L456 VanDerWaalsContact C-N 3.34Å; I454-L456 PolarHBondContact O-N 2.91Å; I454-Q457 PolarHBondContact O-N 2.88Å; I454-A458 WeakPolarHBondContact O-CB 3.24Å; I454-A458 PolarHBondContact O-N 3.05Å
455	K	97.6	Very high	96.6	Very high	133 Å²	133	69 Å²	69	58%	0.578	35%	0.351	S	S	*	.	H	α-helix	trans	-65.1	-31.9	-179.3	-72.6	170.9	-171.8	175.1	0	113.9	N451 L452 I453 K459	N451-K455 WeakPolarHBondContact O-CB 3.26Å; N451-K455 VanDerWaalsContact O-CD 3.28Å; N451-K455 WeakPolarHBondContact O-CD 3.48Å; N451-K455 WeakPolarHBondContact O-CG 3.42Å; N451-K455 PolarHBondContact O-N 3.33Å; L452-K455 PolarHBondContact O-N 3.35Å; I453-K455 VanDerWaalsContact C-N 3.3Å; I453-K455 PolarHBondContact O-N 2.96Å; K455-K459 WeakPolarHBondContact O-CG 3.33Å
456	L	98.1	Very high	96.1	Very high	25 Å²	25	66.5 Å²	66.5	13%	0.131	34%	0.341	C	S	.	.	H	α-helix	trans	-85.7	-36.8	175.3	-63.9	179.7	0	0	0	111.3	L362 R365 L366 L369 L452 I453 I454 K459 H460	L362-L456 HydrophobicContact CD2-CB 4.31Å; L362-L456 HydrophobicContact CD2-CD2 3.71Å; R365-L456 HydrophobicContact CG-CD1 4.24Å; L366-L456 HydrophobicContact CD1-CB 4.48Å; L366-L456 HydrophobicContact CD2-CB 3.8Å; L366-L456 HydrophobicContact CG-CB 4.08Å; L369-L456 HydrophobicContact CD1-CD1 3.62Å; L452-L456 HydrophobicContact CD1-CD1 3.95Å; L452-L456 HydrophobicContact CD1-CG 4.04Å; L452-L456 HydrophobicContact CG-CD1 4Å; L452-L456 HydrophobicContact CG-CG 4.43Å; L452-L456 WeakPolarHBondContact O-CG 3.45Å; L452-L456 PolarHBondContact O-N 3.37Å; I453-L456 PolarHBondContact O-N 2.92Å; I453-L456 VanDerWaalsContact O-N 3.16Å; I454-L456 VanDerWaalsContact C-N 3.34Å; I454-L456 PolarHBondContact O-N 2.91Å; L456-K459 PolarHBondContact O-N 2.8Å; L456-H460 WeakPolarHBondContact O-CB 3.4Å; L456-H460 PolarHBondContact O-N 2.79Å
457	Q	97.7	Very high	95.6	Very high	40 Å²	40	65.1 Å²	65.1	19%	0.187	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-49.2	179.1	-172.1	64.5	60.5	0	0	111.4	L366 K370 I453 I454 K459 H460 D461	L366-Q457 HydrophobicContact CD2-CB 4.1Å; K370-Q457 VanDerWaalsContact CE-OE1 3.26Å; I453-Q457 WeakPolarHBondContact O-CB 3.32Å; I453-Q457 PolarHBondContact O-N 3.39Å; I454-Q457 PolarHBondContact O-N 2.88Å; Q457-K459 VanDerWaalsContact C-N 3.25Å; Q457-K459 PolarHBondContact O-N 3.35Å; Q457-H460 WeakPolarHBondContact O-CB 3.32Å; Q457-H460 PolarHBondContact O-N 2.88Å; Q457-H460 VanDerWaalsContact O-N 3.13Å; Q457-D461 WeakPolarHBondContact CG-OD2 3.42Å; Q457-D461 PolarHBondContact NE2-OD1 2.69Å; Q457-D461 PolarHBondContact NE2-OD2 2.76Å; Q457-D461 VanDerWaalsContact O-CG 3.31Å; Q457-D461 PolarHBondContact O-N 2.8Å
458	A	96.7	Very high	94.1	Very high	64 Å²	64	64.8 Å²	64.8	53%	0.529	35%	0.351	S	S	.	.	H	α-helix	trans	-58.6	-36	177.3	0	0	0	0	0	113	I454 L462	I454-A458 WeakPolarHBondContact O-CB 3.24Å; I454-A458 PolarHBondContact O-N 3.05Å; A458-L462 WeakPolarHBondContact O-CB 3.49Å; A458-L462 PolarHBondContact O-N 2.85Å
459	K	96.3	Very high	91.9	Very high	129 Å²	129	67.4 Å²	67.4	56%	0.561	36%	0.36	S	S	*	.	H	α-helix	trans	-74.1	-39.5	176.3	-67.5	179.4	-177.2	-176.7	0	112.3	L362 K455 L456 Q457 L463	L362-K459 HydrophobicContact CD1-CB 4.13Å; K455-K459 WeakPolarHBondContact O-CG 3.33Å; L456-K459 PolarHBondContact O-N 2.8Å; Q457-K459 VanDerWaalsContact C-N 3.25Å; Q457-K459 PolarHBondContact O-N 3.35Å; K459-L463 WeakPolarHBondContact O-CG 3.07Å; K459-L463 PolarHBondContact O-N 2.91Å
460	H	96.4	Very high	89.4	Confident	18 Å²	18	68.9 Å²	68.9	8%	0.083	38%	0.375	C	S	.	.	H	α-helix	trans	-60.6	-46.5	173.9	166.7	-84.9	0	0	0	111.2	Y359 L362 L366 L456 Q457 L463 K464	Y359-H460 AromaticContact CD2-CD2 3.87Å; Y359-H460 AromaticContact CE2-CD2 3.59Å; Y359-H460 AromaticContact CE2-CE1 3.82Å; Y359-H460 AromaticContact CE2-NE2 3.34Å; Y359-H460 VanDerWaalsContact CE2-NE2 3.34Å; Y359-H460 WeakPolarHBondContact CE2-NE2 3.28Å; Y359-H460 AromaticContact CZ-NE2 3.89Å; L362-H460 HydrophobicContact CB-CB 4.18Å; L366-H460 HydrophobicContact CD1-CB 3.51Å; L456-H460 WeakPolarHBondContact O-CB 3.4Å; L456-H460 PolarHBondContact O-N 2.79Å; Q457-H460 WeakPolarHBondContact O-CB 3.32Å; Q457-H460 PolarHBondContact O-N 2.88Å; Q457-H460 VanDerWaalsContact O-N 3.13Å; H460-L463 PolarHBondContact O-N 3.03Å; H460-K464 WeakPolarHBondContact O-CB 3.36Å; H460-K464 PolarHBondContact O-N 3.11Å
461	D	95.3	Very high	86.6	Confident	67 Å²	67	76.4 Å²	76.4	36%	0.358	41%	0.407	S	S	.	.	H	α-helix	trans	-73.9	-35.4	-173.9	-63.8	-27.9	0	0	0	112.7	Q457 K464 Q465	Q457-D461 WeakPolarHBondContact CG-OD2 3.42Å; Q457-D461 PolarHBondContact NE2-OD1 2.69Å; Q457-D461 PolarHBondContact NE2-OD2 2.76Å; Q457-D461 VanDerWaalsContact O-CG 3.31Å; Q457-D461 PolarHBondContact O-N 2.8Å; D461-K464 WeakPolarHBondContact O-CB 3.47Å; D461-K464 PolarHBondContact O-N 3Å; D461-Q465 PolarHBondContact O-N 3.07Å
462	L	95.4	Very high	84.1	Confident	91 Å²	91	84.6 Å²	84.6	48%	0.476	43%	0.433	S	S	.	.	H	α-helix	trans	-61.7	-46.1	170.1	-176.8	62.3	0	0	0	111.2	V345 A458 K464 Q465 T466	V345-L462 HydrophobicContact CG2-CD2 3.9Å; V345-L462 HydrophobicContact CG2-CG 4.05Å; A458-L462 WeakPolarHBondContact O-CB 3.49Å; A458-L462 PolarHBondContact O-N 2.85Å; L462-K464 VanDerWaalsContact C-N 3.34Å; L462-K464 PolarHBondContact O-N 3.27Å; L462-Q465 PolarHBondContact O-N 3.34Å; L462-T466 PolarHBondContact O-N 3.33Å; L462-T466 PolarHBondContact O-OG1 3.42Å
463	L	94.2	Very high	81	Confident	15 Å²	15	86.6 Å²	86.6	8%	0.079	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-37.2	174.8	-69.9	177	0	0	0	112.4	V345 L355 R358 Y359 L362 K459 H460 Q465 T466 L467	V345-L463 HydrophobicContact CG1-CD2 4.37Å; L355-L463 HydrophobicContact CB-CD2 4.34Å; L355-L463 HydrophobicContact CD2-CD2 3.94Å; R358-L463 HydrophobicContact CB-CD1 4.47Å; R358-L463 HydrophobicContact CG-CD1 4.28Å; Y359-L463 HydrophobicContact CD2-CB 4.39Å; L362-L463 HydrophobicContact CD1-CD1 3.95Å; K459-L463 WeakPolarHBondContact O-CG 3.07Å; K459-L463 PolarHBondContact O-N 2.91Å; H460-L463 PolarHBondContact O-N 3.03Å; L463-Q465 VanDerWaalsContact C-N 3.33Å; L463-Q465 PolarHBondContact O-N 3.49Å; L463-T466 PolarHBondContact O-N 2.97Å; L463-L467 HydrophobicContact CB-CD1 4.36Å; L463-L467 VanDerWaalsContact O-CB 3.29Å; L463-L467 WeakPolarHBondContact O-CB 3.21Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.42Å; L463-L467 PolarHBondContact O-N 3.13Å
464	K	93.1	Very high	78.1	Confident	117 Å²	117	94.8 Å²	94.8	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-43.4	176.1	-169.4	-174.9	174.6	-169.5	0	111.4	Y359 H460 D461 L462 G468	Y359-K464 HydrophobicContact CD2-CB 4.31Å; Y359-K464 HydrophobicContact CE2-CB 3.69Å; Y359-K464 HydrophobicContact CE2-CG 3.93Å; H460-K464 WeakPolarHBondContact O-CB 3.36Å; H460-K464 PolarHBondContact O-N 3.11Å; D461-K464 WeakPolarHBondContact O-CB 3.47Å; D461-K464 PolarHBondContact O-N 3Å; L462-K464 VanDerWaalsContact C-N 3.34Å; L462-K464 PolarHBondContact O-N 3.27Å; K464-G468 PolarHBondContact O-N 3.44Å
465	Q	90.3	Very high	74.8	Confident	127 Å²	127	96.2 Å²	96.2	59%	0.593	51%	0.514	S	S	*	.	H	α-helix	trans	-62.6	-51.1	175.2	-175.5	178.3	-5.2	0	0	110.7	D461 L462 L463 L467 G468	D461-Q465 PolarHBondContact O-N 3.07Å; L462-Q465 PolarHBondContact O-N 3.34Å; L463-Q465 VanDerWaalsContact C-N 3.33Å; L463-Q465 PolarHBondContact O-N 3.49Å; Q465-L467 PolarHBondContact O-N 3.41Å; Q465-G468 PolarHBondContact O-N 3.41Å
466	T	87.9	Confident	71.7	Confident	31 Å²	31	92.5 Å²	92.5	19%	0.19	51%	0.513	C	S	.	.	H	α-helix	trans	-64.5	-39.2	-177.5	-47.8	0	0	0	0	113.5	V345 A347 L462 L463	V345-T466 HydrophobicContact CB-CG2 3.95Å; V345-T466 HydrophobicContact CG1-CG2 4.07Å; V345-T466 WeakPolarHBondContact O-CG2 3.27Å; A347-T466 HydrophobicContact CB-CG2 3.67Å; L462-T466 PolarHBondContact O-N 3.33Å; L462-T466 PolarHBondContact O-OG1 3.42Å; L463-T466 PolarHBondContact O-N 2.97Å
467	L	86.1	Confident	68.6	Low	31 Å²	31	97.6 Å²	97.6	16%	0.162	55%	0.546	C	S	.	.	H	α-helix	trans	-82	-24.5	-178.5	-65.2	166.7	0	0	0	112.6	A347 Q352 L355 L356 Y359 L463 Q465 E469 G470	A347-L467 HydrophobicContact CB-CD2 4.13Å; Q352-L467 HydrophobicContact CG-CD2 4.42Å; L355-L467 HydrophobicContact CB-CD2 4.23Å; L356-L467 HydrophobicContact CB-CD1 4.44Å; L356-L467 HydrophobicContact CD1-CD1 4.2Å; Y359-L467 HydrophobicContact CG-CD1 4.13Å; L463-L467 HydrophobicContact CB-CD1 4.36Å; L463-L467 VanDerWaalsContact O-CB 3.29Å; L463-L467 WeakPolarHBondContact O-CB 3.21Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.42Å; L463-L467 PolarHBondContact O-N 3.13Å; Q465-L467 PolarHBondContact O-N 3.41Å; L467-E469 VanDerWaalsContact C-N 3.28Å; L467-E469 PolarHBondContact O-N 2.96Å; L467-G470 PolarHBondContact O-N 3.31Å
468	G	66.9	Low	65.4	Low	62 Å²	62	102.7 Å²	102.7	64%	0.639	58%	0.579	S	S	*	*	H	α-helix	trans	-70.1	-19.3	178.8	0	0	0	0	0	114.6	K464 Q465 G470	K464-G468 PolarHBondContact O-N 3.44Å; Q465-G468 PolarHBondContact O-N 3.41Å; G468-G470 VanDerWaalsContact C-N 3.27Å; G468-G470 PolarHBondContact O-N 2.84Å
469	E	51.4	Low	62.3	Low	157 Å²	157	111 Å²	111	73%	0.734	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	5.3	176.7	-64.8	-175.9	167.9	0	0	113.2	L467	L467-E469 VanDerWaalsContact C-N 3.28Å; L467-E469 PolarHBondContact O-N 2.96Å
470	G	45.7	Very low	60.4	Low	49 Å²	49	110.1 Å²	110.1	51%	0.505	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-18.7	-175.8	0	0	0	0	0	116.7	L467 G468 R472	L467-G470 PolarHBondContact O-N 3.31Å; G468-G470 VanDerWaalsContact C-N 3.27Å; G468-G470 PolarHBondContact O-N 2.84Å; G470-R472 PolarHBondContact O-N 3.17Å
471	E	38.9	Very low	58	Low	185 Å²	185	114.6 Å²	114.6	86%	0.864	64%	0.635	S	S	*	*	S	Bend	trans	-93.6	59.8	-173.9	-68.3	-162	145.6	0	0	114.3
472	R	44.7	Very low	55	Low	247 Å²	247	117.8 Å²	117.8	93%	0.932	66%	0.657	S	S	*	*			trans	172.9	101.3	148.9	-98.6	159.2	-174.1	-168.2	4	113.1	G470	G470-R472 PolarHBondContact O-N 3.17Å
473	A	33.1	Very low	52.6	Low	104 Å²	104	121 Å²	121	86%	0.86	67%	0.674	S	S	*	*			trans	-165.8	109.9	150.7	0	0	0	0	0	111.9
474	E	36	Very low	49.8	Very low	192 Å²	192	125.9 Å²	125.9	90%	0.897	71%	0.707	S	S	*	*			trans	-130.7	141.8	156.9	-84.9	-158.9	142.8	0	0	110.2
475	C	28.6	Very low	47.2	Very low	137 Å²	137	126.1 Å²	126.1	93%	0.926	72%	0.72	S	S	*	*			trans	64.1	134.8	160.8	-154.3	0	0	0	0	120.2
476	G	33.3	Very low	44.6	Very low	54 Å²	54	128.4 Å²	128.4	56%	0.557	73%	0.728	S	S	*	*				118.5	53	120.5	0	0	0	0	0	122.4
477	T	32.6	Very low	42.1	Very low	133 Å²	133	132.7 Å²	132.7	82%	0.816	76%	0.757	S	S	*	*			trans	63.3	150.4	139.6	56.2	0	0	0	0	123.4
478	T	31	Very low	39.6	Very low	146 Å²	146	140.2 Å²	140.2	90%	0.896	79%	0.791	S	S	*	*			trans	72.8	169.4	158.7	43.1	0	0	0	0	119.5
479	R	31.9	Very low	38.2	Very low	239 Å²	239	147 Å²	147	90%	0.902	80%	0.803	S	S	*	*			trans	-126.1	177	-149.6	-138.8	-168.2	-176.5	-177.1	2.6	112.3
480	P	55.3	Low	37.2	Very low	110 Å²	110	147.3 Å²	147.3	71%	0.714	81%	0.806	S	S	*	*				-84.8	163.6	-117.4	43.6	-31.5	0	0	0	114.4
481	P	45.4	Very low	36.6	Very low	112 Å²	112	156.6 Å²	156.6	73%	0.727	83%	0.826	S	S	*	*				-146.6	179.1	88.9	39.4	-22.7	0	0	0	116
482	T	33.8	Very low	36.2	Very low	135 Å²	135	156.4 Å²	156.4	83%	0.828	82%	0.822	S	S	*	*			trans	60.2	108.8	162.5	41.8	0	0	0	0	119.8
483	L	43.5	Very low	35.5	Very low	159 Å²	159	149.9 Å²	149.9	83%	0.832	81%	0.812	S	S	*	*			trans	-82.6	147.3	161.6	-72	161.7	0	0	0	111.1
484	P	37.3	Very low	35.8	Very low	116 Å²	116	156.3 Å²	156.3	75%	0.753	81%	0.814	S	S	*	*				-141.9	174.1	125.5	41.2	-29.8	0	0	0	112.8
485	P	38.6	Very low	35.7	Very low	122 Å²	122	151.1 Å²	151.1	79%	0.792	80%	0.797	S	S	*	*	P	Polyproline II helix		-98.5	155	-74.1	36.3	-27.2	0	0	0	111.8
486	K	35.3	Very low	36.2	Very low	176 Å²	176	155.4 Å²	155.4	77%	0.765	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78.2	145.9	170.9	-71.6	-176.8	176.3	-178.5	0	110.9	Q488	K486-Q488 PolarHBondContact O-N 3.49Å
487	P	35.7	Very low	36.6	Very low	121 Å²	121	155.4 Å²	155.4	79%	0.786	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-60.8	132.1	161.3	27.8	-33.4	0	0	0	109.3	K489	P487-K489 VanDerWaalsContact C-N 3.3Å; P487-K489 PolarHBondContact O-N 3.09Å
488	Q	33.7	Very low	37.5	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	78%	0.783	S	S	*	*			trans	-75.5	76.4	-176.6	-71.7	177.7	-49.9	0	0	111.9	K486 M490	K486-Q488 PolarHBondContact O-N 3.49Å; Q488-M490 PolarHBondContact O-N 3.31Å; Q488-M490 VanDerWaalsContact O-N 3.12Å
489	K	37	Very low	38.5	Very low	205 Å²	205	152 Å²	152	89%	0.891	75%	0.751	S	S	*	*			trans	-67.1	103.6	145.3	-80.4	-165	175.1	-173.6	0	106.9	P487 R491	P487-K489 VanDerWaalsContact C-N 3.3Å; P487-K489 PolarHBondContact O-N 3.09Å; K489-R491 PolarHBondContact O-N 3.26Å
490	M	29.5	Very low	39.6	Very low	164 Å²	164	148.2 Å²	148.2	81%	0.808	75%	0.749	S	S	*	*			trans	-60	104.5	169	-71.1	-167.8	77.2	0	0	108.7	Q488 K492	Q488-M490 PolarHBondContact O-N 3.31Å; Q488-M490 VanDerWaalsContact O-N 3.12Å; M490-K492 PolarHBondContact O-N 2.88Å
491	R	32.7	Very low	39.9	Very low	243 Å²	243	147.1 Å²	147.1	92%	0.917	73%	0.734	S	S	*	*			trans	-62	98.4	146	-87	-176.2	166	176.3	-4.7	105.7	K489	K489-R491 PolarHBondContact O-N 3.26Å
492	K	31.4	Very low	41.1	Very low	182 Å²	182	149 Å²	149	79%	0.791	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-48.3	129.5	147.3	-77.8	-171.1	175.3	-175.1	0	105.2	M490	M490-K492 PolarHBondContact O-N 2.88Å
493	P	29.6	Very low	43.4	Very low	109 Å²	109	143.3 Å²	143.3	71%	0.708	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-56.6	147.2	170.2	27.1	-33.5	0	0	0	107.6	P495	P493-P495 WeakPolarHBondContact O-CD 3.32Å
494	R	39.2	Very low	45.5	Very low	239 Å²	239	135.8 Å²	135.8	90%	0.902	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-54.8	127.1	157.9	-79.7	-177.2	174.3	168.5	-3.1	105.9	R496	R494-R496 PolarHBondContact O-N 3.17Å
495	P	33.7	Very low	47.8	Very low	84 Å²	84	135.2 Å²	135.2	55%	0.545	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-50.7	129.4	159.4	-21.6	33.4	0	0	0	107	P493	P493-P495 WeakPolarHBondContact O-CD 3.32Å
496	R	39.9	Very low	50	Low	226 Å²	226	129.8 Å²	129.8	85%	0.853	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-66	142.5	148.4	-73.3	179.6	168.7	-176.4	-5.1	104.9	R494 M498	R494-R496 PolarHBondContact O-N 3.17Å; R496-M498 PolarHBondContact O-N 2.88Å
497	S	41.2	Very low	52.4	Low	55 Å²	55	123.1 Å²	123.1	39%	0.385	59%	0.585	S	S	.	*			trans	-45.2	121.7	162.8	173.5	0	0	0	0	107.3	F499	S497-F499 WeakPolarHBondContact CB-O 3.35Å; S497-F499 PolarHBondContact O-N 3.07Å; S497-F499 VanDerWaalsContact O-N 3.16Å; S497-F499 PolarHBondContact OG-O 3.01Å
498	M	51.1	Low	55	Low	156 Å²	156	117.8 Å²	117.8	77%	0.768	55%	0.55	S	S	*	.	S	Bend	trans	-67.4	-16.4	-174.9	-60.4	-155.7	-61.5	0	0	111.5	R496	R496-M498 PolarHBondContact O-N 2.88Å
499	F	53.8	Low	57.5	Low	50 Å²	50	112 Å²	112	22%	0.219	52%	0.523	C	S	.	.	S	Bend	trans	-111.5	136.8	178.1	-42.4	-60.2	0	0	0	109.4	S497 H501 F511	S497-F499 WeakPolarHBondContact CB-O 3.35Å; S497-F499 PolarHBondContact O-N 3.07Å; S497-F499 VanDerWaalsContact O-N 3.16Å; S497-F499 PolarHBondContact OG-O 3.01Å; F499-H501 PolarHBondContact O-N 2.98Å; F499-F511 HydrophobicContact CB-CE2 4.3Å; F499-F511 AromaticContact CD2-CE2 3.93Å; F499-F511 HydrophobicContact CD2-CE2 3.93Å; F499-F511 HydrophobicContact CD2-CZ 4.11Å; F499-F511 HydrophobicContact CG-CE2 4.3Å
500	N	53.3	Low	59.8	Low	160 Å²	160	104.5 Å²	104.5	86%	0.856	49%	0.494	S	S	*	.	S	Bend	trans	-78.1	3	-177	-68.4	-69.4	0	0	0	113.7
501	H	61.4	Low	62.4	Low	87 Å²	87	97.3 Å²	97.3	40%	0.403	46%	0.458	S	S	.	.	S	Bend	trans	-118.9	147.7	-172	-69.7	-91	0	0	0	111.1	F499 D514	F499-H501 PolarHBondContact O-N 2.98Å; H501-D514 IonicContact CD2-OD2 3.91Å; H501-D514 PolarHBondContact CD2-OD2 3.35Å; H501-D514 IonicContact CG-OD2 3.68Å; H501-D514 IonicContact NE2-OD2 3.39Å; H501-D514 PolarHBondContact NE2-OD2 3.36Å
502	K	71.8	Confident	64.9	Low	151 Å²	151	86.4 Å²	86.4	66%	0.657	42%	0.418	S	S	*	.			trans	-73.3	131.7	179.1	-61	-178.8	-178.9	175.6	0	110.1	F504	K502-F504 WeakPolarHBondContact CB-O 3.41Å
503	L	81.8	Confident	67.3	Low	16 Å²	16	86.1 Å²	86.1	8%	0.084	42%	0.417	C	S	.	.	S	Bend	trans	-68.6	-55.9	175.4	177.7	65.1	0	0	0	111.4	F511 V522 F557 Y583	L503-F511 HydrophobicContact CB-CE2 4.27Å; L503-F511 HydrophobicContact CD1-CD1 4.04Å; L503-F511 HydrophobicContact CD1-CD2 4.21Å; L503-F511 HydrophobicContact CD1-CE1 3.67Å; L503-F511 HydrophobicContact CD1-CE2 3.85Å; L503-F511 HydrophobicContact CD1-CG 4.31Å; L503-F511 HydrophobicContact CD1-CZ 3.59Å; L503-V522 HydrophobicContact CD1-CG1 3.89Å; L503-V522 HydrophobicContact CD2-CB 4.18Å; L503-V522 HydrophobicContact CD2-CG1 4.03Å; L503-V522 HydrophobicContact CG-CG1 4.15Å; L503-F557 HydrophobicContact CD2-CB 3.64Å; L503-Y583 HydrophobicContact CD1-CE2 3.73Å; L503-Y583 HydrophobicContact CG-CD2 4.49Å; L503-Y583 HydrophobicContact CG-CE2 4.05Å; L503-Y583 VanDerWaalsContact O-CE2 3.3Å; L503-Y583 WeakPolarHBondContact O-CE2 3.5Å
504	F	87.4	Confident	69.7	Low	1 Å²	1	84.6 Å²	84.6	0%	0.004	40%	0.403	C	S	.	.	S	Bend	trans	-87.8	146.3	171	-64.9	-104.2	0	0	0	109.6	K502 G506 V522 K554 F557 E558 V579 L582 Y583	K502-F504 WeakPolarHBondContact CB-O 3.41Å; F504-G506 VanDerWaalsContact C-N 3.33Å; F504-G506 PolarHBondContact O-N 3.29Å; F504-V522 HydrophobicContact CE2-CG2 4.28Å; F504-V522 HydrophobicContact CZ-CG2 3.79Å; F504-K554 HydrophobicContact CD1-CG 3.79Å; F504-K554 HydrophobicContact CD2-CG 3.69Å; F504-K554 HydrophobicContact CE1-CB 4.32Å; F504-K554 HydrophobicContact CE1-CG 3.59Å; F504-K554 HydrophobicContact CE2-CB 4.17Å; F504-K554 HydrophobicContact CE2-CG 3.5Å; F504-K554 HydrophobicContact CG-CG 3.84Å; F504-K554 HydrophobicContact CZ-CB 3.9Å; F504-K554 HydrophobicContact CZ-CG 3.43Å; F504-K554 VanDerWaalsContact CZ-CG 3.43Å; F504-F557 HydrophobicContact CE2-CB 4.17Å; F504-E558 HydrophobicContact CD2-CG 3.83Å; F504-V579 HydrophobicContact CE1-CG1 4.41Å; F504-V579 HydrophobicContact CZ-CG1 3.94Å; F504-L582 HydrophobicContact CD1-CG 4.36Å; F504-L582 HydrophobicContact CE1-CG 4.31Å; F504-Y583 HydrophobicContact CD1-CD2 4.18Å; F504-Y583 HydrophobicContact CE1-CD2 4.17Å; F504-Y583 HydrophobicContact CG-CD2 4.45Å; F504-Y583 HydrophobicContact CZ-CD2 4.42Å
505	N	86.8	Confident	71.6	Confident	105 Å²	105	74.2 Å²	74.2	56%	0.561	37%	0.367	S	S	*	.	S	Bend	trans	57.8	43.7	178	-54.6	23.4	0	0	0	113.3	G586	N505-G586 VanDerWaalsContact CA-O 3.25Å; N505-G586 WeakPolarHBondContact CA-O 3.25Å
506	G	84.5	Confident	73.7	Confident	8 Å²	8	73.2 Å²	73.2	8%	0.082	37%	0.372	C	S	.	.	S	Bend	trans	-145.1	179.7	172.4	0	0	0	0	0	112	F504 E588	F504-G506 VanDerWaalsContact C-N 3.33Å; F504-G506 PolarHBondContact O-N 3.29Å; G506-E588 VanDerWaalsContact C-CB 3.47Å; G506-E588 PolarHBondContact O-N 3.07Å; G506-E588 VanDerWaalsContact O-N 3.08Å
507	N	86	Confident	75.7	Confident	36 Å²	36	65.1 Å²	65.1	19%	0.193	34%	0.344	C	S	.	.			trans	-77.4	117.9	178.1	-175.5	-52.2	0	0	0	112.1	E509 T510 F511 E588 N589	N507-E509 WeakPolarHBondContact OD1-CA 3.33Å; N507-E509 WeakPolarHBondContact OD1-CB 3.33Å; N507-E509 PolarHBondContact OD1-N 3.43Å; N507-T510 PolarHBondContact O-N 2.72Å; N507-T510 PolarHBondContact OD1-N 3.14Å; N507-T510 PolarHBondContact OD1-OG1 3.13Å; N507-F511 PolarHBondContact O-N 2.65Å; N507-E588 WeakPolarHBondContact CB-OE2 3.39Å; N507-E588 PolarHBondContact N-OE2 3.41Å; N507-E588 VanDerWaalsContact N-OE2 3.12Å; N507-N589 PolarHBondContact ND2-ND2 2.62Å
508	M	90.1	Very high	77.7	Confident	8 Å²	8	65.4 Å²	65.4	4%	0.039	35%	0.345	C	S	.	.	H	α-helix	trans	-64.4	-38.2	-178.7	-174.4	177.6	74.5	0	0	113.5	F511 I512 P520 Y583 L587 L591 V627 V630	M508-F511 PolarHBondContact O-N 3.48Å; M508-I512 HydrophobicContact CG-CD1 3.78Å; M508-I512 HydrophobicContact CG-CG1 4.49Å; M508-I512 WeakPolarHBondContact O-CB 3.12Å; M508-I512 WeakPolarHBondContact O-CG1 3.33Å; M508-I512 PolarHBondContact O-N 3.36Å; M508-I512 HydrophobicContact SD-CD1 4.5Å; M508-P520 HydrophobicContact CG-CG 4.11Å; M508-P520 HydrophobicContact SD-CG 4.3Å; M508-Y583 HydrophobicContact SD-CE1 4.36Å; M508-L587 HydrophobicContact CB-CD1 4.26Å; M508-L587 HydrophobicContact CB-CD2 4.1Å; M508-L587 HydrophobicContact SD-CD1 4.01Å; M508-L591 HydrophobicContact CE-CD1 3.77Å; M508-L591 HydrophobicContact SD-CD1 4.49Å; M508-V627 HydrophobicContact CE-CG2 4.19Å; M508-V630 HydrophobicContact CE-CB 4.04Å; M508-V630 HydrophobicContact CE-CG1 4.15Å; M508-V630 HydrophobicContact CE-CG2 3.99Å; M508-V630 HydrophobicContact SD-CB 4.37Å; M508-V630 HydrophobicContact SD-CG1 3.98Å; M508-V630 HydrophobicContact SD-CG2 4.11Å
509	E	86.1	Confident	79.6	Confident	67 Å²	67	58.1 Å²	58.1	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-39.8	179.4	-60.2	173	-111	0	0	111	N507 K513 P624 V627	N507-E509 WeakPolarHBondContact OD1-CA 3.33Å; N507-E509 WeakPolarHBondContact OD1-CB 3.33Å; N507-E509 PolarHBondContact OD1-N 3.43Å; E509-K513 VanDerWaalsContact O-CB 3.29Å; E509-K513 WeakPolarHBondContact O-CB 3.49Å; E509-K513 PolarHBondContact O-N 3.39Å; E509-P624 WeakPolarHBondContact OE2-CB 3.46Å; E509-P624 WeakPolarHBondContact OE2-CG 3.4Å; E509-V627 HydrophobicContact CG-CG2 4.2Å
510	T	84.7	Confident	81.4	Confident	48 Å²	48	55.7 Å²	55.7	29%	0.294	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-46.4	173.3	-52.6	0	0	0	0	111	N507 I512 K513 D514	N507-T510 PolarHBondContact O-N 2.72Å; N507-T510 PolarHBondContact OD1-N 3.14Å; N507-T510 PolarHBondContact OD1-OG1 3.13Å; T510-I512 PolarHBondContact O-N 2.94Å; T510-K513 PolarHBondContact O-N 3.47Å; T510-D514 PolarHBondContact O-N 2.7Å
511	F	83.7	Confident	83	Confident	12 Å²	12	50.6 Å²	50.6	5%	0.053	27%	0.271	C	S	.	.	H	α-helix	trans	-58.1	-48.4	177.9	179.4	-92.2	0	0	0	112.2	F499 L503 N507 M508 K513 D514 S515 P520	F499-F511 HydrophobicContact CB-CE2 4.3Å; F499-F511 AromaticContact CD2-CE2 3.93Å; F499-F511 HydrophobicContact CD2-CE2 3.93Å; F499-F511 HydrophobicContact CD2-CZ 4.11Å; F499-F511 HydrophobicContact CG-CE2 4.3Å; L503-F511 HydrophobicContact CB-CE2 4.27Å; L503-F511 HydrophobicContact CD1-CD1 4.04Å; L503-F511 HydrophobicContact CD1-CD2 4.21Å; L503-F511 HydrophobicContact CD1-CE1 3.67Å; L503-F511 HydrophobicContact CD1-CE2 3.85Å; L503-F511 HydrophobicContact CD1-CG 4.31Å; L503-F511 HydrophobicContact CD1-CZ 3.59Å; N507-F511 PolarHBondContact O-N 2.65Å; M508-F511 PolarHBondContact O-N 3.48Å; F511-K513 VanDerWaalsContact C-N 3.33Å; F511-K513 PolarHBondContact O-N 3.36Å; F511-D514 PolarHBondContact O-N 3.07Å; F511-S515 VanDerWaalsContact O-CB 3.3Å; F511-S515 WeakPolarHBondContact O-CB 3.34Å; F511-S515 PolarHBondContact O-N 2.91Å; F511-S515 PolarHBondContact O-OG 2.94Å; F511-S515 VanDerWaalsContact O-OG 3.13Å; F511-P520 HydrophobicContact CD1-CB 4.37Å; F511-P520 HydrophobicContact CE1-CB 4.25Å
512	I	85	Confident	84.5	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-39.8	178.3	-73.8	166.8	0	0	0	111.5	M508 T510 D514 S515 G516 Q517 P520 T626 V630	M508-I512 HydrophobicContact CG-CD1 3.78Å; M508-I512 HydrophobicContact CG-CG1 4.49Å; M508-I512 WeakPolarHBondContact O-CB 3.12Å; M508-I512 WeakPolarHBondContact O-CG1 3.33Å; M508-I512 PolarHBondContact O-N 3.36Å; M508-I512 HydrophobicContact SD-CD1 4.5Å; T510-I512 PolarHBondContact O-N 2.94Å; I512-D514 VanDerWaalsContact C-N 3.35Å; I512-D514 PolarHBondContact O-N 3.03Å; I512-S515 PolarHBondContact O-OG 2.95Å; I512-G516 WeakPolarHBondContact O-CA 3.46Å; I512-G516 PolarHBondContact O-N 3.01Å; I512-Q517 VanDerWaalsContact CG2-O 3.28Å; I512-Q517 WeakPolarHBondContact CG2-O 3.36Å; I512-P520 HydrophobicContact CD1-CG 3.93Å; I512-P520 HydrophobicContact CG1-CG 4.05Å; I512-T626 HydrophobicContact CB-CG2 3.97Å; I512-T626 HydrophobicContact CD1-CG2 3.38Å; I512-T626 HydrophobicContact CG1-CG2 4.26Å; I512-T626 HydrophobicContact CG2-CG2 3.61Å; I512-V630 HydrophobicContact CD1-CG2 4Å
513	K	82.5	Confident	85.6	Confident	176 Å²	176	39.3 Å²	39.3	77%	0.765	22%	0.22	S	C	*	.	H	α-helix	trans	-64.7	-37.2	177.7	-174.5	-177.5	178.1	-173.4	0	112.9	E509 T510 F511	E509-K513 VanDerWaalsContact O-CB 3.29Å; E509-K513 WeakPolarHBondContact O-CB 3.49Å; E509-K513 PolarHBondContact O-N 3.39Å; T510-K513 PolarHBondContact O-N 3.47Å; F511-K513 VanDerWaalsContact C-N 3.33Å; F511-K513 PolarHBondContact O-N 3.36Å
514	D	79.4	Confident	86.1	Confident	76 Å²	76	41.9 Å²	41.9	41%	0.406	23%	0.232	S	C	.	.	H	α-helix	trans	-89.6	-20.6	-178.3	-64.8	-30.4	0	0	0	113.4	H501 T510 F511 I512	H501-D514 IonicContact CD2-OD2 3.91Å; H501-D514 PolarHBondContact CD2-OD2 3.35Å; H501-D514 IonicContact CG-OD2 3.68Å; H501-D514 IonicContact NE2-OD2 3.39Å; H501-D514 PolarHBondContact NE2-OD2 3.36Å; T510-D514 PolarHBondContact O-N 2.7Å; F511-D514 PolarHBondContact O-N 3.07Å; I512-D514 VanDerWaalsContact C-N 3.35Å; I512-D514 PolarHBondContact O-N 3.03Å
515	S	78.8	Confident	86.3	Confident	21 Å²	21	42.1 Å²	42.1	15%	0.147	23%	0.234	C	C	.	.	H	α-helix	trans	-88.8	-25.4	173.7	75.1	0	0	0	0	113.7	F511 I512 Q517	F511-S515 VanDerWaalsContact O-CB 3.3Å; F511-S515 WeakPolarHBondContact O-CB 3.34Å; F511-S515 PolarHBondContact O-N 2.91Å; F511-S515 PolarHBondContact O-OG 2.94Å; F511-S515 VanDerWaalsContact O-OG 3.13Å; I512-S515 PolarHBondContact O-OG 2.95Å; S515-Q517 PolarHBondContact O-N 3.38Å; S515-Q517 PolarHBondContact OG-N 3.18Å
516	G	78.3	Confident	86.7	Confident	64 Å²	64	37.1 Å²	37.1	66%	0.66	21%	0.207	S	C	*	.			trans	74.4	-2.3	-172.4	0	0	0	0	0	114.4	I512	I512-G516 WeakPolarHBondContact O-CA 3.46Å; I512-G516 PolarHBondContact O-N 3.01Å
517	Q	81.6	Confident	87.2	Confident	55 Å²	55	36.7 Å²	36.7	26%	0.257	20%	0.203	S	C	.	.			trans	-86.4	119.5	-179.5	-60.7	-175.9	-60.1	0	0	110.6	I512 S515 I519	I512-Q517 VanDerWaalsContact CG2-O 3.28Å; I512-Q517 WeakPolarHBondContact CG2-O 3.36Å; S515-Q517 PolarHBondContact O-N 3.38Å; S515-Q517 PolarHBondContact OG-N 3.18Å; Q517-I519 VanDerWaalsContact C-N 3.27Å; Q517-I519 WeakPolarHBondContact CB-O 3.4Å; Q517-I519 PolarHBondContact O-N 2.98Å
518	P	84.1	Confident	87.5	Confident	62 Å²	62	37.2 Å²	37.2	40%	0.403	20%	0.202	S	C	.	.	S	Bend	trans	-68.7	-22.2	-175.6	27.1	-35.4	0	0	0	114.1	P703	P518-P703 HydrophobicContact CB-CG 4.19Å; P518-P703 HydrophobicContact CG-CG 3.62Å
519	I	90.4	Very high	87.7	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.202	C	C	.	.	S	Bend	trans	-117.3	138.6	164.6	-60.2	-65.6	0	0	0	106.9	Q517 L521 V523 E524 I629 V630 Y633 P703	Q517-I519 VanDerWaalsContact C-N 3.27Å; Q517-I519 WeakPolarHBondContact CB-O 3.4Å; Q517-I519 PolarHBondContact O-N 2.98Å; I519-L521 PolarHBondContact O-N 3.27Å; I519-V523 HydrophobicContact CG2-CB 3.9Å; I519-V523 HydrophobicContact CG2-CG1 3.95Å; I519-E524 HydrophobicContact CG2-CB 4.01Å; I519-I629 HydrophobicContact CD1-CG2 3.88Å; I519-V630 HydrophobicContact CD1-CB 4.44Å; I519-V630 HydrophobicContact CD1-CG2 3.95Å; I519-Y633 HydrophobicContact CD1-CD1 4.38Å; I519-Y633 HydrophobicContact CD1-CD2 4.46Å; I519-Y633 HydrophobicContact CD1-CG 3.95Å; I519-Y633 HydrophobicContact CG1-CD2 4.38Å; I519-Y633 HydrophobicContact CG1-CG 4.24Å; I519-Y633 HydrophobicContact CG2-CD1 4.28Å; I519-Y633 HydrophobicContact CG2-CE1 4.4Å; I519-P703 HydrophobicContact CG1-CB 4.01Å; I519-P703 HydrophobicContact CG1-CG 3.96Å
520	P	91.1	Very high	88	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.			trans	-65.1	132	174	-18.8	31.6	0	0	0	110.7	M508 F511 I512 V522 V523 E524 Y583	M508-P520 HydrophobicContact CG-CG 4.11Å; M508-P520 HydrophobicContact SD-CG 4.3Å; F511-P520 HydrophobicContact CD1-CB 4.37Å; F511-P520 HydrophobicContact CE1-CB 4.25Å; I512-P520 HydrophobicContact CD1-CG 3.93Å; I512-P520 HydrophobicContact CG1-CG 4.05Å; P520-V522 HydrophobicContact CB-CG1 4.31Å; P520-V522 PolarHBondContact O-N 2.92Å; P520-V523 HydrophobicContact CB-CG2 4.24Å; P520-V523 HydrophobicContact CG-CG2 4.26Å; P520-V523 WeakPolarHBondContact O-CA 3.42Å; P520-V523 WeakPolarHBondContact O-CB 3.37Å; P520-V523 PolarHBondContact O-N 3.34Å; P520-E524 PolarHBondContact O-N 3.01Å; P520-E524 VanDerWaalsContact O-N 3.12Å; P520-Y583 HydrophobicContact CB-CE1 4.37Å; P520-Y583 HydrophobicContact CG-CE1 4.18Å; P520-Y583 VanDerWaalsContact CG-OH 3.28Å; P520-Y583 WeakPolarHBondContact CG-OH 3.49Å
521	L	88.6	Confident	88.4	Confident	53 Å²	53	32.3 Å²	32.3	28%	0.277	18%	0.176	S	C	.	.	H	α-helix	trans	-49.6	-36.2	-176.6	-175.7	60.3	0	0	0	114.6	I519 V523 E524 S525 F557 D562	I519-L521 PolarHBondContact O-N 3.27Å; L521-V523 VanDerWaalsContact C-N 3.33Å; L521-V523 PolarHBondContact O-N 2.95Å; L521-E524 PolarHBondContact O-N 3.2Å; L521-S525 WeakPolarHBondContact O-CB 3.43Å; L521-S525 PolarHBondContact O-N 2.98Å; L521-F557 HydrophobicContact CG-CE1 4.38Å; L521-D562 HydrophobicContact CD2-CB 4.19Å
522	V	92.3	Very high	88.7	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.3	-30.5	175.6	62.2	0	0	0	0	113.6	L503 F504 P520 C526 F557 V579 Y583	L503-V522 HydrophobicContact CD1-CG1 3.89Å; L503-V522 HydrophobicContact CD2-CB 4.18Å; L503-V522 HydrophobicContact CD2-CG1 4.03Å; L503-V522 HydrophobicContact CG-CG1 4.15Å; F504-V522 HydrophobicContact CE2-CG2 4.28Å; F504-V522 HydrophobicContact CZ-CG2 3.79Å; P520-V522 HydrophobicContact CB-CG1 4.31Å; P520-V522 PolarHBondContact O-N 2.92Å; V522-C526 WeakPolarHBondContact O-CB 3.45Å; V522-C526 PolarHBondContact O-N 3.24Å; V522-C526 PolarHBondContact O-SG 3.48Å; V522-F557 HydrophobicContact CB-CD1 4.08Å; V522-F557 HydrophobicContact CB-CD2 4.2Å; V522-F557 HydrophobicContact CB-CE1 4.29Å; V522-F557 HydrophobicContact CB-CE2 4.4Å; V522-F557 HydrophobicContact CB-CG 4.04Å; V522-F557 HydrophobicContact CB-CZ 4.44Å; V522-F557 HydrophobicContact CG2-CD1 4.49Å; V522-F557 HydrophobicContact CG2-CD2 3.72Å; V522-F557 HydrophobicContact CG2-CE2 3.9Å; V522-F557 HydrophobicContact CG2-CG 4.04Å; V522-F557 HydrophobicContact CG2-CZ 4.37Å; V522-V579 HydrophobicContact CG2-CG1 3.96Å; V522-Y583 HydrophobicContact CG1-CD1 4.26Å; V522-Y583 HydrophobicContact CG1-CD2 3.42Å; V522-Y583 VanDerWaalsContact CG1-CD2 3.42Å; V522-Y583 HydrophobicContact CG1-CE1 4.4Å; V522-Y583 HydrophobicContact CG1-CE2 3.59Å; V522-Y583 HydrophobicContact CG1-CG 3.78Å
523	V	94.1	Very high	88.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-74	-48.1	172.5	177.3	0	0	0	0	109.4	I519 P520 L521 V527 L580 Y583 F584 Y633	I519-V523 HydrophobicContact CG2-CB 3.9Å; I519-V523 HydrophobicContact CG2-CG1 3.95Å; P520-V523 HydrophobicContact CB-CG2 4.24Å; P520-V523 HydrophobicContact CG-CG2 4.26Å; P520-V523 WeakPolarHBondContact O-CA 3.42Å; P520-V523 WeakPolarHBondContact O-CB 3.37Å; P520-V523 PolarHBondContact O-N 3.34Å; L521-V523 VanDerWaalsContact C-N 3.33Å; L521-V523 PolarHBondContact O-N 2.95Å; V523-V527 HydrophobicContact CG1-CG2 4.49Å; V523-V527 VanDerWaalsContact O-CB 3.25Å; V523-V527 WeakPolarHBondContact O-CB 3.45Å; V523-V527 WeakPolarHBondContact O-CG2 3.43Å; V523-V527 PolarHBondContact O-N 3.01Å; V523-L580 HydrophobicContact CB-CD1 4.32Å; V523-L580 HydrophobicContact CG1-CD1 4.22Å; V523-L580 HydrophobicContact CG2-CD1 4.34Å; V523-Y583 HydrophobicContact CG2-CD1 3.5Å; V523-Y583 VanDerWaalsContact CG2-CD1 3.5Å; V523-Y583 HydrophobicContact CG2-CE1 3.47Å; V523-Y583 VanDerWaalsContact CG2-CE1 3.47Å; V523-Y583 HydrophobicContact CG2-CG 4.46Å; V523-F584 HydrophobicContact CB-CZ 4.41Å; V523-F584 HydrophobicContact CG1-CE2 4.3Å; V523-F584 HydrophobicContact CG1-CZ 3.86Å; V523-F584 HydrophobicContact CG2-CE1 4.21Å; V523-F584 HydrophobicContact CG2-CE2 4.06Å; V523-F584 HydrophobicContact CG2-CZ 3.59Å; V523-Y633 HydrophobicContact CG1-CD1 4.31Å
524	E	92.4	Very high	89.3	Confident	71 Å²	71	30.9 Å²	30.9	33%	0.332	17%	0.17	S	C	.	.	H	α-helix	trans	-60.4	-56.1	-178.1	-175.1	169.2	-153.3	0	0	112.3	I519 P520 L521 V527 R528	I519-E524 HydrophobicContact CG2-CB 4.01Å; P520-E524 PolarHBondContact O-N 3.01Å; P520-E524 VanDerWaalsContact O-N 3.12Å; L521-E524 PolarHBondContact O-N 3.2Å; E524-V527 PolarHBondContact O-N 3.35Å; E524-R528 PolarHBondContact O-N 2.86Å
525	S	92.2	Very high	90	Very high	5 Å²	5	28.3 Å²	28.3	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-70.7	-35	-176.9	-68	0	0	0	0	113.4	L521 R528 Y529 D562	L521-S525 WeakPolarHBondContact O-CB 3.43Å; L521-S525 PolarHBondContact O-N 2.98Å; S525-R528 PolarHBondContact O-N 2.95Å; S525-Y529 VanDerWaalsContact O-CB 3.28Å; S525-Y529 WeakPolarHBondContact O-CB 3.25Å; S525-Y529 PolarHBondContact O-N 3.29Å; S525-D562 VanDerWaalsContact CB-OD2 3.23Å; S525-D562 WeakPolarHBondContact CB-OD2 3.44Å; S525-D562 PolarHBondContact OG-OD2 2.98Å
526	C	95	Very high	90.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.5	-37.6	171.1	-69.6	0	0	0	0	112	V522 I530 L564 V576 L580	V522-C526 WeakPolarHBondContact O-CB 3.45Å; V522-C526 PolarHBondContact O-N 3.24Å; V522-C526 PolarHBondContact O-SG 3.48Å; C526-I530 WeakPolarHBondContact O-CB 3.37Å; C526-I530 WeakPolarHBondContact O-CD1 3.21Å; C526-I530 WeakPolarHBondContact O-CG1 3.5Å; C526-I530 PolarHBondContact O-N 3.42Å; C526-L564 HydrophobicContact CB-CD1 4.4Å; C526-V576 HydrophobicContact CB-CG1 3.92Å; C526-L580 HydrophobicContact CB-CB 3.96Å; C526-L580 HydrophobicContact CB-CD1 4.15Å; C526-L580 HydrophobicContact CB-CD2 4.46Å; C526-L580 HydrophobicContact CB-CG 4.42Å
527	V	95.5	Very high	91.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-44	174.2	164.2	0	0	0	0	111.1	V523 E524 I530 N531 L580 Y633 F637 Y705	V523-V527 HydrophobicContact CG1-CG2 4.49Å; V523-V527 VanDerWaalsContact O-CB 3.25Å; V523-V527 WeakPolarHBondContact O-CB 3.45Å; V523-V527 WeakPolarHBondContact O-CG2 3.43Å; V523-V527 PolarHBondContact O-N 3.01Å; E524-V527 PolarHBondContact O-N 3.35Å; V527-I530 PolarHBondContact O-N 3Å; V527-N531 WeakPolarHBondContact O-CB 3.13Å; V527-N531 PolarHBondContact O-N 2.96Å; V527-L580 HydrophobicContact CG2-CD2 3.89Å; V527-Y633 HydrophobicContact CB-CE1 3.9Å; V527-Y633 HydrophobicContact CG1-CE1 3.71Å; V527-Y633 HydrophobicContact CG2-CE1 4.09Å; V527-F637 HydrophobicContact CB-CG 4.49Å; V527-F637 HydrophobicContact CG1-CB 3.97Å; V527-F637 HydrophobicContact CG1-CD1 4.37Å; V527-F637 HydrophobicContact CG1-CD2 3.71Å; V527-F637 HydrophobicContact CG1-CE2 4.3Å; V527-F637 HydrophobicContact CG1-CG 3.73Å; V527-F637 HydrophobicContact CG2-CD1 3.86Å; V527-F637 HydrophobicContact CG2-CE1 4.18Å; V527-F637 HydrophobicContact CG2-CG 4.07Å; V527-Y705 HydrophobicContact CG1-CD2 3.67Å; V527-Y705 HydrophobicContact CG1-CE2 3.64Å
528	R	92.4	Very high	92	Very high	47 Å²	47	36.2 Å²	36.2	18%	0.177	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-51.5	174.9	-179.1	179.6	58.7	78.3	5.9	111.4	E524 S525 I530 N531 L532 L564 D567 M709	E524-R528 PolarHBondContact O-N 2.86Å; S525-R528 PolarHBondContact O-N 2.95Å; R528-I530 VanDerWaalsContact C-N 3.34Å; R528-I530 PolarHBondContact O-N 3.36Å; R528-N531 WeakPolarHBondContact O-CB 3.46Å; R528-N531 PolarHBondContact O-N 3.47Å; R528-N531 VanDerWaalsContact O-N 3.11Å; R528-L532 HydrophobicContact CG-CD1 3.89Å; R528-L532 HydrophobicContact CG-CG 4.46Å; R528-L532 WeakPolarHBondContact O-CG 3.33Å; R528-L532 PolarHBondContact O-N 2.82Å; R528-L564 PolarHBondContact NH2-O 3.1Å; R528-D567 IonicContact NH1-OD1 3.94Å; R528-M709 HydrophobicContact CB-CE 4.05Å; R528-M709 HydrophobicContact CG-CE 3.91Å
529	Y	92.6	Very high	92.4	Very high	8 Å²	8	33.7 Å²	33.7	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-38.9	-178.9	-166.4	-84.3	0	0	0	112.1	S525 L532 Y533 L564 N569 H571 I573 V576	S525-Y529 VanDerWaalsContact O-CB 3.28Å; S525-Y529 WeakPolarHBondContact O-CB 3.25Å; S525-Y529 PolarHBondContact O-N 3.29Å; Y529-L532 PolarHBondContact O-N 2.92Å; Y529-Y533 AromaticContact CD1-CD2 3.85Å; Y529-Y533 HydrophobicContact CD1-CD2 3.85Å; Y529-Y533 AromaticContact CD2-CD2 3.82Å; Y529-Y533 HydrophobicContact CD2-CD2 3.82Å; Y529-Y533 AromaticContact CD2-CE2 3.65Å; Y529-Y533 HydrophobicContact CD2-CE2 3.65Å; Y529-Y533 AromaticContact CE1-CD2 3.85Å; Y529-Y533 HydrophobicContact CE1-CD2 3.85Å; Y529-Y533 AromaticContact CE2-CD2 3.82Å; Y529-Y533 HydrophobicContact CE2-CD2 3.82Å; Y529-Y533 AromaticContact CE2-CE2 3.68Å; Y529-Y533 HydrophobicContact CE2-CE2 3.68Å; Y529-Y533 AromaticContact CG-CD2 3.84Å; Y529-Y533 HydrophobicContact CG-CD2 3.84Å; Y529-Y533 HydrophobicContact CG-CE2 4.1Å; Y529-Y533 AromaticContact CZ-CD2 3.85Å; Y529-Y533 VanDerWaalsContact O-CD2 3.3Å; Y529-Y533 WeakPolarHBondContact O-CD2 3.25Å; Y529-Y533 PolarHBondContact O-N 3.27Å; Y529-L564 HydrophobicContact CD2-CB 4.07Å; Y529-L564 HydrophobicContact CD2-CD2 4.2Å; Y529-L564 HydrophobicContact CE2-CD2 4.33Å; Y529-L564 HydrophobicContact CG-CD1 4.46Å; Y529-L564 HydrophobicContact CG-CD2 4.48Å; Y529-N569 PolarHBondContact OH-O 3.28Å; Y529-H571 PolarHBondContact OH-N 3.38Å; Y529-H571 PolarHBondContact OH-O 3.3Å; Y529-I573 HydrophobicContact CD1-CD1 3.68Å; Y529-I573 HydrophobicContact CE1-CD1 3.85Å; Y529-V576 HydrophobicContact CD1-CB 4.16Å; Y529-V576 HydrophobicContact CD1-CG1 3.95Å; Y529-V576 HydrophobicContact CD1-CG2 3.81Å; Y529-V576 HydrophobicContact CE1-CB 4.49Å; Y529-V576 HydrophobicContact CE1-CG2 3.78Å; Y529-V576 HydrophobicContact CG-CG1 4.4Å
530	I	94.2	Very high	92.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-73.2	-28.4	175.3	-59.6	164.5	0	0	0	112	C526 V527 R528 G534 L535 I540 F541 I573 V576 A577 L580 F637	C526-I530 WeakPolarHBondContact O-CB 3.37Å; C526-I530 WeakPolarHBondContact O-CD1 3.21Å; C526-I530 WeakPolarHBondContact O-CG1 3.5Å; C526-I530 PolarHBondContact O-N 3.42Å; V527-I530 PolarHBondContact O-N 3Å; R528-I530 VanDerWaalsContact C-N 3.34Å; R528-I530 PolarHBondContact O-N 3.36Å; I530-G534 CarbonylContact O-C 3.53Å; I530-G534 WeakPolarHBondContact O-CA 3.3Å; I530-G534 PolarHBondContact O-N 2.92Å; I530-L535 PolarHBondContact O-N 3.09Å; I530-I540 HydrophobicContact CG2-CD1 4.43Å; I530-I540 HydrophobicContact CG2-CG1 4.18Å; I530-F541 HydrophobicContact CD1-CE1 4.1Å; I530-F541 HydrophobicContact CD1-CE2 4.46Å; I530-F541 HydrophobicContact CD1-CZ 3.61Å; I530-F541 HydrophobicContact CG2-CE2 4.44Å; I530-I573 HydrophobicContact CB-CD1 4.45Å; I530-I573 HydrophobicContact CG1-CD1 3.99Å; I530-V576 HydrophobicContact CD1-CG1 4.17Å; I530-V576 HydrophobicContact CG1-CG1 4.01Å; I530-A577 HydrophobicContact CD1-CB 3.95Å; I530-L580 HydrophobicContact CD1-CD2 4.28Å; I530-F637 HydrophobicContact CB-CE2 4.35Å; I530-F637 HydrophobicContact CB-CZ 3.99Å; I530-F637 HydrophobicContact CG2-CE2 4.16Å; I530-F637 HydrophobicContact CG2-CZ 3.67Å
531	N	91.6	Very high	92.9	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.059	16%	0.158	C	C	.	.	H	α-helix	trans	-70.6	-36.6	171.8	-164.2	57.2	0	0	0	112.8	V527 R528 L535 H640 Y705 K707 M709	V527-N531 WeakPolarHBondContact O-CB 3.13Å; V527-N531 PolarHBondContact O-N 2.96Å; R528-N531 WeakPolarHBondContact O-CB 3.46Å; R528-N531 PolarHBondContact O-N 3.47Å; R528-N531 VanDerWaalsContact O-N 3.11Å; N531-L535 VanDerWaalsContact O-CD1 3.27Å; N531-L535 WeakPolarHBondContact O-CD1 3.46Å; N531-L535 WeakPolarHBondContact O-CG 3.34Å; N531-H640 PolarHBondContact OD1-ND1 3Å; N531-Y705 VanDerWaalsContact CG-OH 3.28Å; N531-Y705 PolarHBondContact OD1-OH 2.92Å; N531-K707 PolarHBondContact ND2-O 3.14Å; N531-M709 HydrophobicContact CB-CG 4.48Å; N531-M709 VanDerWaalsContact ND2-CG 3.34Å; N531-M709 WeakPolarHBondContact ND2-CG 3.44Å
532	L	89.9	Confident	93.2	Very high	70 Å²	70	39.1 Å²	39.1	37%	0.366	18%	0.175	S	C	.	.	H	α-helix	trans	-75.5	-43	179.4	-69.2	170	0	0	0	112.5	R528 Y529	R528-L532 HydrophobicContact CG-CD1 3.89Å; R528-L532 HydrophobicContact CG-CG 4.46Å; R528-L532 WeakPolarHBondContact O-CG 3.33Å; R528-L532 PolarHBondContact O-N 2.82Å; Y529-L532 PolarHBondContact O-N 2.92Å
533	Y	90.8	Very high	93.2	Very high	104 Å²	104	42.1 Å²	42.1	41%	0.408	19%	0.193	S	C	.	.	H	α-helix	trans	-122.5	-9.1	-168.9	-44.9	-62.3	0	0	0	115	Y529 D567	Y529-Y533 AromaticContact CD1-CD2 3.85Å; Y529-Y533 HydrophobicContact CD1-CD2 3.85Å; Y529-Y533 AromaticContact CD2-CD2 3.82Å; Y529-Y533 HydrophobicContact CD2-CD2 3.82Å; Y529-Y533 AromaticContact CD2-CE2 3.65Å; Y529-Y533 HydrophobicContact CD2-CE2 3.65Å; Y529-Y533 AromaticContact CE1-CD2 3.85Å; Y529-Y533 HydrophobicContact CE1-CD2 3.85Å; Y529-Y533 AromaticContact CE2-CD2 3.82Å; Y529-Y533 HydrophobicContact CE2-CD2 3.82Å; Y529-Y533 AromaticContact CE2-CE2 3.68Å; Y529-Y533 HydrophobicContact CE2-CE2 3.68Å; Y529-Y533 AromaticContact CG-CD2 3.84Å; Y529-Y533 HydrophobicContact CG-CD2 3.84Å; Y529-Y533 HydrophobicContact CG-CE2 4.1Å; Y529-Y533 AromaticContact CZ-CD2 3.85Å; Y529-Y533 VanDerWaalsContact O-CD2 3.3Å; Y529-Y533 WeakPolarHBondContact O-CD2 3.25Å; Y529-Y533 PolarHBondContact O-N 3.27Å; Y533-D567 PolarHBondContact OH-OD1 2.99Å; Y533-D567 PolarHBondContact OH-OD2 3.04Å
534	G	90.6	Very high	93	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.			trans	-115.1	-6.7	-167.8	0	0	0	0	0	117	I530 Q536 Q537	I530-G534 CarbonylContact O-C 3.53Å; I530-G534 WeakPolarHBondContact O-CA 3.3Å; I530-G534 PolarHBondContact O-N 2.92Å; G534-Q536 VanDerWaalsContact C-N 3.26Å; G534-Q536 PolarHBondContact O-N 3.44Å; G534-Q537 WeakPolarHBondContact O-CB 3.25Å; G534-Q537 PolarHBondContact O-N 3.15Å; G534-Q537 VanDerWaalsContact O-N 3.11Å
535	L	93.6	Very high	92.9	Very high	21 Å²	21	44 Å²	44	11%	0.11	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-35.5	-176.2	-68.2	176.8	0	0	0	113.4	I530 N531 L641 Y644 N648	I530-L535 PolarHBondContact O-N 3.09Å; N531-L535 VanDerWaalsContact O-CD1 3.27Å; N531-L535 WeakPolarHBondContact O-CD1 3.46Å; N531-L535 WeakPolarHBondContact O-CG 3.34Å; L535-L641 HydrophobicContact CD2-CD1 3.83Å; L535-Y644 HydrophobicContact CB-CD1 4.41Å; L535-Y644 HydrophobicContact CB-CD2 4.18Å; L535-Y644 HydrophobicContact CB-CE2 4.32Å; L535-Y644 HydrophobicContact CB-CG 4.23Å; L535-Y644 HydrophobicContact CD1-CD2 4.45Å; L535-Y644 HydrophobicContact CD1-CE2 3.84Å; L535-Y644 HydrophobicContact CD2-CD2 4.3Å; L535-Y644 HydrophobicContact CD2-CE2 4.34Å; L535-Y644 HydrophobicContact CG-CE2 4.4Å; L535-Y644 WeakPolarHBondContact O-CB 3.42Å; L535-N648 WeakPolarHBondContact O-CB 3.26Å; L535-N648 PolarHBondContact O-ND2 3.05Å
536	Q	91.4	Very high	92.9	Very high	112 Å²	112	46.4 Å²	46.4	52%	0.523	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	1	-179.8	-66.2	176.5	-42.4	0	0	113.7	G534 Q538 Y644 E647	G534-Q536 VanDerWaalsContact C-N 3.26Å; G534-Q536 PolarHBondContact O-N 3.44Å; Q536-Q538 PolarHBondContact O-N 3.02Å; Q536-Y644 HydrophobicContact CG-CD1 4.35Å; Q536-E647 HydrophobicContact CG-CB 4.47Å; Q536-E647 VanDerWaalsContact NE2-CD 3.29Å; Q536-E647 PolarHBondContact NE2-OE1 2.88Å; Q536-E647 PolarHBondContact NE2-OE2 2.87Å; Q536-E647 VanDerWaalsContact NE2-OE2 3.08Å
537	Q	94.4	Very high	92.8	Very high	64 Å²	64	52.3 Å²	52.3	30%	0.299	26%	0.258	S	S	.	.			trans	-71.4	117.5	-173	169.7	63.1	-1.9	0	0	111.9	G534 G539 I540 I573 N574 N648	G534-Q537 WeakPolarHBondContact O-CB 3.25Å; G534-Q537 PolarHBondContact O-N 3.15Å; G534-Q537 VanDerWaalsContact O-N 3.11Å; Q537-G539 PolarHBondContact O-N 2.77Å; Q537-I540 HydrophobicContact CB-CB 4.14Å; Q537-I540 HydrophobicContact CB-CD1 4.34Å; Q537-I540 HydrophobicContact CG-CB 4.11Å; Q537-I540 HydrophobicContact CG-CD1 4.05Å; Q537-I540 WeakPolarHBondContact O-CB 3.27Å; Q537-I540 PolarHBondContact O-N 3.35Å; Q537-I540 VanDerWaalsContact O-N 3.09Å; Q537-I573 HydrophobicContact CB-CG2 4.3Å; Q537-I573 HydrophobicContact CG-CG2 3.7Å; Q537-N574 PolarHBondContact NE2-ND2 2.67Å; Q537-N574 VanDerWaalsContact NE2-ND2 3.11Å; Q537-N574 PolarHBondContact NE2-OD1 3.13Å; Q537-N574 VanDerWaalsContact NE2-OD1 3.09Å; Q537-N648 WeakPolarHBondContact O-CB 3.49Å
538	Q	94.9	Very high	92.6	Very high	130 Å²	130	57.2 Å²	57.2	61%	0.607	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	119.7	-176.4	-164.9	-175.2	28.5	0	0	111.8	Q536 I540 N648 M649	Q536-Q538 PolarHBondContact O-N 3.02Å; Q538-I540 VanDerWaalsContact C-N 3.34Å; Q538-N648 WeakPolarHBondContact CA-O 3.39Å; Q538-M649 HydrophobicContact CG-CB 4.35Å; Q538-M649 HydrophobicContact CG-CG 3.8Å
539	G	93.5	Very high	92.6	Very high	9 Å²	9	57 Å²	57	9%	0.093	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	23.8	-179.8	0	0	0	0	0	114.1	Q537 F541 R542 V543 N648	Q537-G539 PolarHBondContact O-N 2.77Å; G539-F541 PolarHBondContact O-N 3.11Å; G539-R542 CarbonylContact O-C 3.57Å; G539-R542 WeakPolarHBondContact O-CA 3.48Å; G539-R542 WeakPolarHBondContact O-CB 3.41Å; G539-R542 PolarHBondContact O-N 2.89Å; G539-V543 PolarHBondContact O-N 3.42Å; G539-N648 PolarHBondContact N-O 3.12Å
540	I	94.5	Very high	92.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	139.6	171.1	-170	64.3	0	0	0	111.2	I530 Q537 Q538 R542 I573 A577 L641 N648 M650	I530-I540 HydrophobicContact CG2-CD1 4.43Å; I530-I540 HydrophobicContact CG2-CG1 4.18Å; Q537-I540 HydrophobicContact CB-CB 4.14Å; Q537-I540 HydrophobicContact CB-CD1 4.34Å; Q537-I540 HydrophobicContact CG-CB 4.11Å; Q537-I540 HydrophobicContact CG-CD1 4.05Å; Q537-I540 WeakPolarHBondContact O-CB 3.27Å; Q537-I540 PolarHBondContact O-N 3.35Å; Q537-I540 VanDerWaalsContact O-N 3.09Å; Q538-I540 VanDerWaalsContact C-N 3.34Å; I540-R542 PolarHBondContact O-N 3.4Å; I540-I573 HydrophobicContact CD1-CG1 4.04Å; I540-A577 HydrophobicContact CD1-CB 3.62Å; I540-A577 HydrophobicContact CG1-CB 4.32Å; I540-L641 HydrophobicContact CG2-CD1 4.14Å; I540-L641 HydrophobicContact CG2-CD2 4.15Å; I540-L641 HydrophobicContact CG2-CG 4.44Å; I540-N648 HydrophobicContact CG2-CB 4.39Å; I540-M650 HydrophobicContact CG2-CB 4.4Å; I540-M650 HydrophobicContact CG2-CG 3.93Å; I540-M650 WeakPolarHBondContact O-CE 3.33Å; I540-M650 WeakPolarHBondContact O-CG 3.37Å
541	F	96.2	Very high	92.6	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.009	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-19.5	-166.5	-58.5	-73.6	0	0	0	117.7	I530 G539 A577 L580 K581 F637 L638 L641 L655 C658 F659	I530-F541 HydrophobicContact CD1-CE1 4.1Å; I530-F541 HydrophobicContact CD1-CE2 4.46Å; I530-F541 HydrophobicContact CD1-CZ 3.61Å; I530-F541 HydrophobicContact CG2-CE2 4.44Å; G539-F541 PolarHBondContact O-N 3.11Å; F541-A577 HydrophobicContact CD1-CB 3.65Å; F541-A577 WeakPolarHBondContact CD1-O 3.24Å; F541-A577 HydrophobicContact CE1-CB 3.58Å; F541-A577 WeakPolarHBondContact CE1-O 3.37Å; F541-A577 HydrophobicContact CG-CB 4.24Å; F541-A577 HydrophobicContact CZ-CB 4.14Å; F541-L580 HydrophobicContact CE1-CB 4.35Å; F541-L580 HydrophobicContact CE1-CD2 4.01Å; F541-L580 HydrophobicContact CZ-CD2 3.9Å; F541-K581 HydrophobicContact CB-CD 4.31Å; F541-K581 HydrophobicContact CD1-CD 3.88Å; F541-K581 HydrophobicContact CD1-CG 3.84Å; F541-K581 HydrophobicContact CE1-CG 4.36Å; F541-K581 PolarHBondContact O-NZ 3.02Å; F541-F637 AromaticContact CE2-CE1 3.97Å; F541-F637 HydrophobicContact CE2-CE1 3.97Å; F541-F637 HydrophobicContact CE2-CZ 4.1Å; F541-F637 AromaticContact CZ-CE1 3.89Å; F541-F637 HydrophobicContact CZ-CE1 3.89Å; F541-F637 HydrophobicContact CZ-CZ 4.16Å; F541-L638 HydrophobicContact CE2-CD2 4.44Å; F541-L641 HydrophobicContact CD2-CD2 3.78Å; F541-L641 HydrophobicContact CE2-CD2 3.51Å; F541-L655 HydrophobicContact CD2-CD2 4.21Å; F541-C658 HydrophobicContact CB-CB 4.2Å; F541-F659 HydrophobicContact CB-CE2 4.11Å; F541-F659 AromaticContact CD1-CE2 3.66Å; F541-F659 HydrophobicContact CD1-CE2 3.66Å; F541-F659 AromaticContact CD1-CZ 3.61Å; F541-F659 HydrophobicContact CD1-CZ 3.61Å; F541-F659 AromaticContact CD2-CE2 3.83Å; F541-F659 HydrophobicContact CD2-CE2 3.83Å; F541-F659 HydrophobicContact CD2-CZ 4.36Å; F541-F659 AromaticContact CE1-CE2 3.99Å; F541-F659 HydrophobicContact CE1-CE2 3.99Å; F541-F659 AromaticContact CE1-CZ 3.56Å; F541-F659 HydrophobicContact CE1-CZ 3.56Å; F541-F659 HydrophobicContact CE2-CE2 4.14Å; F541-F659 HydrophobicContact CE2-CZ 4.32Å; F541-F659 AromaticContact CG-CE2 3.58Å; F541-F659 HydrophobicContact CG-CE2 3.58Å; F541-F659 HydrophobicContact CG-CZ 4.03Å; F541-F659 HydrophobicContact CZ-CE2 4.22Å; F541-F659 AromaticContact CZ-CZ 3.94Å; F541-F659 HydrophobicContact CZ-CZ 3.94Å
542	R	94.6	Very high	92.6	Very high	167 Å²	167	63.9 Å²	63.9	63%	0.63	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-39.3	173.8	177.2	176.4	170.9	168.6	-2.9	112.3	G539 I540 M650	G539-R542 CarbonylContact O-C 3.57Å; G539-R542 WeakPolarHBondContact O-CA 3.48Å; G539-R542 WeakPolarHBondContact O-CB 3.41Å; G539-R542 PolarHBondContact O-N 2.89Å; I540-R542 PolarHBondContact O-N 3.4Å; R542-M650 HydrophobicContact CB-CE 4Å; R542-M650 HydrophobicContact CB-SD 3.76Å
543	V	93.1	Very high	92.7	Very high	63 Å²	63	60.7 Å²	60.7	38%	0.382	31%	0.309	S	S	.	.	S	Bend	trans	-74.5	134.9	173.2	178.6	0	0	0	0	109.4	G539 N574	G539-V543 PolarHBondContact O-N 3.42Å; V543-N574 HydrophobicContact CG1-CB 4.45Å
544	P	89.7	Confident	92.8	Very high	104 Å²	104	57.3 Å²	57.3	68%	0.675	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-84.1	124	174	31.9	-31.7	0	0	0	111.3
545	G	90.1	Very high	92.8	Very high	7 Å²	7	60.1 Å²	60.1	7%	0.072	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-70.5	172.2	169.5	0	0	0	0	0	114.5	Q547 N574	G545-Q547 PolarHBondContact O-N 3.42Å; G545-Q547 PolarHBondContact O-NE2 3.45Å; G545-N574 VanDerWaalsContact CA-C 3.49Å; G545-N574 PolarHBondContact N-O 3.16Å
546	S	93.3	Very high	92.5	Very high	55 Å²	55	59.9 Å²	59.9	39%	0.385	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-58.1	118.3	-179.1	176.1	0	0	0	0	111.8	V548 E549 V550 S575	S546-V548 PolarHBondContact O-N 2.87Å; S546-V548 VanDerWaalsContact O-N 3.16Å; S546-E549 WeakPolarHBondContact CB-OE2 3.18Å; S546-E549 PolarHBondContact O-N 2.91Å; S546-V550 WeakPolarHBondContact O-CB 3.26Å; S546-V550 VanDerWaalsContact O-CG2 3.23Å; S546-V550 WeakPolarHBondContact O-CG2 3.44Å; S546-V550 PolarHBondContact O-N 3.42Å; S546-S575 PolarHBondContact N-OG 3.41Å
547	Q	92.6	Very high	92.4	Very high	125 Å²	125	55 Å²	55	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-67.9	-15.9	-177.3	-62.4	-59	-78.5	0	0	113.8	G545 N551	G545-Q547 PolarHBondContact O-N 3.42Å; G545-Q547 PolarHBondContact O-NE2 3.45Å; Q547-N551 PolarHBondContact O-ND2 2.91Å
548	V	91.3	Very high	92	Very high	102 Å²	102	55.2 Å²	55.2	62%	0.618	29%	0.29	S	S	*	.	H	α-helix	trans	-75.7	-55.9	172.4	179.7	0	0	0	0	109	S546 V550 N551 D552	S546-V548 PolarHBondContact O-N 2.87Å; S546-V548 VanDerWaalsContact O-N 3.16Å; V548-V550 PolarHBondContact O-N 3.06Å; V548-N551 CarbonylContact O-C 3.5Å; V548-N551 WeakPolarHBondContact O-CA 3.37Å; V548-N551 WeakPolarHBondContact O-CB 3.11Å; V548-N551 PolarHBondContact O-N 3.15Å; V548-D552 WeakPolarHBondContact CG1-OD2 3.46Å; V548-D552 PolarHBondContact O-N 3.44Å
549	E	92.8	Very high	91.5	Very high	44 Å²	44	54.5 Å²	54.5	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-40.9	-179.1	-173.8	-179.2	-160.8	0	0	113.2	S546 N551 D552 I553 H571 D572 S575	S546-E549 WeakPolarHBondContact CB-OE2 3.18Å; S546-E549 PolarHBondContact O-N 2.91Å; E549-N551 PolarHBondContact O-N 3.37Å; E549-D552 PolarHBondContact O-N 2.89Å; E549-I553 HydrophobicContact CG-CD1 3.92Å; E549-I553 HydrophobicContact CG-CG1 4.45Å; E549-I553 WeakPolarHBondContact O-CB 3.3Å; E549-I553 WeakPolarHBondContact O-CG1 3.45Å; E549-I553 PolarHBondContact O-N 2.98Å; E549-H571 WeakPolarHBondContact OE1-CA 3.38Å; E549-D572 PolarHBondContact OE1-N 2.98Å; E549-D572 VanDerWaalsContact OE2-CB 3.32Å; E549-D572 WeakPolarHBondContact OE2-CB 3.45Å; E549-S575 VanDerWaalsContact OE2-CB 3.32Å; E549-S575 WeakPolarHBondContact OE2-CB 3.34Å; E549-S575 PolarHBondContact OE2-OG 3.44Å
550	V	93.1	Very high	90.7	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-54.8	-40.3	170.2	168.9	0	0	0	0	110.9	S546 V548 K554 S575 V579 L582	S546-V550 WeakPolarHBondContact O-CB 3.26Å; S546-V550 VanDerWaalsContact O-CG2 3.23Å; S546-V550 WeakPolarHBondContact O-CG2 3.44Å; S546-V550 PolarHBondContact O-N 3.42Å; V548-V550 PolarHBondContact O-N 3.06Å; V550-K554 WeakPolarHBondContact O-CB 3.47Å; V550-K554 PolarHBondContact O-N 2.94Å; V550-S575 WeakPolarHBondContact CG2-O 3.31Å; V550-V579 HydrophobicContact CB-CG2 4.3Å; V550-V579 HydrophobicContact CG1-CG2 4.02Å; V550-V579 HydrophobicContact CG2-CG2 4.48Å; V550-V579 WeakPolarHBondContact O-CG2 3.13Å; V550-L582 HydrophobicContact CG1-CD2 3.78Å
551	N	92.4	Very high	90.2	Very high	72 Å²	72	60.5 Å²	60.5	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-74.2	-36.8	175.4	-81.6	-69.6	0	0	0	112	Q547 V548 E549 K554 N555	Q547-N551 PolarHBondContact O-ND2 2.91Å; V548-N551 CarbonylContact O-C 3.5Å; V548-N551 WeakPolarHBondContact O-CA 3.37Å; V548-N551 WeakPolarHBondContact O-CB 3.11Å; V548-N551 PolarHBondContact O-N 3.15Å; E549-N551 PolarHBondContact O-N 3.37Å; N551-K554 PolarHBondContact O-N 3.42Å; N551-N555 WeakPolarHBondContact O-CB 3.21Å; N551-N555 PolarHBondContact O-N 2.98Å; N551-N555 PolarHBondContact O-ND2 3.24Å; N551-N555 PolarHBondContact O-OD1 3.33Å
552	D	91.9	Very high	89.8	Confident	87 Å²	87	61.7 Å²	61.7	47%	0.465	33%	0.327	S	S	.	.	H	α-helix	trans	-71.5	-40.2	-178.7	-68	-34.5	0	0	0	113.1	V548 E549 N555 S556	V548-D552 WeakPolarHBondContact CG1-OD2 3.46Å; V548-D552 PolarHBondContact O-N 3.44Å; E549-D552 PolarHBondContact O-N 2.89Å; D552-N555 PolarHBondContact O-N 2.99Å; D552-S556 WeakPolarHBondContact O-CB 3.27Å; D552-S556 PolarHBondContact O-N 2.95Å; D552-S556 PolarHBondContact O-OG 2.99Å
553	I	93	Very high	89.4	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.015	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-50.2	170.1	-65.2	167.7	0	0	0	109.5	E549 N555 S556 F557 P563 H571 V576 V579	E549-I553 HydrophobicContact CG-CD1 3.92Å; E549-I553 HydrophobicContact CG-CG1 4.45Å; E549-I553 WeakPolarHBondContact O-CB 3.3Å; E549-I553 WeakPolarHBondContact O-CG1 3.45Å; E549-I553 PolarHBondContact O-N 2.98Å; I553-N555 PolarHBondContact O-N 3.24Å; I553-S556 WeakPolarHBondContact O-CB 3.28Å; I553-S556 PolarHBondContact O-N 3.36Å; I553-F557 HydrophobicContact CG2-CD2 3.9Å; I553-F557 HydrophobicContact CG2-CE2 3.67Å; I553-F557 WeakPolarHBondContact O-CD2 3.32Å; I553-F557 PolarHBondContact O-N 3.13Å; I553-P563 HydrophobicContact CB-CG 4.38Å; I553-P563 HydrophobicContact CG2-CG 3.79Å; I553-H571 HydrophobicContact CD1-CB 4.12Å; I553-V576 HydrophobicContact CD1-CG2 4.15Å; I553-V579 HydrophobicContact CB-CG2 3.89Å; I553-V579 HydrophobicContact CD1-CG2 4.47Å; I553-V579 HydrophobicContact CG2-CB 4.35Å; I553-V579 HydrophobicContact CG2-CG1 4.09Å; I553-V579 HydrophobicContact CG2-CG2 3.76Å
554	K	91.8	Very high	89.1	Confident	32 Å²	32	51.6 Å²	51.6	14%	0.139	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-44.2	176.5	176.8	-109.7	171.9	-148.4	0	112.5	F504 V550 N551 S556 F557 E558 L582	F504-K554 HydrophobicContact CD1-CG 3.79Å; F504-K554 HydrophobicContact CD2-CG 3.69Å; F504-K554 HydrophobicContact CE1-CB 4.32Å; F504-K554 HydrophobicContact CE1-CG 3.59Å; F504-K554 HydrophobicContact CE2-CB 4.17Å; F504-K554 HydrophobicContact CE2-CG 3.5Å; F504-K554 HydrophobicContact CG-CG 3.84Å; F504-K554 HydrophobicContact CZ-CB 3.9Å; F504-K554 HydrophobicContact CZ-CG 3.43Å; F504-K554 VanDerWaalsContact CZ-CG 3.43Å; V550-K554 WeakPolarHBondContact O-CB 3.47Å; V550-K554 PolarHBondContact O-N 2.94Å; N551-K554 PolarHBondContact O-N 3.42Å; K554-S556 PolarHBondContact O-N 2.82Å; K554-F557 PolarHBondContact O-N 3.42Å; K554-E558 WeakPolarHBondContact CE-OE1 3.41Å; K554-E558 IonicContact NZ-OE1 3.9Å; K554-E558 PolarHBondContact NZ-OE1 3.38Å; K554-E558 IonicContact NZ-OE2 3.58Å; K554-E558 PolarHBondContact NZ-OE2 2.91Å; K554-E558 PolarHBondContact O-N 3.48Å; K554-L582 HydrophobicContact CG-CD2 4.21Å
555	N	90.3	Very high	88.7	Confident	59 Å²	59	51.7 Å²	51.7	32%	0.316	28%	0.278	S	S	.	.	H	α-helix	trans	-67.7	-21.4	176.9	-71.4	-24.6	0	0	0	112.4	N551 D552 I553 R559	N551-N555 WeakPolarHBondContact O-CB 3.21Å; N551-N555 PolarHBondContact O-N 2.98Å; N551-N555 PolarHBondContact O-ND2 3.24Å; N551-N555 PolarHBondContact O-OD1 3.33Å; D552-N555 PolarHBondContact O-N 2.99Å; I553-N555 PolarHBondContact O-N 3.24Å; N555-R559 WeakPolarHBondContact O-CG 3.41Å; N555-R559 PolarHBondContact O-N 2.98Å; N555-R559 PolarHBondContact O-NH1 3Å
556	S	88.3	Confident	87.6	Confident	16 Å²	16	56.2 Å²	56.2	11%	0.112	30%	0.301	C	S	.	.	H	α-helix	trans	-80.3	-46.9	176.1	-56.1	0	0	0	0	110.9	D552 I553 K554 E558 R559 G560 E561	D552-S556 WeakPolarHBondContact O-CB 3.27Å; D552-S556 PolarHBondContact O-N 2.95Å; D552-S556 PolarHBondContact O-OG 2.99Å; I553-S556 WeakPolarHBondContact O-CB 3.28Å; I553-S556 PolarHBondContact O-N 3.36Å; K554-S556 PolarHBondContact O-N 2.82Å; S556-E558 VanDerWaalsContact C-N 3.27Å; S556-E558 PolarHBondContact O-N 3.1Å; S556-R559 WeakPolarHBondContact O-CA 3.36Å; S556-R559 WeakPolarHBondContact O-CB 3.49Å; S556-R559 PolarHBondContact O-N 3.01Å; S556-R559 PolarHBondContact OG-NH1 2.67Å; S556-R559 PolarHBondContact OG-NH2 3.04Å; S556-G560 PolarHBondContact O-N 3.08Å; S556-E561 CarbonylContact C-O 3.48Å; S556-E561 PolarHBondContact O-N 2.82Å; S556-E561 VanDerWaalsContact O-N 3.11Å; S556-E561 VanDerWaalsContact O-O 3.09Å
557	F	89.7	Confident	86	Confident	10 Å²	10	58.4 Å²	58.4	4%	0.044	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-36.9	168.9	-74.4	-64.3	0	0	0	112.5	L503 F504 L521 V522 I553 K554 R559 G560 E561 D562 P563 L564 V579	L503-F557 HydrophobicContact CD2-CB 3.64Å; F504-F557 HydrophobicContact CE2-CB 4.17Å; L521-F557 HydrophobicContact CG-CE1 4.38Å; V522-F557 HydrophobicContact CB-CD1 4.08Å; V522-F557 HydrophobicContact CB-CD2 4.2Å; V522-F557 HydrophobicContact CB-CE1 4.29Å; V522-F557 HydrophobicContact CB-CE2 4.4Å; V522-F557 HydrophobicContact CB-CG 4.04Å; V522-F557 HydrophobicContact CB-CZ 4.44Å; V522-F557 HydrophobicContact CG2-CD1 4.49Å; V522-F557 HydrophobicContact CG2-CD2 3.72Å; V522-F557 HydrophobicContact CG2-CE2 3.9Å; V522-F557 HydrophobicContact CG2-CG 4.04Å; V522-F557 HydrophobicContact CG2-CZ 4.37Å; I553-F557 HydrophobicContact CG2-CD2 3.9Å; I553-F557 HydrophobicContact CG2-CE2 3.67Å; I553-F557 WeakPolarHBondContact O-CD2 3.32Å; I553-F557 PolarHBondContact O-N 3.13Å; K554-F557 PolarHBondContact O-N 3.42Å; F557-R559 PolarHBondContact O-N 3.49Å; F557-G560 PolarHBondContact O-N 2.98Å; F557-E561 WeakPolarHBondContact CA-O 3.24Å; F557-E561 PolarHBondContact N-O 3.14Å; F557-D562 HydrophobicContact CE1-CB 4.11Å; F557-D562 WeakPolarHBondContact CE1-OD1 3.26Å; F557-D562 WeakPolarHBondContact CZ-OD1 3.23Å; F557-P563 HydrophobicContact CD2-CG 4.24Å; F557-P563 HydrophobicContact CE2-CG 3.95Å; F557-P563 HydrophobicContact CZ-CG 4.25Å; F557-L564 HydrophobicContact CE2-CD1 4.23Å; F557-L564 HydrophobicContact CE2-CG 4.4Å; F557-L564 HydrophobicContact CZ-CD1 4.05Å; F557-L564 HydrophobicContact CZ-CG 4.16Å; F557-V579 HydrophobicContact CD2-CG1 4.49Å
558	E	85.9	Confident	84	Confident	69 Å²	69	60.8 Å²	60.8	32%	0.322	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.3	172.3	-78.2	-171.9	163.1	0	0	115	F504 K554 S556	F504-E558 HydrophobicContact CD2-CG 3.83Å; K554-E558 WeakPolarHBondContact CE-OE1 3.41Å; K554-E558 IonicContact NZ-OE1 3.9Å; K554-E558 PolarHBondContact NZ-OE1 3.38Å; K554-E558 IonicContact NZ-OE2 3.58Å; K554-E558 PolarHBondContact NZ-OE2 2.91Å; K554-E558 PolarHBondContact O-N 3.48Å; S556-E558 VanDerWaalsContact C-N 3.27Å; S556-E558 PolarHBondContact O-N 3.1Å
559	R	82.9	Confident	82.3	Confident	115 Å²	115	60.1 Å²	60.1	43%	0.434	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-9.3	169.8	-68.4	-177.1	-49.2	-92.9	9.6	112.9	N555 S556 F557 E561	N555-R559 WeakPolarHBondContact O-CG 3.41Å; N555-R559 PolarHBondContact O-N 2.98Å; N555-R559 PolarHBondContact O-NH1 3Å; S556-R559 WeakPolarHBondContact O-CA 3.36Å; S556-R559 WeakPolarHBondContact O-CB 3.49Å; S556-R559 PolarHBondContact O-N 3.01Å; S556-R559 PolarHBondContact OG-NH1 2.67Å; S556-R559 PolarHBondContact OG-NH2 3.04Å; F557-R559 PolarHBondContact O-N 3.49Å; R559-E561 HydrophobicContact CB-CG 4.27Å; R559-E561 IonicContact CZ-OE2 3Å; R559-E561 IonicContact NE-OE1 3.58Å; R559-E561 IonicContact NE-OE2 3.77Å; R559-E561 PolarHBondContact NE-OE2 3.24Å; R559-E561 IonicContact NH2-OE2 3.73Å; R559-E561 PolarHBondContact NH2-OE2 3.23Å
560	G	78.2	Confident	81.1	Confident	52 Å²	52	62.6 Å²	62.6	54%	0.536	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	24.2	-169.2	0	0	0	0	0	113.3	S556 F557	S556-G560 PolarHBondContact O-N 3.08Å; F557-G560 PolarHBondContact O-N 2.98Å
561	E	83.3	Confident	80.7	Confident	82 Å²	82	63.9 Å²	63.9	38%	0.383	33%	0.333	S	S	.	.			trans	-106.5	133.9	174	-64	166.6	171.9	0	0	108.1	S556 F557 R559 P563	S556-E561 CarbonylContact C-O 3.48Å; S556-E561 PolarHBondContact O-N 2.82Å; S556-E561 VanDerWaalsContact O-N 3.11Å; S556-E561 VanDerWaalsContact O-O 3.09Å; F557-E561 WeakPolarHBondContact CA-O 3.24Å; F557-E561 PolarHBondContact N-O 3.14Å; R559-E561 HydrophobicContact CB-CG 4.27Å; R559-E561 IonicContact CZ-OE2 3Å; R559-E561 IonicContact NE-OE1 3.58Å; R559-E561 IonicContact NE-OE2 3.77Å; R559-E561 PolarHBondContact NE-OE2 3.24Å; R559-E561 IonicContact NH2-OE2 3.73Å; R559-E561 PolarHBondContact NH2-OE2 3.23Å; E561-P563 VanDerWaalsContact O-CD 3.29Å; E561-P563 WeakPolarHBondContact O-CD 3.32Å
562	D	86.9	Confident	80.6	Confident	27 Å²	27	62.9 Å²	62.9	14%	0.144	33%	0.327	C	S	.	.			trans	-91.8	107.8	169.3	-175	-3	0	0	0	109.2	L521 S525 F557 L564 I565	L521-D562 HydrophobicContact CD2-CB 4.19Å; S525-D562 VanDerWaalsContact CB-OD2 3.23Å; S525-D562 WeakPolarHBondContact CB-OD2 3.44Å; S525-D562 PolarHBondContact OG-OD2 2.98Å; F557-D562 HydrophobicContact CE1-CB 4.11Å; F557-D562 WeakPolarHBondContact CE1-OD1 3.26Å; F557-D562 WeakPolarHBondContact CZ-OD1 3.23Å; D562-L564 PolarHBondContact O-N 3.44Å; D562-L564 WeakPolarHBondContact OD1-CA 3.38Å; D562-L564 WeakPolarHBondContact OD1-CB 3.43Å; D562-L564 PolarHBondContact OD1-N 2.95Å; D562-I565 HydrophobicContact CB-CB 4.14Å; D562-I565 HydrophobicContact CB-CG2 4.46Å; D562-I565 WeakPolarHBondContact O-CG2 3.13Å
563	P	85.9	Confident	80.7	Confident	19 Å²	19	59.7 Å²	59.7	12%	0.123	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.7	178.5	33.1	-36.6	0	0	0	113.4	I553 F557 E561 H571	I553-P563 HydrophobicContact CB-CG 4.38Å; I553-P563 HydrophobicContact CG2-CG 3.79Å; F557-P563 HydrophobicContact CD2-CG 4.24Å; F557-P563 HydrophobicContact CE2-CG 3.95Å; F557-P563 HydrophobicContact CZ-CG 4.25Å; E561-P563 VanDerWaalsContact O-CD 3.29Å; E561-P563 WeakPolarHBondContact O-CD 3.32Å; P563-H571 PolarHBondContact O-NE2 3.18Å
564	L	88.1	Confident	80.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	2	-174.9	-50.6	-178.3	0	0	0	113.1	C526 R528 Y529 F557 D562 H571 V576	C526-L564 HydrophobicContact CB-CD1 4.4Å; R528-L564 PolarHBondContact NH2-O 3.1Å; Y529-L564 HydrophobicContact CD2-CB 4.07Å; Y529-L564 HydrophobicContact CD2-CD2 4.2Å; Y529-L564 HydrophobicContact CE2-CD2 4.33Å; Y529-L564 HydrophobicContact CG-CD1 4.46Å; Y529-L564 HydrophobicContact CG-CD2 4.48Å; F557-L564 HydrophobicContact CE2-CD1 4.23Å; F557-L564 HydrophobicContact CE2-CG 4.4Å; F557-L564 HydrophobicContact CZ-CD1 4.05Å; F557-L564 HydrophobicContact CZ-CG 4.16Å; D562-L564 PolarHBondContact O-N 3.44Å; D562-L564 WeakPolarHBondContact OD1-CA 3.38Å; D562-L564 WeakPolarHBondContact OD1-CB 3.43Å; D562-L564 PolarHBondContact OD1-N 2.95Å; L564-H571 HydrophobicContact CD2-CB 4.43Å; L564-H571 VanDerWaalsContact CD2-CD2 3.45Å; L564-H571 WeakPolarHBondContact CD2-CD2 3.35Å; L564-V576 HydrophobicContact CD1-CG1 3.77Å; L564-V576 HydrophobicContact CD1-CG2 4.42Å; L564-V576 HydrophobicContact CD2-CG2 3.92Å
565	I	80.1	Confident	81	Confident	105 Å²	105	58.7 Å²	58.7	54%	0.538	31%	0.307	S	S	.	.	S	Bend	trans	-73	-34.7	-174.6	-162.4	167.5	0	0	0	113.4	D562	D562-I565 HydrophobicContact CB-CB 4.14Å; D562-I565 HydrophobicContact CB-CG2 4.46Å; D562-I565 WeakPolarHBondContact O-CG2 3.13Å
566	D	68.5	Low	81.3	Confident	102 Å²	102	55.9 Å²	55.9	55%	0.545	29%	0.292	S	S	.	.	S	Bend	trans	-96.3	122.7	176.6	-63.4	-47.5	0	0	0	110.4	Q568 N569	D566-Q568 HydrophobicContact CB-CB 4.45Å; D566-Q568 PolarHBondContact O-N 3.42Å; D566-N569 PolarHBondContact O-N 2.79Å
567	D	58.6	Low	81.7	Confident	102 Å²	102	55.1 Å²	55.1	55%	0.545	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	18.2	173.9	-65.5	15.5	0	0	0	114	R528 Y533	R528-D567 IonicContact NH1-OD1 3.94Å; Y533-D567 PolarHBondContact OH-OD1 2.99Å; Y533-D567 PolarHBondContact OH-OD2 3.04Å
568	Q	50.3	Low	82	Confident	175 Å²	175	55.3 Å²	55.3	82%	0.818	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-13.1	-177	-62.1	-68.5	-39.1	0	0	113.1	D566	D566-Q568 HydrophobicContact CB-CB 4.45Å; D566-Q568 PolarHBondContact O-N 3.42Å
569	N	57.2	Low	82.5	Confident	87 Å²	87	52 Å²	52	47%	0.465	28%	0.275	S	S	.	.	S	Bend	trans	-101.1	107.6	172.5	-78.2	-44.3	0	0	0	110.1	Y529 D566 H571	Y529-N569 PolarHBondContact OH-O 3.28Å; D566-N569 PolarHBondContact O-N 2.79Å; N569-H571 VanDerWaalsContact C-N 3.29Å; N569-H571 VanDerWaalsContact CB-NE2 3.32Å; N569-H571 WeakPolarHBondContact CB-NE2 3.43Å; N569-H571 PolarHBondContact O-CD2 3.38Å; N569-H571 PolarHBondContact O-N 2.85Å
570	D	65.9	Low	83.2	Confident	97 Å²	97	46.5 Å²	46.5	52%	0.519	26%	0.255	S	S	.	.			trans	-79	71.5	179.4	-162.8	54.6	0	0	0	111.7	Q324	Q324-D570 WeakPolarHBondContact CB-OD2 3.35Å; Q324-D570 VanDerWaalsContact CD-OD2 3.3Å; Q324-D570 HydrophobicContact CG-CB 4.43Å; Q324-D570 WeakPolarHBondContact CG-OD2 3.41Å; Q324-D570 VanDerWaalsContact NE2-CG 3.31Å; Q324-D570 PolarHBondContact NE2-OD1 3.01Å; Q324-D570 PolarHBondContact NE2-OD2 3.42Å
571	H	85.4	Confident	84	Confident	31 Å²	31	46 Å²	46	14%	0.144	24%	0.238	C	C	.	.			trans	-73.4	140.5	175.6	-56.3	-91	0	0	0	110.8	Y529 E549 I553 P563 L564 N569 I573 V576	Y529-H571 PolarHBondContact OH-N 3.38Å; Y529-H571 PolarHBondContact OH-O 3.3Å; E549-H571 WeakPolarHBondContact OE1-CA 3.38Å; I553-H571 HydrophobicContact CD1-CB 4.12Å; P563-H571 PolarHBondContact O-NE2 3.18Å; L564-H571 HydrophobicContact CD2-CB 4.43Å; L564-H571 VanDerWaalsContact CD2-CD2 3.45Å; L564-H571 WeakPolarHBondContact CD2-CD2 3.35Å; N569-H571 VanDerWaalsContact C-N 3.29Å; N569-H571 VanDerWaalsContact CB-NE2 3.32Å; N569-H571 WeakPolarHBondContact CB-NE2 3.43Å; N569-H571 PolarHBondContact O-CD2 3.38Å; N569-H571 PolarHBondContact O-N 2.85Å; H571-I573 PolarHBondContact O-N 2.89Å; H571-I573 VanDerWaalsContact O-N 3.13Å; H571-V576 HydrophobicContact CB-CG2 3.95Å
572	D	91.2	Very high	84.5	Confident	50 Å²	50	44.8 Å²	44.8	27%	0.267	23%	0.233	S	C	.	.			trans	-56.2	120.5	173.4	169.2	32	0	0	0	110.2	E549 N574 S575 V576	E549-D572 PolarHBondContact OE1-N 2.98Å; E549-D572 VanDerWaalsContact OE2-CB 3.32Å; E549-D572 WeakPolarHBondContact OE2-CB 3.45Å; D572-N574 PolarHBondContact O-N 3.34Å; D572-N574 VanDerWaalsContact O-N 3.12Å; D572-N574 WeakPolarHBondContact OD1-CB 3.37Å; D572-N574 PolarHBondContact OD1-N 3.39Å; D572-N574 PolarHBondContact OD1-ND2 3.33Å; D572-N574 WeakPolarHBondContact OD2-CB 3.46Å; D572-S575 CarbonylContact O-C 3.55Å; D572-S575 WeakPolarHBondContact O-CA 3.5Å; D572-S575 VanDerWaalsContact O-CB 3.27Å; D572-S575 WeakPolarHBondContact O-CB 3.36Å; D572-S575 PolarHBondContact O-N 2.86Å; D572-S575 PolarHBondContact OD2-N 3.5Å; D572-S575 PolarHBondContact OD2-OG 2.65Å; D572-V576 PolarHBondContact O-N 2.99Å
573	I	93.9	Very high	84.9	Confident	20 Å²	20	43.6 Å²	43.6	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-28.9	178.2	-163.5	61.9	0	0	0	112.5	Y529 I530 Q537 I540 H571 A577	Y529-I573 HydrophobicContact CD1-CD1 3.68Å; Y529-I573 HydrophobicContact CE1-CD1 3.85Å; I530-I573 HydrophobicContact CB-CD1 4.45Å; I530-I573 HydrophobicContact CG1-CD1 3.99Å; Q537-I573 HydrophobicContact CB-CG2 4.3Å; Q537-I573 HydrophobicContact CG-CG2 3.7Å; I540-I573 HydrophobicContact CD1-CG1 4.04Å; H571-I573 PolarHBondContact O-N 2.89Å; H571-I573 VanDerWaalsContact O-N 3.13Å; I573-A577 VanDerWaalsContact O-CB 3.29Å; I573-A577 WeakPolarHBondContact O-CB 3.39Å; I573-A577 PolarHBondContact O-N 2.96Å
574	N	95.2	Very high	85.4	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.08	22%	0.222	C	C	.	.	H	α-helix	trans	-78.9	-28.5	176.1	-47.2	-87.3	0	0	0	111.6	Q537 V543 G545 D572 G578	Q537-N574 PolarHBondContact NE2-ND2 2.67Å; Q537-N574 VanDerWaalsContact NE2-ND2 3.11Å; Q537-N574 PolarHBondContact NE2-OD1 3.13Å; Q537-N574 VanDerWaalsContact NE2-OD1 3.09Å; V543-N574 HydrophobicContact CG1-CB 4.45Å; G545-N574 VanDerWaalsContact CA-C 3.49Å; G545-N574 PolarHBondContact N-O 3.16Å; D572-N574 PolarHBondContact O-N 3.34Å; D572-N574 VanDerWaalsContact O-N 3.12Å; D572-N574 WeakPolarHBondContact OD1-CB 3.37Å; D572-N574 PolarHBondContact OD1-N 3.39Å; D572-N574 PolarHBondContact OD1-ND2 3.33Å; D572-N574 WeakPolarHBondContact OD2-CB 3.46Å; N574-G578 PolarHBondContact O-N 3.22Å
575	S	96.1	Very high	85.6	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-45.6	167.5	-69.9	0	0	0	0	111.2	S546 E549 V550 D572 A577 G578 V579	S546-S575 PolarHBondContact N-OG 3.41Å; E549-S575 VanDerWaalsContact OE2-CB 3.32Å; E549-S575 WeakPolarHBondContact OE2-CB 3.34Å; E549-S575 PolarHBondContact OE2-OG 3.44Å; V550-S575 WeakPolarHBondContact CG2-O 3.31Å; D572-S575 CarbonylContact O-C 3.55Å; D572-S575 WeakPolarHBondContact O-CA 3.5Å; D572-S575 VanDerWaalsContact O-CB 3.27Å; D572-S575 WeakPolarHBondContact O-CB 3.36Å; D572-S575 PolarHBondContact O-N 2.86Å; D572-S575 PolarHBondContact OD2-N 3.5Å; D572-S575 PolarHBondContact OD2-OG 2.65Å; S575-A577 PolarHBondContact O-N 3.16Å; S575-G578 CarbonylContact O-C 3.49Å; S575-G578 VanDerWaalsContact O-CA 3.27Å; S575-G578 WeakPolarHBondContact O-CA 3.36Å; S575-G578 PolarHBondContact O-N 2.86Å; S575-V579 WeakPolarHBondContact O-CG2 3.23Å; S575-V579 PolarHBondContact O-N 3.06Å
576	V	96	Very high	86.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175	-180	0	0	0	0	111.3	C526 Y529 I530 I553 L564 H571 D572 G578 V579 L580	C526-V576 HydrophobicContact CB-CG1 3.92Å; Y529-V576 HydrophobicContact CD1-CB 4.16Å; Y529-V576 HydrophobicContact CD1-CG1 3.95Å; Y529-V576 HydrophobicContact CD1-CG2 3.81Å; Y529-V576 HydrophobicContact CE1-CB 4.49Å; Y529-V576 HydrophobicContact CE1-CG2 3.78Å; Y529-V576 HydrophobicContact CG-CG1 4.4Å; I530-V576 HydrophobicContact CD1-CG1 4.17Å; I530-V576 HydrophobicContact CG1-CG1 4.01Å; I553-V576 HydrophobicContact CD1-CG2 4.15Å; L564-V576 HydrophobicContact CD1-CG1 3.77Å; L564-V576 HydrophobicContact CD1-CG2 4.42Å; L564-V576 HydrophobicContact CD2-CG2 3.92Å; H571-V576 HydrophobicContact CB-CG2 3.95Å; D572-V576 PolarHBondContact O-N 2.99Å; V576-G578 PolarHBondContact O-N 3.23Å; V576-V579 PolarHBondContact O-N 2.78Å; V576-V579 VanDerWaalsContact O-N 3.15Å; V576-L580 PolarHBondContact O-N 3.18Å; V576-L580 VanDerWaalsContact O-N 3.07Å
577	A	96.5	Very high	87.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-28.2	171.4	0	0	0	0	0	113.4	I530 I540 F541 I573 S575 K581	I530-A577 HydrophobicContact CD1-CB 3.95Å; I540-A577 HydrophobicContact CD1-CB 3.62Å; I540-A577 HydrophobicContact CG1-CB 4.32Å; F541-A577 HydrophobicContact CD1-CB 3.65Å; F541-A577 WeakPolarHBondContact CD1-O 3.24Å; F541-A577 HydrophobicContact CE1-CB 3.58Å; F541-A577 WeakPolarHBondContact CE1-O 3.37Å; F541-A577 HydrophobicContact CG-CB 4.24Å; F541-A577 HydrophobicContact CZ-CB 4.14Å; I573-A577 VanDerWaalsContact O-CB 3.29Å; I573-A577 WeakPolarHBondContact O-CB 3.39Å; I573-A577 PolarHBondContact O-N 2.96Å; S575-A577 PolarHBondContact O-N 3.16Å; A577-K581 VanDerWaalsContact O-CE 3.29Å; A577-K581 WeakPolarHBondContact O-CE 3.4Å; A577-K581 PolarHBondContact O-N 2.98Å
578	G	96.1	Very high	88.5	Confident	13 Å²	13	45 Å²	45	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-45.5	170	0	0	0	0	0	112.5	N574 S575 V576 K581 L582	N574-G578 PolarHBondContact O-N 3.22Å; S575-G578 CarbonylContact O-C 3.49Å; S575-G578 VanDerWaalsContact O-CA 3.27Å; S575-G578 WeakPolarHBondContact O-CA 3.36Å; S575-G578 PolarHBondContact O-N 2.86Å; V576-G578 PolarHBondContact O-N 3.23Å; G578-K581 PolarHBondContact O-N 3.24Å; G578-L582 VanDerWaalsContact O-CB 3.31Å; G578-L582 WeakPolarHBondContact O-CB 3.31Å; G578-L582 PolarHBondContact O-N 2.84Å
579	V	96.6	Very high	90.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-45.2	179	174.8	0	0	0	0	111.5	F504 V522 V550 I553 F557 S575 V576 K581 L582 Y583	F504-V579 HydrophobicContact CE1-CG1 4.41Å; F504-V579 HydrophobicContact CZ-CG1 3.94Å; V522-V579 HydrophobicContact CG2-CG1 3.96Å; V550-V579 HydrophobicContact CB-CG2 4.3Å; V550-V579 HydrophobicContact CG1-CG2 4.02Å; V550-V579 HydrophobicContact CG2-CG2 4.48Å; V550-V579 WeakPolarHBondContact O-CG2 3.13Å; I553-V579 HydrophobicContact CB-CG2 3.89Å; I553-V579 HydrophobicContact CD1-CG2 4.47Å; I553-V579 HydrophobicContact CG2-CB 4.35Å; I553-V579 HydrophobicContact CG2-CG1 4.09Å; I553-V579 HydrophobicContact CG2-CG2 3.76Å; F557-V579 HydrophobicContact CD2-CG1 4.49Å; S575-V579 WeakPolarHBondContact O-CG2 3.23Å; S575-V579 PolarHBondContact O-N 3.06Å; V576-V579 PolarHBondContact O-N 2.78Å; V576-V579 VanDerWaalsContact O-N 3.15Å; V579-K581 VanDerWaalsContact C-N 3.33Å; V579-K581 PolarHBondContact O-N 2.62Å; V579-L582 WeakPolarHBondContact O-CB 3.43Å; V579-L582 PolarHBondContact O-N 3.26Å; V579-L582 VanDerWaalsContact O-N 3.09Å; V579-Y583 PolarHBondContact O-N 3.19Å
580	L	96.8	Very high	91.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.7	-42.8	178.3	-175.4	60	0	0	0	112	V523 C526 V527 I530 F541 V576 F584 F637	V523-L580 HydrophobicContact CB-CD1 4.32Å; V523-L580 HydrophobicContact CG1-CD1 4.22Å; V523-L580 HydrophobicContact CG2-CD1 4.34Å; C526-L580 HydrophobicContact CB-CB 3.96Å; C526-L580 HydrophobicContact CB-CD1 4.15Å; C526-L580 HydrophobicContact CB-CD2 4.46Å; C526-L580 HydrophobicContact CB-CG 4.42Å; V527-L580 HydrophobicContact CG2-CD2 3.89Å; I530-L580 HydrophobicContact CD1-CD2 4.28Å; F541-L580 HydrophobicContact CE1-CB 4.35Å; F541-L580 HydrophobicContact CE1-CD2 4.01Å; F541-L580 HydrophobicContact CZ-CD2 3.9Å; V576-L580 PolarHBondContact O-N 3.18Å; V576-L580 VanDerWaalsContact O-N 3.07Å; L580-F584 HydrophobicContact CD1-CD2 4.33Å; L580-F584 HydrophobicContact CD1-CE2 3.74Å; L580-F584 HydrophobicContact CG-CE2 4.27Å; L580-F584 VanDerWaalsContact O-CD2 3.29Å; L580-F584 WeakPolarHBondContact O-CD2 3.45Å; L580-F584 PolarHBondContact O-N 3.28Å; L580-F637 HydrophobicContact CD2-CE1 4.3Å
581	K	95.6	Very high	92.9	Very high	42 Å²	42	33 Å²	33	18%	0.183	16%	0.162	C	C	.	.	H	α-helix	trans	-67.5	-39.4	172.8	-70.6	-178.3	-64.5	172	0	112.5	F541 A577 G578 V579 Y583 F584 R585 F659 T662	F541-K581 HydrophobicContact CB-CD 4.31Å; F541-K581 HydrophobicContact CD1-CD 3.88Å; F541-K581 HydrophobicContact CD1-CG 3.84Å; F541-K581 HydrophobicContact CE1-CG 4.36Å; F541-K581 PolarHBondContact O-NZ 3.02Å; A577-K581 VanDerWaalsContact O-CE 3.29Å; A577-K581 WeakPolarHBondContact O-CE 3.4Å; A577-K581 PolarHBondContact O-N 2.98Å; G578-K581 PolarHBondContact O-N 3.24Å; V579-K581 VanDerWaalsContact C-N 3.33Å; V579-K581 PolarHBondContact O-N 2.62Å; K581-Y583 VanDerWaalsContact C-N 3.27Å; K581-Y583 PolarHBondContact O-N 2.94Å; K581-F584 PolarHBondContact O-N 3.48Å; K581-R585 WeakPolarHBondContact O-CB 3.48Å; K581-R585 PolarHBondContact O-N 3.06Å; K581-F659 HydrophobicContact CG-CE1 4.09Å; K581-F659 HydrophobicContact CG-CZ 4.07Å; K581-T662 HydrophobicContact CB-CG2 4.02Å; K581-T662 HydrophobicContact CG-CG2 4.29Å; K581-T662 WeakPolarHBondContact O-CG2 3.37Å
582	L	94.6	Very high	93.3	Very high	56 Å²	56	31.7 Å²	31.7	29%	0.293	16%	0.156	S	C	.	.	H	α-helix	trans	-63	-35.5	179.1	-179	61	0	0	0	111.6	F504 V550 K554 G578 V579 G586	F504-L582 HydrophobicContact CD1-CG 4.36Å; F504-L582 HydrophobicContact CE1-CG 4.31Å; V550-L582 HydrophobicContact CG1-CD2 3.78Å; K554-L582 HydrophobicContact CG-CD2 4.21Å; G578-L582 VanDerWaalsContact O-CB 3.31Å; G578-L582 WeakPolarHBondContact O-CB 3.31Å; G578-L582 PolarHBondContact O-N 2.84Å; V579-L582 WeakPolarHBondContact O-CB 3.43Å; V579-L582 PolarHBondContact O-N 3.26Å; V579-L582 VanDerWaalsContact O-N 3.09Å; L582-G586 PolarHBondContact O-N 3.16Å
583	Y	95.1	Very high	93.1	Very high	1 Å²	1	30.7 Å²	30.7	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-61.6	173.7	-180	-103.9	0	0	0	111.2	L503 F504 M508 P520 V522 V523 V579 K581 R585 G586 L587	L503-Y583 HydrophobicContact CD1-CE2 3.73Å; L503-Y583 HydrophobicContact CG-CD2 4.49Å; L503-Y583 HydrophobicContact CG-CE2 4.05Å; L503-Y583 VanDerWaalsContact O-CE2 3.3Å; L503-Y583 WeakPolarHBondContact O-CE2 3.5Å; F504-Y583 HydrophobicContact CD1-CD2 4.18Å; F504-Y583 HydrophobicContact CE1-CD2 4.17Å; F504-Y583 HydrophobicContact CG-CD2 4.45Å; F504-Y583 HydrophobicContact CZ-CD2 4.42Å; M508-Y583 HydrophobicContact SD-CE1 4.36Å; P520-Y583 HydrophobicContact CB-CE1 4.37Å; P520-Y583 HydrophobicContact CG-CE1 4.18Å; P520-Y583 VanDerWaalsContact CG-OH 3.28Å; P520-Y583 WeakPolarHBondContact CG-OH 3.49Å; V522-Y583 HydrophobicContact CG1-CD1 4.26Å; V522-Y583 HydrophobicContact CG1-CD2 3.42Å; V522-Y583 VanDerWaalsContact CG1-CD2 3.42Å; V522-Y583 HydrophobicContact CG1-CE1 4.4Å; V522-Y583 HydrophobicContact CG1-CE2 3.59Å; V522-Y583 HydrophobicContact CG1-CG 3.78Å; V523-Y583 HydrophobicContact CG2-CD1 3.5Å; V523-Y583 VanDerWaalsContact CG2-CD1 3.5Å; V523-Y583 HydrophobicContact CG2-CE1 3.47Å; V523-Y583 VanDerWaalsContact CG2-CE1 3.47Å; V523-Y583 HydrophobicContact CG2-CG 4.46Å; V579-Y583 PolarHBondContact O-N 3.19Å; K581-Y583 VanDerWaalsContact C-N 3.27Å; K581-Y583 PolarHBondContact O-N 2.94Å; Y583-R585 PolarHBondContact O-N 2.89Å; Y583-G586 PolarHBondContact O-N 3.31Å; Y583-L587 HydrophobicContact CE1-CD2 3.99Å; Y583-L587 HydrophobicContact CE2-CD2 4.11Å; Y583-L587 PolarHBondContact O-N 3.24Å
584	F	95.3	Very high	92.8	Very high	3 Å²	3	34.1 Å²	34.1	1%	0.013	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-38.3	-177.5	-70.5	-66.2	0	0	0	113.4	V523 L580 K581 G586 L587 L591 V630 L634 T662 L663	V523-F584 HydrophobicContact CB-CZ 4.41Å; V523-F584 HydrophobicContact CG1-CE2 4.3Å; V523-F584 HydrophobicContact CG1-CZ 3.86Å; V523-F584 HydrophobicContact CG2-CE1 4.21Å; V523-F584 HydrophobicContact CG2-CE2 4.06Å; V523-F584 HydrophobicContact CG2-CZ 3.59Å; L580-F584 HydrophobicContact CD1-CD2 4.33Å; L580-F584 HydrophobicContact CD1-CE2 3.74Å; L580-F584 HydrophobicContact CG-CE2 4.27Å; L580-F584 VanDerWaalsContact O-CD2 3.29Å; L580-F584 WeakPolarHBondContact O-CD2 3.45Å; L580-F584 PolarHBondContact O-N 3.28Å; K581-F584 PolarHBondContact O-N 3.48Å; F584-G586 PolarHBondContact O-N 2.83Å; F584-L587 HydrophobicContact CD1-CD1 4.07Å; F584-L591 HydrophobicContact CD1-CB 4.45Å; F584-L591 HydrophobicContact CD1-CD1 4.47Å; F584-L591 HydrophobicContact CD1-CD2 4.15Å; F584-L591 HydrophobicContact CE1-CD1 4.22Å; F584-L591 HydrophobicContact CE1-CD2 4.04Å; F584-V630 HydrophobicContact CE1-CG1 3.75Å; F584-V630 HydrophobicContact CZ-CG1 4.02Å; F584-L634 HydrophobicContact CD2-CD2 4.24Å; F584-L634 HydrophobicContact CE1-CD2 4.36Å; F584-L634 HydrophobicContact CE2-CD1 3.92Å; F584-L634 HydrophobicContact CE2-CD2 3.76Å; F584-L634 HydrophobicContact CE2-CG 4.4Å; F584-L634 HydrophobicContact CZ-CD1 4.38Å; F584-L634 HydrophobicContact CZ-CD2 3.84Å; F584-T662 HydrophobicContact CB-CG2 4.1Å; F584-L663 HydrophobicContact CB-CD2 3.61Å; F584-L663 HydrophobicContact CD1-CD2 4.16Å; F584-L663 HydrophobicContact CD2-CD2 4.12Å; F584-L663 HydrophobicContact CG-CD2 3.71Å
585	R	93.6	Very high	92.4	Very high	194 Å²	194	40.7 Å²	40.7	73%	0.732	20%	0.197	S	C	*	.	H	α-helix	trans	-65.4	-28.3	174.8	-176.6	176	178.1	-169.3	0.1	112.8	K581 Y583 T662	K581-R585 WeakPolarHBondContact O-CB 3.48Å; K581-R585 PolarHBondContact O-N 3.06Å; Y583-R585 PolarHBondContact O-N 2.89Å; R585-T662 HydrophobicContact CB-CG2 4.22Å
586	G	88.6	Confident	92.1	Very high	17 Å²	17	44.7 Å²	44.7	18%	0.175	21%	0.212	C	C	.	.	H	α-helix	trans	-81.7	-20.7	-177.1	0	0	0	0	0	114.4	N505 L582 Y583 F584	N505-G586 VanDerWaalsContact CA-O 3.25Å; N505-G586 WeakPolarHBondContact CA-O 3.25Å; L582-G586 PolarHBondContact O-N 3.16Å; Y583-G586 PolarHBondContact O-N 3.31Å; F584-G586 PolarHBondContact O-N 2.83Å
587	L	90.5	Very high	91.8	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.063	21%	0.213	C	C	.	.			trans	-54.7	139.7	-171.6	-62.7	-178.6	0	0	0	113.5	M508 Y583 F584 N589	M508-L587 HydrophobicContact CB-CD1 4.26Å; M508-L587 HydrophobicContact CB-CD2 4.1Å; M508-L587 HydrophobicContact SD-CD1 4.01Å; Y583-L587 HydrophobicContact CE1-CD2 3.99Å; Y583-L587 HydrophobicContact CE2-CD2 4.11Å; Y583-L587 PolarHBondContact O-N 3.24Å; F584-L587 HydrophobicContact CD1-CD1 4.07Å; L587-N589 VanDerWaalsContact C-N 3.34Å; L587-N589 VanDerWaalsContact CB-O 3.25Å; L587-N589 WeakPolarHBondContact CB-O 3.34Å; L587-N589 PolarHBondContact O-N 2.71Å
588	E	87.3	Confident	91.5	Very high	133 Å²	133	50.2 Å²	50.2	62%	0.621	24%	0.24	S	C	*	.	S	Bend	trans	-61.7	-43.2	177.7	-176	173.9	-167.8	0	0	111.6	G506 N507	G506-E588 VanDerWaalsContact C-CB 3.47Å; G506-E588 PolarHBondContact O-N 3.07Å; G506-E588 VanDerWaalsContact O-N 3.08Å; N507-E588 WeakPolarHBondContact CB-OE2 3.39Å; N507-E588 PolarHBondContact N-OE2 3.41Å; N507-E588 VanDerWaalsContact N-OE2 3.12Å
589	N	86.8	Confident	91.3	Very high	79 Å²	79	52.2 Å²	52.2	42%	0.422	25%	0.248	S	C	.	.	S	Bend	trans	-105.9	116.7	164.9	-69.3	-12.1	0	0	0	108.1	N507 L587	N507-N589 PolarHBondContact ND2-ND2 2.62Å; L587-N589 VanDerWaalsContact C-N 3.34Å; L587-N589 VanDerWaalsContact CB-O 3.25Å; L587-N589 WeakPolarHBondContact CB-O 3.34Å; L587-N589 PolarHBondContact O-N 2.71Å
590	P	89.4	Confident	91.1	Very high	23 Å²	23	52.2 Å²	52.2	15%	0.149	25%	0.248	C	C	.	.			trans	-61.2	154	175.7	-22.4	33.3	0	0	0	112.5	F592 P665	P590-F592 CarbonylContact O-C 3.56Å; P590-F592 PolarHBondContact O-N 3.09Å; P590-F592 VanDerWaalsContact O-N 3.12Å; P590-P665 HydrophobicContact CB-CG 3.8Å; P590-P665 HydrophobicContact CG-CG 3.55Å
591	L	90.7	Very high	90.9	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.016	25%	0.254	C	S	.	.	S	Bend	trans	-58.9	-29	-177	-166.4	70.4	0	0	0	112.8	M508 F584 V627 V630 M631 L634 L663	M508-L591 HydrophobicContact CE-CD1 3.77Å; M508-L591 HydrophobicContact SD-CD1 4.49Å; F584-L591 HydrophobicContact CD1-CB 4.45Å; F584-L591 HydrophobicContact CD1-CD1 4.47Å; F584-L591 HydrophobicContact CD1-CD2 4.15Å; F584-L591 HydrophobicContact CE1-CD1 4.22Å; F584-L591 HydrophobicContact CE1-CD2 4.04Å; L591-V627 HydrophobicContact CD1-CG1 4.14Å; L591-V627 WeakPolarHBondContact O-CG1 3.29Å; L591-V630 HydrophobicContact CD1-CB 4.4Å; L591-V630 HydrophobicContact CD1-CG1 4.01Å; L591-M631 HydrophobicContact CD1-CG 3.96Å; L591-M631 HydrophobicContact CD2-CG 3.82Å; L591-M631 HydrophobicContact CG-CG 3.7Å; L591-L634 HydrophobicContact CD2-CD2 3.89Å; L591-L663 HydrophobicContact CB-CD2 4.45Å; L591-L663 HydrophobicContact CD2-CD1 4.44Å; L591-L663 HydrophobicContact CD2-CD2 3.96Å
592	F	92.6	Very high	90.7	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.018	27%	0.265	C	S	.	.	S	Bend	trans	-104.5	108.8	164.4	-68.3	-104.8	0	0	0	108.9	P590 F600 M631 F635 L663 M664 I683 I686	P590-F592 CarbonylContact O-C 3.56Å; P590-F592 PolarHBondContact O-N 3.09Å; P590-F592 VanDerWaalsContact O-N 3.12Å; F592-F600 HydrophobicContact CD1-CD2 4.01Å; F592-F600 HydrophobicContact CD1-CE1 4.34Å; F592-F600 AromaticContact CD1-CE2 3.67Å; F592-F600 HydrophobicContact CD1-CE2 3.67Å; F592-F600 HydrophobicContact CD1-CG 4.49Å; F592-F600 AromaticContact CD1-CZ 3.85Å; F592-F600 HydrophobicContact CD1-CZ 3.85Å; F592-F600 HydrophobicContact CE1-CE1 4.24Å; F592-F600 HydrophobicContact CE1-CE2 4.36Å; F592-F600 HydrophobicContact CE1-CZ 4.09Å; F592-M631 HydrophobicContact CD1-CE 3.87Å; F592-M631 HydrophobicContact CD2-CE 3.98Å; F592-M631 HydrophobicContact CE1-CE 3.46Å; F592-M631 VanDerWaalsContact CE1-CE 3.46Å; F592-M631 HydrophobicContact CE2-CE 3.58Å; F592-M631 HydrophobicContact CG-CE 4.12Å; F592-M631 HydrophobicContact CZ-CE 3.29Å; F592-F635 AromaticContact CE2-CE2 3.95Å; F592-F635 HydrophobicContact CE2-CE2 3.95Å; F592-F635 AromaticContact CE2-CZ 3.93Å; F592-F635 HydrophobicContact CE2-CZ 3.93Å; F592-F635 AromaticContact CZ-CE2 3.84Å; F592-F635 HydrophobicContact CZ-CE2 3.84Å; F592-F635 AromaticContact CZ-CZ 3.81Å; F592-F635 HydrophobicContact CZ-CZ 3.81Å; F592-L663 HydrophobicContact CD2-CB 3.78Å; F592-L663 HydrophobicContact CE2-CB 3.86Å; F592-L663 HydrophobicContact CE2-CD1 4.21Å; F592-L663 PolarHBondContact N-O 3.25Å; F592-M664 HydrophobicContact CB-CB 3.95Å; F592-M664 HydrophobicContact CB-CG 3.87Å; F592-M664 HydrophobicContact CD1-SD 4.37Å; F592-M664 HydrophobicContact CD2-CB 4.18Å; F592-M664 HydrophobicContact CG-CB 4.07Å; F592-M664 HydrophobicContact CG-CG 4.22Å; F592-I683 HydrophobicContact CD2-CD1 4.28Å; F592-I683 HydrophobicContact CE1-CD1 4.23Å; F592-I683 HydrophobicContact CE2-CD1 3.53Å; F592-I683 HydrophobicContact CZ-CD1 3.5Å; F592-I686 HydrophobicContact CE1-CD1 3.57Å; F592-I686 HydrophobicContact CZ-CD1 3.62Å
593	P	88.8	Confident	90.6	Very high	30 Å²	30	51.7 Å²	51.7	20%	0.195	25%	0.252	C	S	.	.			trans	-59.2	139.2	-178.3	-27.2	36.3	0	0	0	112.8	E595 R596 F597 L623	P593-E595 VanDerWaalsContact CB-OE2 3.26Å; P593-E595 WeakPolarHBondContact CB-OE2 3.47Å; P593-E595 PolarHBondContact O-N 3.34Å; P593-R596 PolarHBondContact O-N 2.9Å; P593-F597 PolarHBondContact O-N 3.15Å; P593-L623 HydrophobicContact CG-CD2 3.89Å
594	K	86.3	Confident	90.4	Very high	91 Å²	91	53.6 Å²	53.6	40%	0.396	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-61.8	-28.8	-175	-67.8	-175.5	177.9	-175.4	0	112.2	R596 F597 P667	K594-R596 VanDerWaalsContact C-N 3.25Å; K594-R596 PolarHBondContact O-N 2.66Å; K594-F597 WeakPolarHBondContact O-CB 3.4Å; K594-F597 PolarHBondContact O-N 2.9Å; K594-P667 HydrophobicContact CB-CG 4.23Å; K594-P667 HydrophobicContact CG-CG 4.47Å
595	E	88.2	Confident	90	Very high	154 Å²	154	62 Å²	62	72%	0.72	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-63.8	-31.3	177.4	-58	65.6	-141.3	0	0	111.5	P593	P593-E595 VanDerWaalsContact CB-OE2 3.26Å; P593-E595 WeakPolarHBondContact CB-OE2 3.47Å; P593-E595 PolarHBondContact O-N 3.34Å
596	R	88.9	Confident	89.7	Confident	83 Å²	83	54.8 Å²	54.8	31%	0.313	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-92.1	-1.7	177.6	-69.5	-57.1	-160.5	-170.6	2.9	113.9	P593 K594 L598 D599 F600 I619 T622 L623	P593-R596 PolarHBondContact O-N 2.9Å; K594-R596 VanDerWaalsContact C-N 3.25Å; K594-R596 PolarHBondContact O-N 2.66Å; R596-L598 VanDerWaalsContact C-N 3.35Å; R596-L598 PolarHBondContact O-N 3.48Å; R596-D599 WeakPolarHBondContact CD-OD2 3.32Å; R596-D599 IonicContact CZ-OD2 2.7Å; R596-D599 IonicContact NE-OD2 3.13Å; R596-D599 IonicContact NH1-OD2 3.27Å; R596-D599 PolarHBondContact NH1-OD2 3.47Å; R596-D599 WeakPolarHBondContact O-CB 3.41Å; R596-D599 PolarHBondContact O-N 3.16Å; R596-D599 VanDerWaalsContact O-N 3.13Å; R596-F600 HydrophobicContact CB-CD2 3.89Å; R596-F600 HydrophobicContact CB-CE2 3.79Å; R596-F600 VanDerWaalsContact O-CD2 3.3Å; R596-F600 WeakPolarHBondContact O-CD2 3.26Å; R596-F600 PolarHBondContact O-N 2.89Å; R596-F600 VanDerWaalsContact O-N 3.08Å; R596-I619 HydrophobicContact CB-CG2 4.36Å; R596-I619 HydrophobicContact CG-CG2 4.3Å; R596-T622 PolarHBondContact NE-OG1 3.44Å; R596-T622 PolarHBondContact NH2-OG1 2.7Å; R596-L623 HydrophobicContact CG-CD2 4.31Å
597	F	90.3	Very high	89.5	Confident	5 Å²	5	63.3 Å²	63.3	2%	0.022	31%	0.31	C	S	.	.	H	α-helix	trans	-56.9	-45.9	-174.6	-175.4	-88.6	0	0	0	112.5	P593 K594 I601 M664 I666 P667 C675 V679	P593-F597 PolarHBondContact O-N 3.15Å; K594-F597 WeakPolarHBondContact O-CB 3.4Å; K594-F597 PolarHBondContact O-N 2.9Å; F597-I601 HydrophobicContact CD1-CG1 4Å; F597-I601 HydrophobicContact CE1-CD1 4.3Å; F597-I601 HydrophobicContact CE1-CG1 3.7Å; F597-I601 HydrophobicContact CE2-CG1 4.45Å; F597-I601 HydrophobicContact CZ-CD1 4.08Å; F597-I601 HydrophobicContact CZ-CG1 3.93Å; F597-I601 WeakPolarHBondContact O-CB 3.5Å; F597-I601 WeakPolarHBondContact O-CG1 3.42Å; F597-I601 PolarHBondContact O-N 2.91Å; F597-M664 HydrophobicContact CD2-CE 3.55Å; F597-M664 HydrophobicContact CD2-CG 3.9Å; F597-M664 HydrophobicContact CE2-CE 3.89Å; F597-M664 HydrophobicContact CE2-CG 4.04Å; F597-M664 HydrophobicContact CG-CE 4.1Å; F597-I666 HydrophobicContact CE1-CG2 4.47Å; F597-I666 HydrophobicContact CE2-CB 4.36Å; F597-I666 HydrophobicContact CE2-CG1 4.12Å; F597-I666 HydrophobicContact CZ-CB 4.17Å; F597-I666 HydrophobicContact CZ-CG1 3.95Å; F597-I666 HydrophobicContact CZ-CG2 3.98Å; F597-P667 HydrophobicContact CB-CG 3.84Å; F597-P667 HydrophobicContact CD1-CG 4.07Å; F597-P667 VanDerWaalsContact CD2-CD 3.47Å; F597-P667 HydrophobicContact CD2-CG 4.12Å; F597-P667 VanDerWaalsContact CG-CD 3.43Å; F597-P667 HydrophobicContact CG-CG 3.75Å; F597-C675 HydrophobicContact CZ-CB 4.2Å; F597-V679 HydrophobicContact CE2-CG2 3.66Å; F597-V679 HydrophobicContact CZ-CG2 3.81Å
598	L	89.8	Confident	89.5	Confident	111 Å²	111	65 Å²	65	58%	0.581	32%	0.322	S	S	*	.	H	α-helix	trans	-66.3	-37.2	178.2	-79.4	170.1	0	0	0	112.8	R596 I601 S602 Q670	R596-L598 VanDerWaalsContact C-N 3.35Å; R596-L598 PolarHBondContact O-N 3.48Å; L598-I601 PolarHBondContact O-N 3.08Å; L598-S602 WeakPolarHBondContact O-CB 3.11Å; L598-S602 PolarHBondContact O-N 3.15Å; L598-Q670 VanDerWaalsContact CD2-NE2 3.31Å
599	D	91.3	Very high	89.4	Confident	56 Å²	56	62 Å²	62	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-51.6	178.4	-60.1	-23.1	0	0	0	110	R596 I601 S602 I619	R596-D599 WeakPolarHBondContact CD-OD2 3.32Å; R596-D599 IonicContact CZ-OD2 2.7Å; R596-D599 IonicContact NE-OD2 3.13Å; R596-D599 IonicContact NH1-OD2 3.27Å; R596-D599 PolarHBondContact NH1-OD2 3.47Å; R596-D599 WeakPolarHBondContact O-CB 3.41Å; R596-D599 PolarHBondContact O-N 3.16Å; R596-D599 VanDerWaalsContact O-N 3.13Å; D599-I601 PolarHBondContact O-N 2.04Å; D599-S602 WeakPolarHBondContact O-CB 3.33Å; D599-S602 PolarHBondContact O-N 3.41Å; D599-S602 PolarHBondContact O-OG 3.3Å; D599-I619 HydrophobicContact CB-CD1 3.87Å; D599-I619 HydrophobicContact CB-CG1 4.25Å; D599-I619 HydrophobicContact CB-CG2 4.47Å
600	F	92.9	Very high	89.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-46.2	178	-78.7	-64.4	0	0	0	112.6	F592 R596 S602 T603 I616 I619 V620 M664 V682	F592-F600 HydrophobicContact CD1-CD2 4.01Å; F592-F600 HydrophobicContact CD1-CE1 4.34Å; F592-F600 AromaticContact CD1-CE2 3.67Å; F592-F600 HydrophobicContact CD1-CE2 3.67Å; F592-F600 HydrophobicContact CD1-CG 4.49Å; F592-F600 AromaticContact CD1-CZ 3.85Å; F592-F600 HydrophobicContact CD1-CZ 3.85Å; F592-F600 HydrophobicContact CE1-CE1 4.24Å; F592-F600 HydrophobicContact CE1-CE2 4.36Å; F592-F600 HydrophobicContact CE1-CZ 4.09Å; R596-F600 HydrophobicContact CB-CD2 3.89Å; R596-F600 HydrophobicContact CB-CE2 3.79Å; R596-F600 VanDerWaalsContact O-CD2 3.3Å; R596-F600 WeakPolarHBondContact O-CD2 3.26Å; R596-F600 PolarHBondContact O-N 2.89Å; R596-F600 VanDerWaalsContact O-N 3.08Å; F600-S602 PolarHBondContact O-N 2.9Å; F600-T603 WeakPolarHBondContact O-CB 3.45Å; F600-T603 PolarHBondContact O-N 3.16Å; F600-T603 PolarHBondContact O-OG1 3.01Å; F600-I616 HydrophobicContact CD1-CG2 4.49Å; F600-I616 HydrophobicContact CE1-CG2 4.16Å; F600-I619 HydrophobicContact CD1-CB 4.36Å; F600-I619 HydrophobicContact CD1-CD1 3.96Å; F600-I619 HydrophobicContact CD1-CG2 4.19Å; F600-I619 HydrophobicContact CD2-CG2 4.09Å; F600-I619 HydrophobicContact CE1-CB 3.87Å; F600-I619 HydrophobicContact CE1-CD1 4.32Å; F600-I619 HydrophobicContact CE1-CG2 3.71Å; F600-I619 HydrophobicContact CE2-CG2 3.6Å; F600-I619 HydrophobicContact CG-CD1 4.33Å; F600-I619 HydrophobicContact CG-CG2 4.36Å; F600-I619 HydrophobicContact CZ-CB 4.02Å; F600-I619 HydrophobicContact CZ-CG2 3.39Å; F600-V620 HydrophobicContact CE1-CG2 4.07Å; F600-V620 HydrophobicContact CZ-CG2 4.11Å; F600-M664 HydrophobicContact CB-CE 3.53Å; F600-M664 HydrophobicContact CD2-CE 4.31Å; F600-M664 HydrophobicContact CG-CE 4.24Å; F600-V682 HydrophobicContact CB-CG1 4.37Å; F600-V682 HydrophobicContact CD1-CG1 4.31Å
601	I	92.2	Very high	89.5	Confident	24 Å²	24	65.7 Å²	65.7	12%	0.123	33%	0.333	C	S	.	.	H	α-helix	trans	-64.7	-28.5	179	-64.9	-72.4	0	0	0	111.6	F597 L598 D599 T603 I604 M664 H678 V679	F597-I601 HydrophobicContact CD1-CG1 4Å; F597-I601 HydrophobicContact CE1-CD1 4.3Å; F597-I601 HydrophobicContact CE1-CG1 3.7Å; F597-I601 HydrophobicContact CE2-CG1 4.45Å; F597-I601 HydrophobicContact CZ-CD1 4.08Å; F597-I601 HydrophobicContact CZ-CG1 3.93Å; F597-I601 WeakPolarHBondContact O-CB 3.5Å; F597-I601 WeakPolarHBondContact O-CG1 3.42Å; F597-I601 PolarHBondContact O-N 2.91Å; L598-I601 PolarHBondContact O-N 3.08Å; D599-I601 PolarHBondContact O-N 2.04Å; I601-T603 VanDerWaalsContact C-N 3.27Å; I601-T603 PolarHBondContact O-N 2.9Å; I601-I604 HydrophobicContact CD1-CD1 4.27Å; I601-I604 HydrophobicContact CG2-CD1 4.43Å; I601-I604 WeakPolarHBondContact O-CD1 3.47Å; I601-I604 WeakPolarHBondContact O-CG1 3.47Å; I601-M664 HydrophobicContact CD1-CE 4.22Å; I601-M664 HydrophobicContact CG1-CE 4.03Å; I601-H678 HydrophobicContact CD1-CB 3.62Å; I601-H678 HydrophobicContact CG2-CB 4.19Å; I601-V679 HydrophobicContact CD1-CG2 3.83Å
602	S	91.1	Very high	89.6	Confident	59 Å²	59	66.5 Å²	66.5	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-29.8	177	81.8	0	0	0	0	113.4	L598 D599 F600 I604 K605	L598-S602 WeakPolarHBondContact O-CB 3.11Å; L598-S602 PolarHBondContact O-N 3.15Å; D599-S602 WeakPolarHBondContact O-CB 3.33Å; D599-S602 PolarHBondContact O-N 3.41Å; D599-S602 PolarHBondContact O-OG 3.3Å; F600-S602 PolarHBondContact O-N 2.9Å; S602-I604 PolarHBondContact O-N 3.37Å; S602-I604 VanDerWaalsContact O-N 3.16Å; S602-K605 WeakPolarHBondContact O-CB 3.43Å; S602-K605 PolarHBondContact O-N 3.48Å
603	T	92.6	Very high	89.6	Confident	4 Å²	4	66.3 Å²	66.3	3%	0.025	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-64.8	-20.2	-176	70	0	0	0	0	113.4	F600 I601 K605 L606 R612 H615 I616 I619	F600-T603 WeakPolarHBondContact O-CB 3.45Å; F600-T603 PolarHBondContact O-N 3.16Å; F600-T603 PolarHBondContact O-OG1 3.01Å; I601-T603 VanDerWaalsContact C-N 3.27Å; I601-T603 PolarHBondContact O-N 2.9Å; T603-K605 PolarHBondContact O-N 2.68Å; T603-L606 VanDerWaalsContact O-CB 3.22Å; T603-L606 WeakPolarHBondContact O-CB 3.28Å; T603-L606 WeakPolarHBondContact O-CG 3.36Å; T603-L606 PolarHBondContact O-N 2.69Å; T603-R612 WeakPolarHBondContact O-CD 3.4Å; T603-R612 WeakPolarHBondContact O-CG 3.28Å; T603-H615 HydrophobicContact CG2-CB 3.92Å; T603-I616 HydrophobicContact CG2-CG1 4.03Å; T603-I619 HydrophobicContact CG2-CD1 3.83Å
604	I	90.7	Very high	89.8	Confident	40 Å²	40	69.1 Å²	69.1	21%	0.205	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-72.2	-15.8	-178.5	-47	161.6	0	0	0	111.5	I601 S602 L606 H678 E681 V682	I601-I604 HydrophobicContact CD1-CD1 4.27Å; I601-I604 HydrophobicContact CG2-CD1 4.43Å; I601-I604 WeakPolarHBondContact O-CD1 3.47Å; I601-I604 WeakPolarHBondContact O-CG1 3.47Å; S602-I604 PolarHBondContact O-N 3.37Å; S602-I604 VanDerWaalsContact O-N 3.16Å; I604-L606 PolarHBondContact O-N 3.31Å; I604-H678 VanDerWaalsContact CD1-CA 3.5Å; I604-H678 HydrophobicContact CD1-CB 3.36Å; I604-H678 WeakPolarHBondContact CD1-O 3.43Å; I604-E681 HydrophobicContact CG2-CG 4.38Å; I604-V682 HydrophobicContact CD1-CG2 3.72Å; I604-V682 HydrophobicContact CG1-CG2 3.68Å
605	K	87.1	Confident	90.1	Very high	179 Å²	179	68.5 Å²	68.5	78%	0.778	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-72.1	-6.3	170.6	-60.3	175.5	-177.3	174.3	0	112.9	S602 T603	S602-K605 WeakPolarHBondContact O-CB 3.43Å; S602-K605 PolarHBondContact O-N 3.48Å; T603-K605 PolarHBondContact O-N 2.68Å
606	L	88.8	Confident	90.4	Very high	43 Å²	43	61.1 Å²	61.1	23%	0.225	31%	0.31	C	S	.	.			trans	-90.4	112.4	175.7	-55.6	170.8	0	0	0	109.2	T603 I604 S608 R612 H615	T603-L606 VanDerWaalsContact O-CB 3.22Å; T603-L606 WeakPolarHBondContact O-CB 3.28Å; T603-L606 WeakPolarHBondContact O-CG 3.36Å; T603-L606 PolarHBondContact O-N 2.69Å; I604-L606 PolarHBondContact O-N 3.31Å; L606-S608 VanDerWaalsContact C-N 3.31Å; L606-S608 PolarHBondContact O-N 3.49Å; L606-R612 HydrophobicContact CB-CB 4.25Å; L606-R612 PolarHBondContact O-NH1 2.96Å; L606-R612 VanDerWaalsContact O-NH1 3.14Å; L606-H615 HydrophobicContact CD1-CB 3.93Å; L606-H615 VanDerWaalsContact CD1-ND1 3.32Å; L606-H615 WeakPolarHBondContact CD1-ND1 3.25Å
607	E	83.4	Confident	90.7	Very high	197 Å²	197	60 Å²	60	92%	0.921	31%	0.308	S	S	*	.	S	Bend	trans	-64	-37.1	-179	-60.4	-176.9	168.5	0	0	111.7
608	S	89.6	Confident	90.8	Very high	46 Å²	46	64.3 Å²	64.3	32%	0.322	33%	0.328	S	S	.	.			trans	-75.4	121.5	176.8	176.1	0	0	0	0	111.5	L606 A610 E611 R612	L606-S608 VanDerWaalsContact C-N 3.31Å; L606-S608 PolarHBondContact O-N 3.49Å; S608-A610 VanDerWaalsContact C-N 3.33Å; S608-A610 PolarHBondContact O-N 2.91Å; S608-E611 PolarHBondContact O-N 3.12Å; S608-E611 PolarHBondContact OG-N 3.36Å; S608-R612 WeakPolarHBondContact O-CB 3.42Å; S608-R612 PolarHBondContact O-N 3.45Å
609	E	85.8	Confident	91	Very high	71 Å²	71	60 Å²	60	33%	0.332	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-35.7	177.1	-178.3	161.8	172.6	0	0	112.8	R612 A613 T685 N689	E609-R612 PolarHBondContact O-N 2.84Å; E609-R612 IonicContact OE2-NH2 2.63Å; E609-A613 WeakPolarHBondContact O-CB 3.49Å; E609-A613 PolarHBondContact O-N 2.95Å; E609-T685 HydrophobicContact CG-CG2 4.38Å; E609-N689 PolarHBondContact OE1-ND2 2.98Å
610	A	87.4	Confident	91.1	Very high	72 Å²	72	57.3 Å²	57.3	60%	0.595	29%	0.291	S	S	*	.	H	α-helix	trans	-67	-39.7	176.2	0	0	0	0	0	112.2	S608 H614	S608-A610 VanDerWaalsContact C-N 3.33Å; S608-A610 PolarHBondContact O-N 2.91Å; A610-H614 WeakPolarHBondContact O-CB 3.16Å; A610-H614 PolarHBondContact O-N 2.5Å
611	E	91.1	Very high	91	Very high	108 Å²	108	61.6 Å²	61.6	51%	0.505	32%	0.317	S	S	.	.	H	α-helix	trans	-69.1	-37.3	175	-66.1	173.2	-178.2	0	0	111.4	S608 H614 H615	S608-E611 PolarHBondContact O-N 3.12Å; S608-E611 PolarHBondContact OG-N 3.36Å; E611-H614 PolarHBondContact O-N 3.41Å; E611-H615 PolarHBondContact O-N 3.41Å; E611-H615 PolarHBondContact O-ND1 2.99Å
612	R	93.1	Very high	90.9	Very high	19 Å²	19	64 Å²	64	7%	0.072	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-47.4	174.1	-172.5	167.1	66.5	-104.4	1.1	111.4	T603 L606 S608 E609 H614 H615 I616 E681 T685	T603-R612 WeakPolarHBondContact O-CD 3.4Å; T603-R612 WeakPolarHBondContact O-CG 3.28Å; L606-R612 HydrophobicContact CB-CB 4.25Å; L606-R612 PolarHBondContact O-NH1 2.96Å; L606-R612 VanDerWaalsContact O-NH1 3.14Å; S608-R612 WeakPolarHBondContact O-CB 3.42Å; S608-R612 PolarHBondContact O-N 3.45Å; E609-R612 PolarHBondContact O-N 2.84Å; E609-R612 IonicContact OE2-NH2 2.63Å; R612-H614 VanDerWaalsContact C-N 3.35Å; R612-H614 PolarHBondContact O-N 3.5Å; R612-H615 PolarHBondContact O-N 3.13Å; R612-I616 HydrophobicContact CG-CD1 4Å; R612-I616 WeakPolarHBondContact O-CB 3.19Å; R612-I616 VanDerWaalsContact O-CG1 3.24Å; R612-I616 WeakPolarHBondContact O-CG1 3.31Å; R612-I616 PolarHBondContact O-N 3.39Å; R612-E681 IonicContact NH2-OE1 3.85Å; R612-T685 HydrophobicContact CG-CG2 4.27Å; R612-T685 PolarHBondContact NE-OG1 3.36Å; R612-T685 PolarHBondContact NH2-OG1 3.29Å
613	A	92.7	Very high	91	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-43.5	174.5	0	0	0	0	0	111.8	E609 I616 Q617 N689 I693	E609-A613 WeakPolarHBondContact O-CB 3.49Å; E609-A613 PolarHBondContact O-N 2.95Å; A613-I616 PolarHBondContact O-N 3.48Å; A613-Q617 WeakPolarHBondContact O-CB 3.22Å; A613-Q617 PolarHBondContact O-N 3.41Å; A613-N689 HydrophobicContact CB-CB 4.03Å; A613-I693 HydrophobicContact CB-CD1 4.07Å; A613-I693 HydrophobicContact CB-CG1 4.14Å
614	H	92.3	Very high	90.9	Very high	89 Å²	89	64 Å²	64	41%	0.412	33%	0.331	S	S	.	.	H	α-helix	trans	-67.2	-37.7	177.5	-173.7	54.5	0	0	0	113.4	A610 E611 R612 Q617 Q618	A610-H614 WeakPolarHBondContact O-CB 3.16Å; A610-H614 PolarHBondContact O-N 2.5Å; E611-H614 PolarHBondContact O-N 3.41Å; R612-H614 VanDerWaalsContact C-N 3.35Å; R612-H614 PolarHBondContact O-N 3.5Å; H614-Q617 PolarHBondContact ND1-OE1 3.33Å; H614-Q617 WeakPolarHBondContact O-CB 3.41Å; H614-Q617 PolarHBondContact O-N 3.27Å; H614-Q618 PolarHBondContact CD2-NE2 2.78Å; H614-Q618 VanDerWaalsContact CD2-NE2 3.33Å; H614-Q618 PolarHBondContact NE2-NE2 3.06Å; H614-Q618 WeakPolarHBondContact O-CG 2.74Å; H614-Q618 PolarHBondContact O-N 3.37Å
615	H	92.8	Very high	90.9	Very high	77 Å²	77	70.6 Å²	70.6	36%	0.356	35%	0.353	S	S	.	.	H	α-helix	trans	-68.1	-36.7	172.6	-76.7	81	0	0	0	112.2	T603 L606 E611 R612 Q618 I619	T603-H615 HydrophobicContact CG2-CB 3.92Å; L606-H615 HydrophobicContact CD1-CB 3.93Å; L606-H615 VanDerWaalsContact CD1-ND1 3.32Å; L606-H615 WeakPolarHBondContact CD1-ND1 3.25Å; E611-H615 PolarHBondContact O-N 3.41Å; E611-H615 PolarHBondContact O-ND1 2.99Å; R612-H615 PolarHBondContact O-N 3.13Å; H615-Q618 PolarHBondContact O-N 3.01Å; H615-I619 WeakPolarHBondContact O-CG1 3.35Å; H615-I619 PolarHBondContact O-N 2.86Å; H615-I619 VanDerWaalsContact O-N 3.14Å
616	I	95.1	Very high	91	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-44.4	173	-70.9	169.6	0	0	0	110.4	F600 T603 R612 A613 Q618 I619 V620 V682 T685 I686 I693	F600-I616 HydrophobicContact CD1-CG2 4.49Å; F600-I616 HydrophobicContact CE1-CG2 4.16Å; T603-I616 HydrophobicContact CG2-CG1 4.03Å; R612-I616 HydrophobicContact CG-CD1 4Å; R612-I616 WeakPolarHBondContact O-CB 3.19Å; R612-I616 VanDerWaalsContact O-CG1 3.24Å; R612-I616 WeakPolarHBondContact O-CG1 3.31Å; R612-I616 PolarHBondContact O-N 3.39Å; A613-I616 PolarHBondContact O-N 3.48Å; I616-Q618 PolarHBondContact O-N 2.9Å; I616-I619 PolarHBondContact O-N 2.8Å; I616-I619 VanDerWaalsContact O-N 3.14Å; I616-V620 HydrophobicContact CG2-CG2 4.29Å; I616-V620 WeakPolarHBondContact O-CG2 3.28Å; I616-V620 PolarHBondContact O-N 3.38Å; I616-V682 HydrophobicContact CD1-CG1 4.31Å; I616-T685 HydrophobicContact CD1-CG2 3.95Å; I616-I686 HydrophobicContact CD1-CG1 4.43Å; I616-I686 HydrophobicContact CG2-CD1 3.94Å; I616-I686 HydrophobicContact CG2-CG1 3.7Å; I616-I693 HydrophobicContact CB-CD1 4.46Å; I616-I693 HydrophobicContact CG2-CD1 4.02Å; I616-I693 HydrophobicContact CG2-CG1 4.3Å; I616-I693 HydrophobicContact CG2-CG2 3.85Å
617	Q	94.8	Very high	91.1	Very high	58 Å²	58	62.5 Å²	62.5	27%	0.271	32%	0.321	S	S	.	.	H	α-helix	trans	-54.7	-48.9	172.6	-173.5	-168.1	34.6	0	0	111.3	A613 H614 I619 V620 V621 V692	A613-Q617 WeakPolarHBondContact O-CB 3.22Å; A613-Q617 PolarHBondContact O-N 3.41Å; H614-Q617 PolarHBondContact ND1-OE1 3.33Å; H614-Q617 WeakPolarHBondContact O-CB 3.41Å; H614-Q617 PolarHBondContact O-N 3.27Å; Q617-I619 VanDerWaalsContact C-N 3.25Å; Q617-I619 PolarHBondContact O-N 2.98Å; Q617-V620 PolarHBondContact O-N 2.72Å; Q617-V620 VanDerWaalsContact O-N 3.16Å; Q617-V621 PolarHBondContact O-N 2.84Å; Q617-V692 VanDerWaalsContact CD-O 3.3Å; Q617-V692 PolarHBondContact NE2-O 3.31Å
618	Q	93	Very high	91.6	Very high	96 Å²	96	53.6 Å²	53.6	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-31.1	177.4	-72.4	177.9	18.6	0	0	113.5	H614 H615 I616 V621	H614-Q618 PolarHBondContact CD2-NE2 2.78Å; H614-Q618 VanDerWaalsContact CD2-NE2 3.33Å; H614-Q618 PolarHBondContact NE2-NE2 3.06Å; H614-Q618 WeakPolarHBondContact O-CG 2.74Å; H614-Q618 PolarHBondContact O-N 3.37Å; H615-Q618 PolarHBondContact O-N 3.01Å; I616-Q618 PolarHBondContact O-N 2.9Å; Q618-V621 WeakPolarHBondContact O-CG2 3.44Å
619	I	93.3	Very high	91.8	Very high	21 Å²	21	52.3 Å²	52.3	11%	0.108	27%	0.269	C	S	.	.	H	α-helix	trans	-77.7	-46.1	173.9	-59	160	0	0	0	110.2	R596 D599 F600 T603 H615 I616 Q617 V621 T622	R596-I619 HydrophobicContact CB-CG2 4.36Å; R596-I619 HydrophobicContact CG-CG2 4.3Å; D599-I619 HydrophobicContact CB-CD1 3.87Å; D599-I619 HydrophobicContact CB-CG1 4.25Å; D599-I619 HydrophobicContact CB-CG2 4.47Å; F600-I619 HydrophobicContact CD1-CB 4.36Å; F600-I619 HydrophobicContact CD1-CD1 3.96Å; F600-I619 HydrophobicContact CD1-CG2 4.19Å; F600-I619 HydrophobicContact CD2-CG2 4.09Å; F600-I619 HydrophobicContact CE1-CB 3.87Å; F600-I619 HydrophobicContact CE1-CD1 4.32Å; F600-I619 HydrophobicContact CE1-CG2 3.71Å; F600-I619 HydrophobicContact CE2-CG2 3.6Å; F600-I619 HydrophobicContact CG-CD1 4.33Å; F600-I619 HydrophobicContact CG-CG2 4.36Å; F600-I619 HydrophobicContact CZ-CB 4.02Å; F600-I619 HydrophobicContact CZ-CG2 3.39Å; T603-I619 HydrophobicContact CG2-CD1 3.83Å; H615-I619 WeakPolarHBondContact O-CG1 3.35Å; H615-I619 PolarHBondContact O-N 2.86Å; H615-I619 VanDerWaalsContact O-N 3.14Å; I616-I619 PolarHBondContact O-N 2.8Å; I616-I619 VanDerWaalsContact O-N 3.14Å; Q617-I619 VanDerWaalsContact C-N 3.25Å; Q617-I619 PolarHBondContact O-N 2.98Å; I619-V621 VanDerWaalsContact C-N 3.35Å; I619-V621 PolarHBondContact O-N 3.47Å; I619-T622 PolarHBondContact O-N 3.19Å; I619-T622 PolarHBondContact O-OG1 2.92Å
620	V	93.4	Very high	92.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-41.6	-178.2	166.7	0	0	0	0	112.2	F600 I616 Q617 T622 L623 I628 I693 F694	F600-V620 HydrophobicContact CE1-CG2 4.07Å; F600-V620 HydrophobicContact CZ-CG2 4.11Å; I616-V620 HydrophobicContact CG2-CG2 4.29Å; I616-V620 WeakPolarHBondContact O-CG2 3.28Å; I616-V620 PolarHBondContact O-N 3.38Å; Q617-V620 PolarHBondContact O-N 2.72Å; Q617-V620 VanDerWaalsContact O-N 3.16Å; V620-T622 PolarHBondContact O-N 3.46Å; V620-L623 VanDerWaalsContact O-CB 3.31Å; V620-L623 WeakPolarHBondContact O-CB 3.26Å; V620-L623 WeakPolarHBondContact O-CG 3.45Å; V620-L623 PolarHBondContact O-N 3.37Å; V620-I628 HydrophobicContact CG1-CG1 4.35Å; V620-I628 HydrophobicContact CG1-CG2 4.38Å; V620-I628 VanDerWaalsContact O-CD1 3.31Å; V620-I628 WeakPolarHBondContact O-CD1 3.47Å; V620-I693 HydrophobicContact CG2-CG2 4.13Å; V620-F694 HydrophobicContact CG1-CD1 3.8Å; V620-F694 HydrophobicContact CG1-CE1 3.73Å; V620-F694 HydrophobicContact CG2-CE1 4.4Å
621	V	90.8	Very high	92.5	Very high	89 Å²	89	45.5 Å²	45.5	54%	0.539	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.5	178	-61.3	0	0	0	0	114.4	Q617 Q618 I619	Q617-V621 PolarHBondContact O-N 2.84Å; Q618-V621 WeakPolarHBondContact O-CG2 3.44Å; I619-V621 VanDerWaalsContact C-N 3.35Å; I619-V621 PolarHBondContact O-N 3.47Å
622	T	91.2	Very high	92.7	Very high	75 Å²	75	41.2 Å²	41.2	46%	0.46	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-2.9	172.4	72.9	0	0	0	0	114.1	R596 I619 V620	R596-T622 PolarHBondContact NE-OG1 3.44Å; R596-T622 PolarHBondContact NH2-OG1 2.7Å; I619-T622 PolarHBondContact O-N 3.19Å; I619-T622 PolarHBondContact O-OG1 2.92Å; V620-T622 PolarHBondContact O-N 3.46Å
623	L	91.4	Very high	92.8	Very high	14 Å²	14	40.6 Å²	40.6	7%	0.073	20%	0.202	C	C	.	.	S	Bend	trans	-80.6	160.8	177.2	-57.4	178.9	0	0	0	111.1	P593 R596 V620 R625 V627 I628 M631	P593-L623 HydrophobicContact CG-CD2 3.89Å; R596-L623 HydrophobicContact CG-CD2 4.31Å; V620-L623 VanDerWaalsContact O-CB 3.31Å; V620-L623 WeakPolarHBondContact O-CB 3.26Å; V620-L623 WeakPolarHBondContact O-CG 3.45Å; V620-L623 PolarHBondContact O-N 3.37Å; L623-R625 PolarHBondContact O-N 2.97Å; L623-V627 HydrophobicContact CB-CG1 4.47Å; L623-V627 HydrophobicContact CD1-CG1 4.32Å; L623-I628 HydrophobicContact CB-CD1 4.45Å; L623-I628 HydrophobicContact CB-CG1 4Å; L623-I628 WeakPolarHBondContact O-CD1 3.34Å; L623-M631 HydrophobicContact CD1-CE 4.09Å; L623-M631 HydrophobicContact CD1-SD 3.64Å
624	P	91.3	Very high	93	Very high	50 Å²	50	40.6 Å²	40.6	33%	0.325	20%	0.201	S	C	.	.			trans	-57.3	137.8	173.3	-23.1	33.7	0	0	0	111.3	E509 T626 V627 I628	E509-P624 WeakPolarHBondContact OE2-CB 3.46Å; E509-P624 WeakPolarHBondContact OE2-CG 3.4Å; P624-T626 PolarHBondContact O-N 2.91Å; P624-T626 VanDerWaalsContact O-N 3.1Å; P624-V627 HydrophobicContact CB-CB 4.48Å; P624-V627 HydrophobicContact CB-CG2 4.12Å; P624-V627 HydrophobicContact CG-CG2 4.17Å; P624-V627 WeakPolarHBondContact O-CA 3.45Å; P624-V627 WeakPolarHBondContact O-CB 3.49Å; P624-V627 PolarHBondContact O-N 2.71Å; P624-I628 PolarHBondContact O-N 3.48Å; P624-I628 VanDerWaalsContact O-N 3.1Å
625	R	89.9	Confident	93.2	Very high	177 Å²	177	36.3 Å²	36.3	67%	0.668	18%	0.182	S	C	*	.	H	α-helix	trans	-49.3	-42.3	-178.4	-73.7	-174.7	173.9	-149.6	-3.3	112.8	L623 V627 I628 I629 L700	L623-R625 PolarHBondContact O-N 2.97Å; R625-V627 VanDerWaalsContact C-N 3.33Å; R625-V627 PolarHBondContact O-N 3.31Å; R625-I628 PolarHBondContact O-N 3.46Å; R625-I629 WeakPolarHBondContact O-CG1 3.24Å; R625-I629 PolarHBondContact O-N 2.96Å; R625-L700 HydrophobicContact CB-CD1 4.23Å; R625-L700 HydrophobicContact CG-CD1 4.03Å
626	T	89.4	Confident	93.4	Very high	42 Å²	42	33.3 Å²	33.3	26%	0.258	17%	0.17	S	C	.	.	H	α-helix	trans	-58.7	-40.6	176.9	-45.5	0	0	0	0	112.9	I512 P624 V630	I512-T626 HydrophobicContact CB-CG2 3.97Å; I512-T626 HydrophobicContact CD1-CG2 3.38Å; I512-T626 HydrophobicContact CG1-CG2 4.26Å; I512-T626 HydrophobicContact CG2-CG2 3.61Å; P624-T626 PolarHBondContact O-N 2.91Å; P624-T626 VanDerWaalsContact O-N 3.1Å; T626-V630 WeakPolarHBondContact O-CG2 3.4Å; T626-V630 PolarHBondContact O-N 2.98Å
627	V	91.8	Very high	93.5	Very high	11 Å²	11	33.3 Å²	33.3	7%	0.067	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-43.4	175.9	175.4	0	0	0	0	110	M508 E509 L591 L623 P624 R625 I629 V630 M631	M508-V627 HydrophobicContact CE-CG2 4.19Å; E509-V627 HydrophobicContact CG-CG2 4.2Å; L591-V627 HydrophobicContact CD1-CG1 4.14Å; L591-V627 WeakPolarHBondContact O-CG1 3.29Å; L623-V627 HydrophobicContact CB-CG1 4.47Å; L623-V627 HydrophobicContact CD1-CG1 4.32Å; P624-V627 HydrophobicContact CB-CB 4.48Å; P624-V627 HydrophobicContact CB-CG2 4.12Å; P624-V627 HydrophobicContact CG-CG2 4.17Å; P624-V627 WeakPolarHBondContact O-CA 3.45Å; P624-V627 WeakPolarHBondContact O-CB 3.49Å; P624-V627 PolarHBondContact O-N 2.71Å; R625-V627 VanDerWaalsContact C-N 3.33Å; R625-V627 PolarHBondContact O-N 3.31Å; V627-I629 VanDerWaalsContact C-N 3.33Å; V627-I629 PolarHBondContact O-N 3.27Å; V627-V630 PolarHBondContact O-N 3.02Å; V627-M631 HydrophobicContact CG1-CG 4.25Å; V627-M631 HydrophobicContact CG1-SD 3.81Å; V627-M631 WeakPolarHBondContact O-CB 3.34Å; V627-M631 VanDerWaalsContact O-CG 3.22Å; V627-M631 WeakPolarHBondContact O-CG 3.47Å; V627-M631 PolarHBondContact O-N 3.05Å
628	I	93.5	Very high	93.6	Very high	10 Å²	10	30.5 Å²	30.5	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-41.6	177.5	-58.2	173.7	0	0	0	111.4	V620 L623 P624 R625 M631 R632 F694 P695 L700	V620-I628 HydrophobicContact CG1-CG1 4.35Å; V620-I628 HydrophobicContact CG1-CG2 4.38Å; V620-I628 VanDerWaalsContact O-CD1 3.31Å; V620-I628 WeakPolarHBondContact O-CD1 3.47Å; L623-I628 HydrophobicContact CB-CD1 4.45Å; L623-I628 HydrophobicContact CB-CG1 4Å; L623-I628 WeakPolarHBondContact O-CD1 3.34Å; P624-I628 PolarHBondContact O-N 3.48Å; P624-I628 VanDerWaalsContact O-N 3.1Å; R625-I628 PolarHBondContact O-N 3.46Å; I628-M631 PolarHBondContact O-N 3.01Å; I628-R632 WeakPolarHBondContact O-CB 3.44Å; I628-R632 PolarHBondContact O-N 3.49Å; I628-F694 HydrophobicContact CG2-CD1 4.34Å; I628-P695 HydrophobicContact CG2-CG 3.8Å; I628-L700 HydrophobicContact CB-CD2 4.01Å; I628-L700 HydrophobicContact CG2-CD2 3.69Å
629	I	92.9	Very high	93.8	Very high	18 Å²	18	26.9 Å²	26.9	9%	0.092	14%	0.14	C	C	.	.	H	α-helix	trans	-63.2	-47.7	178	-68.4	161.9	0	0	0	111.1	I519 R625 V627 M631 R632 Y633 L700 D701	I519-I629 HydrophobicContact CD1-CG2 3.88Å; R625-I629 WeakPolarHBondContact O-CG1 3.24Å; R625-I629 PolarHBondContact O-N 2.96Å; V627-I629 VanDerWaalsContact C-N 3.33Å; V627-I629 PolarHBondContact O-N 3.27Å; I629-M631 PolarHBondContact O-N 3.09Å; I629-R632 PolarHBondContact O-N 3.06Å; I629-Y633 PolarHBondContact O-N 3.2Å; I629-L700 HydrophobicContact CD1-CG 4.36Å; I629-L700 HydrophobicContact CG1-CD2 3.86Å; I629-L700 HydrophobicContact CG1-CG 4.06Å; I629-D701 WeakPolarHBondContact CD1-O 3.33Å
630	V	94.1	Very high	93.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-38.4	177.3	175.7	0	0	0	0	111.7	M508 I512 I519 F584 L591 T626 V627 L634	M508-V630 HydrophobicContact CE-CB 4.04Å; M508-V630 HydrophobicContact CE-CG1 4.15Å; M508-V630 HydrophobicContact CE-CG2 3.99Å; M508-V630 HydrophobicContact SD-CB 4.37Å; M508-V630 HydrophobicContact SD-CG1 3.98Å; M508-V630 HydrophobicContact SD-CG2 4.11Å; I512-V630 HydrophobicContact CD1-CG2 4Å; I519-V630 HydrophobicContact CD1-CB 4.44Å; I519-V630 HydrophobicContact CD1-CG2 3.95Å; F584-V630 HydrophobicContact CE1-CG1 3.75Å; F584-V630 HydrophobicContact CZ-CG1 4.02Å; L591-V630 HydrophobicContact CD1-CB 4.4Å; L591-V630 HydrophobicContact CD1-CG1 4.01Å; T626-V630 WeakPolarHBondContact O-CG2 3.4Å; T626-V630 PolarHBondContact O-N 2.98Å; V627-V630 PolarHBondContact O-N 3.02Å; V630-L634 WeakPolarHBondContact O-CB 3.39Å; V630-L634 PolarHBondContact O-N 2.83Å
631	M	95.3	Very high	94.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.7	-47.1	173.5	-69.2	172.9	105	0	0	111.7	L591 F592 L623 V627 I628 I629 Y633 L634 F635 F694	L591-M631 HydrophobicContact CD1-CG 3.96Å; L591-M631 HydrophobicContact CD2-CG 3.82Å; L591-M631 HydrophobicContact CG-CG 3.7Å; F592-M631 HydrophobicContact CD1-CE 3.87Å; F592-M631 HydrophobicContact CD2-CE 3.98Å; F592-M631 HydrophobicContact CE1-CE 3.46Å; F592-M631 VanDerWaalsContact CE1-CE 3.46Å; F592-M631 HydrophobicContact CE2-CE 3.58Å; F592-M631 HydrophobicContact CG-CE 4.12Å; F592-M631 HydrophobicContact CZ-CE 3.29Å; L623-M631 HydrophobicContact CD1-CE 4.09Å; L623-M631 HydrophobicContact CD1-SD 3.64Å; V627-M631 HydrophobicContact CG1-CG 4.25Å; V627-M631 HydrophobicContact CG1-SD 3.81Å; V627-M631 WeakPolarHBondContact O-CB 3.34Å; V627-M631 VanDerWaalsContact O-CG 3.22Å; V627-M631 WeakPolarHBondContact O-CG 3.47Å; V627-M631 PolarHBondContact O-N 3.05Å; I628-M631 PolarHBondContact O-N 3.01Å; I629-M631 PolarHBondContact O-N 3.09Å; M631-Y633 VanDerWaalsContact C-N 3.32Å; M631-Y633 PolarHBondContact O-N 2.67Å; M631-L634 PolarHBondContact O-N 3.34Å; M631-F635 HydrophobicContact CB-CD2 4.27Å; M631-F635 WeakPolarHBondContact O-CB 3.37Å; M631-F635 VanDerWaalsContact O-CD2 3.32Å; M631-F635 WeakPolarHBondContact O-CD2 3.34Å; M631-F635 PolarHBondContact O-N 2.87Å; M631-F694 HydrophobicContact CB-CD1 4.22Å; M631-F694 HydrophobicContact CB-CE1 3.42Å; M631-F694 VanDerWaalsContact CB-CE1 3.42Å; M631-F694 HydrophobicContact CB-CZ 3.78Å; M631-F694 HydrophobicContact CG-CE1 4.39Å; M631-F694 HydrophobicContact SD-CE1 4.25Å
632	R	94.6	Very high	94.3	Very high	18 Å²	18	22.7 Å²	22.7	7%	0.068	12%	0.116	C	C	.	.	H	α-helix	trans	-55.8	-47.3	178.3	-177	174.9	72.9	-168.5	1.3	111.3	I628 I629 A636 F694 P695 N696 L700 G702 P703	I628-R632 WeakPolarHBondContact O-CB 3.44Å; I628-R632 PolarHBondContact O-N 3.49Å; I629-R632 PolarHBondContact O-N 3.06Å; R632-A636 VanDerWaalsContact O-CB 3.26Å; R632-A636 WeakPolarHBondContact O-CB 3.41Å; R632-A636 PolarHBondContact O-N 2.74Å; R632-A636 VanDerWaalsContact O-N 3.12Å; R632-F694 HydrophobicContact CB-CB 3.97Å; R632-F694 HydrophobicContact CB-CD1 4.41Å; R632-F694 HydrophobicContact CB-CG 4.1Å; R632-F694 HydrophobicContact CG-CB 3.92Å; R632-F694 HydrophobicContact CG-CG 4.47Å; R632-P695 WeakPolarHBondContact CD-O 3.22Å; R632-P695 PolarHBondContact NH1-O 3Å; R632-N696 PolarHBondContact NH1-O 2.83Å; R632-L700 PolarHBondContact NH1-O 3.4Å; R632-L700 PolarHBondContact NH2-O 3.26Å; R632-L700 VanDerWaalsContact NH2-O 3.11Å; R632-G702 PolarHBondContact NH2-O 3.33Å; R632-P703 PolarHBondContact NH2-O 3.38Å
633	Y	95.4	Very high	94.5	Very high	7 Å²	7	24.4 Å²	24.4	3%	0.027	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-50.6	177.8	-170.7	-94.9	0	0	0	111.9	I519 V523 V527 I629 M631 F637 P703 Y705	I519-Y633 HydrophobicContact CD1-CD1 4.38Å; I519-Y633 HydrophobicContact CD1-CD2 4.46Å; I519-Y633 HydrophobicContact CD1-CG 3.95Å; I519-Y633 HydrophobicContact CG1-CD2 4.38Å; I519-Y633 HydrophobicContact CG1-CG 4.24Å; I519-Y633 HydrophobicContact CG2-CD1 4.28Å; I519-Y633 HydrophobicContact CG2-CE1 4.4Å; V523-Y633 HydrophobicContact CG1-CD1 4.31Å; V527-Y633 HydrophobicContact CB-CE1 3.9Å; V527-Y633 HydrophobicContact CG1-CE1 3.71Å; V527-Y633 HydrophobicContact CG2-CE1 4.09Å; I629-Y633 PolarHBondContact O-N 3.2Å; M631-Y633 VanDerWaalsContact C-N 3.32Å; M631-Y633 PolarHBondContact O-N 2.67Å; Y633-F637 PolarHBondContact O-N 3.19Å; Y633-F637 VanDerWaalsContact O-N 3.16Å; Y633-P703 HydrophobicContact CD2-CB 4.42Å; Y633-Y705 HydrophobicContact CE2-CD2 4.33Å
634	L	96.6	Very high	94.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.8	-45.8	-179.4	179.6	65	0	0	0	112.8	F584 L591 V630 M631 F637 L638 F659 L663	F584-L634 HydrophobicContact CD2-CD2 4.24Å; F584-L634 HydrophobicContact CE1-CD2 4.36Å; F584-L634 HydrophobicContact CE2-CD1 3.92Å; F584-L634 HydrophobicContact CE2-CD2 3.76Å; F584-L634 HydrophobicContact CE2-CG 4.4Å; F584-L634 HydrophobicContact CZ-CD1 4.38Å; F584-L634 HydrophobicContact CZ-CD2 3.84Å; L591-L634 HydrophobicContact CD2-CD2 3.89Å; V630-L634 WeakPolarHBondContact O-CB 3.39Å; V630-L634 PolarHBondContact O-N 2.83Å; M631-L634 PolarHBondContact O-N 3.34Å; L634-F637 HydrophobicContact CD1-CD1 4.43Å; L634-F637 PolarHBondContact O-N 3.05Å; L634-L638 HydrophobicContact CD1-CD1 4.26Å; L634-L638 HydrophobicContact CD1-CG 4.32Å; L634-L638 HydrophobicContact CG-CD1 4.08Å; L634-L638 HydrophobicContact CG-CG 4.47Å; L634-L638 WeakPolarHBondContact O-CG 3.39Å; L634-L638 PolarHBondContact O-N 3.28Å; L634-F659 HydrophobicContact CD1-CE1 4.43Å; L634-L663 HydrophobicContact CD2-CD1 3.84Å; L634-L663 HydrophobicContact CD2-CD2 3.9Å
635	F	97.2	Very high	94.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-76	-28.8	-175.5	-79.6	-73.5	0	0	0	113.3	F592 M631 L638 N639 L663 I683 I686 I687 H690 F694	F592-F635 AromaticContact CE2-CE2 3.95Å; F592-F635 HydrophobicContact CE2-CE2 3.95Å; F592-F635 AromaticContact CE2-CZ 3.93Å; F592-F635 HydrophobicContact CE2-CZ 3.93Å; F592-F635 AromaticContact CZ-CE2 3.84Å; F592-F635 HydrophobicContact CZ-CE2 3.84Å; F592-F635 AromaticContact CZ-CZ 3.81Å; F592-F635 HydrophobicContact CZ-CZ 3.81Å; M631-F635 HydrophobicContact CB-CD2 4.27Å; M631-F635 WeakPolarHBondContact O-CB 3.37Å; M631-F635 VanDerWaalsContact O-CD2 3.32Å; M631-F635 WeakPolarHBondContact O-CD2 3.34Å; M631-F635 PolarHBondContact O-N 2.87Å; F635-L638 HydrophobicContact CD1-CD1 4.35Å; F635-L638 HydrophobicContact CE1-CD1 4.43Å; F635-L638 PolarHBondContact O-N 3.42Å; F635-N639 WeakPolarHBondContact O-CB 3.47Å; F635-N639 PolarHBondContact O-N 2.9Å; F635-L663 HydrophobicContact CE1-CD1 4.47Å; F635-L663 HydrophobicContact CE2-CD1 4.21Å; F635-L663 HydrophobicContact CZ-CD1 3.72Å; F635-I683 HydrophobicContact CE1-CG2 4.15Å; F635-I683 HydrophobicContact CZ-CD1 4.01Å; F635-I686 HydrophobicContact CB-CG2 4.26Å; F635-I686 HydrophobicContact CD1-CB 4.22Å; F635-I686 HydrophobicContact CD1-CG2 3.52Å; F635-I686 HydrophobicContact CD2-CG2 3.72Å; F635-I686 HydrophobicContact CE1-CB 4.03Å; F635-I686 HydrophobicContact CE1-CG2 3.64Å; F635-I686 HydrophobicContact CE2-CG2 3.86Å; F635-I686 HydrophobicContact CG-CG2 3.56Å; F635-I686 HydrophobicContact CZ-CB 4.36Å; F635-I686 HydrophobicContact CZ-CG2 3.82Å; F635-I687 HydrophobicContact CD1-CG1 3.7Å; F635-I687 HydrophobicContact CE1-CG1 3.85Å; F635-H690 HydrophobicContact CB-CB 4.19Å; F635-F694 HydrophobicContact CB-CD2 4.44Å; F635-F694 HydrophobicContact CB-CE2 3.64Å; F635-F694 HydrophobicContact CB-CZ 4.31Å; F635-F694 AromaticContact CD2-CE2 3.85Å; F635-F694 HydrophobicContact CD2-CE2 3.85Å; F635-F694 AromaticContact CD2-CZ 3.62Å; F635-F694 HydrophobicContact CD2-CZ 3.62Å; F635-F694 HydrophobicContact CE2-CZ 4.3Å; F635-F694 AromaticContact CG-CE2 3.96Å; F635-F694 HydrophobicContact CG-CE2 3.96Å; F635-F694 HydrophobicContact CG-CZ 4.2Å
636	A	95.9	Very high	95	Very high	13 Å²	13	25.2 Å²	25.2	11%	0.107	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-40.7	168.3	0	0	0	0	0	111.8	R632 N639 H640 Y705	R632-A636 VanDerWaalsContact O-CB 3.26Å; R632-A636 WeakPolarHBondContact O-CB 3.41Å; R632-A636 PolarHBondContact O-N 2.74Å; R632-A636 VanDerWaalsContact O-N 3.12Å; A636-N639 PolarHBondContact O-N 3.42Å; A636-H640 PolarHBondContact O-N 3.14Å; A636-Y705 HydrophobicContact CB-CD1 4Å; A636-Y705 HydrophobicContact CB-CG 4.46Å
637	F	97	Very high	95	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-47.4	171.3	162.9	-107.4	0	0	0	112.4	V527 I530 F541 L580 Y633 L634 N639 H640 L641 Y705	V527-F637 HydrophobicContact CB-CG 4.49Å; V527-F637 HydrophobicContact CG1-CB 3.97Å; V527-F637 HydrophobicContact CG1-CD1 4.37Å; V527-F637 HydrophobicContact CG1-CD2 3.71Å; V527-F637 HydrophobicContact CG1-CE2 4.3Å; V527-F637 HydrophobicContact CG1-CG 3.73Å; V527-F637 HydrophobicContact CG2-CD1 3.86Å; V527-F637 HydrophobicContact CG2-CE1 4.18Å; V527-F637 HydrophobicContact CG2-CG 4.07Å; I530-F637 HydrophobicContact CB-CE2 4.35Å; I530-F637 HydrophobicContact CB-CZ 3.99Å; I530-F637 HydrophobicContact CG2-CE2 4.16Å; I530-F637 HydrophobicContact CG2-CZ 3.67Å; F541-F637 AromaticContact CE2-CE1 3.97Å; F541-F637 HydrophobicContact CE2-CE1 3.97Å; F541-F637 HydrophobicContact CE2-CZ 4.1Å; F541-F637 AromaticContact CZ-CE1 3.89Å; F541-F637 HydrophobicContact CZ-CE1 3.89Å; F541-F637 HydrophobicContact CZ-CZ 4.16Å; L580-F637 HydrophobicContact CD2-CE1 4.3Å; Y633-F637 PolarHBondContact O-N 3.19Å; Y633-F637 VanDerWaalsContact O-N 3.16Å; L634-F637 HydrophobicContact CD1-CD1 4.43Å; L634-F637 PolarHBondContact O-N 3.05Å; F637-N639 VanDerWaalsContact C-N 3.3Å; F637-N639 PolarHBondContact O-N 3.03Å; F637-H640 PolarHBondContact O-N 2.94Å; F637-L641 HydrophobicContact CE1-CD2 4.47Å; F637-L641 HydrophobicContact CZ-CD2 4.18Å; F637-L641 WeakPolarHBondContact O-CB 3.46Å; F637-L641 PolarHBondContact O-N 3.01Å; F637-Y705 HydrophobicContact CB-CD1 4.11Å; F637-Y705 HydrophobicContact CB-CD2 3.89Å; F637-Y705 HydrophobicContact CB-CE1 4.12Å; F637-Y705 HydrophobicContact CB-CE2 3.9Å; F637-Y705 HydrophobicContact CB-CG 3.98Å; F637-Y705 AromaticContact CD2-CE2 3.83Å; F637-Y705 HydrophobicContact CD2-CE2 3.83Å; F637-Y705 AromaticContact CD2-CZ 3.83Å; F637-Y705 HydrophobicContact CG-CE2 4.31Å
638	L	97.3	Very high	95.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.7	-32.3	178.5	-67.9	177.3	0	0	0	112.6	F541 L634 F635 L641 S642 L655 F659 I687	F541-L638 HydrophobicContact CE2-CD2 4.44Å; L634-L638 HydrophobicContact CD1-CD1 4.26Å; L634-L638 HydrophobicContact CD1-CG 4.32Å; L634-L638 HydrophobicContact CG-CD1 4.08Å; L634-L638 HydrophobicContact CG-CG 4.47Å; L634-L638 WeakPolarHBondContact O-CG 3.39Å; L634-L638 PolarHBondContact O-N 3.28Å; F635-L638 HydrophobicContact CD1-CD1 4.35Å; F635-L638 HydrophobicContact CE1-CD1 4.43Å; F635-L638 PolarHBondContact O-N 3.42Å; L638-L641 HydrophobicContact CD2-CD2 4.42Å; L638-S642 WeakPolarHBondContact O-CB 3.32Å; L638-S642 PolarHBondContact O-N 3.24Å; L638-S642 VanDerWaalsContact O-N 3.16Å; L638-L655 HydrophobicContact CD2-CD2 4.43Å; L638-L655 WeakPolarHBondContact O-CD1 3.5Å; L638-F659 HydrophobicContact CD1-CD1 4.25Å; L638-F659 HydrophobicContact CD1-CD2 3.93Å; L638-F659 HydrophobicContact CD1-CE1 4.45Å; L638-F659 HydrophobicContact CD1-CE2 4.15Å; L638-F659 HydrophobicContact CD1-CG 3.98Å; L638-F659 HydrophobicContact CD1-CZ 4.4Å; L638-F659 HydrophobicContact CD2-CD2 3.91Å; L638-F659 HydrophobicContact CD2-CE2 3.44Å; L638-F659 VanDerWaalsContact CD2-CE2 3.44Å; L638-F659 HydrophobicContact CD2-CZ 3.89Å; L638-F659 HydrophobicContact CG-CE2 4.45Å; L638-I687 HydrophobicContact CB-CG1 4.19Å
639	N	97.1	Very high	95.3	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.102	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-53.3	169.2	-175.3	-76.7	0	0	0	110.5	F635 A636 F637 L641 S642 Q643 I687 H690	F635-N639 WeakPolarHBondContact O-CB 3.47Å; F635-N639 PolarHBondContact O-N 2.9Å; A636-N639 PolarHBondContact O-N 3.42Å; F637-N639 VanDerWaalsContact C-N 3.3Å; F637-N639 PolarHBondContact O-N 3.03Å; N639-L641 VanDerWaalsContact C-N 3.32Å; N639-L641 PolarHBondContact O-N 3.47Å; N639-S642 WeakPolarHBondContact O-CA 3.2Å; N639-S642 WeakPolarHBondContact O-CB 3.41Å; N639-S642 PolarHBondContact O-N 3.42Å; N639-S642 PolarHBondContact O-OG 3.33Å; N639-Q643 WeakPolarHBondContact O-CG 3.42Å; N639-Q643 PolarHBondContact O-N 3.44Å; N639-Q643 PolarHBondContact OD1-NE2 3.33Å; N639-I687 WeakPolarHBondContact CB-O 3.2Å; N639-I687 PolarHBondContact ND2-O 3.27Å; N639-H690 WeakPolarHBondContact CB-CD2 3.25Å; N639-H690 WeakPolarHBondContact CB-NE2 3.13Å; N639-H690 VanDerWaalsContact CG-CD2 3.41Å; N639-H690 VanDerWaalsContact CG-NE2 3.33Å; N639-H690 PolarHBondContact ND2-CD2 2.87Å
640	H	96.6	Very high	95.4	Very high	11 Å²	11	29.8 Å²	29.8	5%	0.051	15%	0.149	C	C	.	.	H	α-helix	trans	-56.2	-45.7	-179.7	-175.6	-142.1	0	0	0	112.4	N531 A636 F637 S642 Q643 Y644 Y705 K707	N531-H640 PolarHBondContact OD1-ND1 3Å; A636-H640 PolarHBondContact O-N 3.14Å; F637-H640 PolarHBondContact O-N 2.94Å; H640-S642 VanDerWaalsContact C-N 3.25Å; H640-S642 PolarHBondContact O-N 3.03Å; H640-Q643 VanDerWaalsContact O-CB 3.27Å; H640-Q643 WeakPolarHBondContact O-CB 3.44Å; H640-Q643 PolarHBondContact O-N 2.96Å; H640-Y644 AromaticContact NE2-CE2 3.62Å; H640-Y705 HydrophobicContact CB-CE1 3.72Å; H640-Y705 AromaticContact ND1-CE1 3.92Å; H640-Y705 AromaticContact ND1-CZ 3.81Å; H640-Y705 PolarHBondContact ND1-OH 3.39Å; H640-K707 HydrophobicContact CB-CD 4.49Å; H640-K707 HydrophobicContact CB-CG 4.3Å; H640-K707 VanDerWaalsContact CD2-CD 3.44Å; H640-K707 WeakPolarHBondContact CD2-CD 3.41Å
641	L	95.9	Very high	95.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58	-37.4	175.6	-175.4	66.3	0	0	0	112.7	L535 I540 F541 F637 L638 N639 Q643 Y644 N648 L655	L535-L641 HydrophobicContact CD2-CD1 3.83Å; I540-L641 HydrophobicContact CG2-CD1 4.14Å; I540-L641 HydrophobicContact CG2-CD2 4.15Å; I540-L641 HydrophobicContact CG2-CG 4.44Å; F541-L641 HydrophobicContact CD2-CD2 3.78Å; F541-L641 HydrophobicContact CE2-CD2 3.51Å; F637-L641 HydrophobicContact CE1-CD2 4.47Å; F637-L641 HydrophobicContact CZ-CD2 4.18Å; F637-L641 WeakPolarHBondContact O-CB 3.46Å; F637-L641 PolarHBondContact O-N 3.01Å; L638-L641 HydrophobicContact CD2-CD2 4.42Å; N639-L641 VanDerWaalsContact C-N 3.32Å; N639-L641 PolarHBondContact O-N 3.47Å; L641-Q643 PolarHBondContact O-N 2.92Å; L641-Y644 PolarHBondContact O-N 3Å; L641-N648 PolarHBondContact O-ND2 2.97Å; L641-L655 HydrophobicContact CD2-CD1 4.47Å; L641-L655 HydrophobicContact CD2-CD2 3.87Å
642	S	96.7	Very high	95.6	Very high	12 Å²	12	34 Å²	34	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-69.8	-17	176.3	80.3	0	0	0	0	113.8	L638 N639 H640 Y644 S645	L638-S642 WeakPolarHBondContact O-CB 3.32Å; L638-S642 PolarHBondContact O-N 3.24Å; L638-S642 VanDerWaalsContact O-N 3.16Å; N639-S642 WeakPolarHBondContact O-CA 3.2Å; N639-S642 WeakPolarHBondContact O-CB 3.41Å; N639-S642 PolarHBondContact O-N 3.42Å; N639-S642 PolarHBondContact O-OG 3.33Å; H640-S642 VanDerWaalsContact C-N 3.25Å; H640-S642 PolarHBondContact O-N 3.03Å; S642-Y644 PolarHBondContact O-N 3Å; S642-S645 WeakPolarHBondContact O-CB 3.46Å; S642-S645 PolarHBondContact O-N 3.27Å; S642-S645 PolarHBondContact O-OG 3.12Å
643	Q	95.3	Very high	95.6	Very high	111 Å²	111	38.5 Å²	38.5	52%	0.519	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-12.7	174.2	-49.7	-170.5	-11.5	0	0	112.1	N639 H640 L641 K707	N639-Q643 WeakPolarHBondContact O-CG 3.42Å; N639-Q643 PolarHBondContact O-N 3.44Å; N639-Q643 PolarHBondContact OD1-NE2 3.33Å; H640-Q643 VanDerWaalsContact O-CB 3.27Å; H640-Q643 WeakPolarHBondContact O-CB 3.44Å; H640-Q643 PolarHBondContact O-N 2.96Å; L641-Q643 PolarHBondContact O-N 2.92Å; Q643-K707 VanDerWaalsContact CD-NZ 3.31Å
644	Y	95.3	Very high	95.7	Very high	79 Å²	79	40 Å²	40	31%	0.31	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	18.9	173.7	-66	-96	0	0	0	112.9	L535 Q536 H640 L641 S642 D646 E647 N648	L535-Y644 HydrophobicContact CB-CD1 4.41Å; L535-Y644 HydrophobicContact CB-CD2 4.18Å; L535-Y644 HydrophobicContact CB-CE2 4.32Å; L535-Y644 HydrophobicContact CB-CG 4.23Å; L535-Y644 HydrophobicContact CD1-CD2 4.45Å; L535-Y644 HydrophobicContact CD1-CE2 3.84Å; L535-Y644 HydrophobicContact CD2-CD2 4.3Å; L535-Y644 HydrophobicContact CD2-CE2 4.34Å; L535-Y644 HydrophobicContact CG-CE2 4.4Å; L535-Y644 WeakPolarHBondContact O-CB 3.42Å; Q536-Y644 HydrophobicContact CG-CD1 4.35Å; H640-Y644 AromaticContact NE2-CE2 3.62Å; L641-Y644 PolarHBondContact O-N 3Å; S642-Y644 PolarHBondContact O-N 3Å; Y644-D646 PolarHBondContact O-N 3.45Å; Y644-E647 PolarHBondContact O-N 3.44Å; Y644-N648 WeakPolarHBondContact CB-ND2 3.43Å; Y644-N648 PolarHBondContact O-N 3.37Å; Y644-N648 PolarHBondContact O-OD1 3.32Å
645	S	94.9	Very high	95.7	Very high	34 Å²	34	40 Å²	40	24%	0.238	20%	0.2	C	C	.	.	H	α-helix	trans	-53.3	-31.6	-175.8	58.1	0	0	0	0	114.6	S642 E647 N648 M649	S642-S645 WeakPolarHBondContact O-CB 3.46Å; S642-S645 PolarHBondContact O-N 3.27Å; S642-S645 PolarHBondContact O-OG 3.12Å; S645-E647 VanDerWaalsContact C-N 3.25Å; S645-E647 PolarHBondContact O-N 2.95Å; S645-N648 WeakPolarHBondContact CA-OD1 3.5Å; S645-M649 WeakPolarHBondContact O-CA 3.41Å; S645-M649 PolarHBondContact O-N 3.19Å
646	D	91.3	Very high	95.7	Very high	144 Å²	144	40 Å²	40	77%	0.77	20%	0.2	S	C	*	.	H	α-helix	trans	-71	-21.7	-178.2	-66.9	1.5	0	0	0	112.6	Y644 M649	Y644-D646 PolarHBondContact O-N 3.45Å; D646-M649 WeakPolarHBondContact O-CE 3.43Å
647	E	91.2	Very high	95.6	Very high	80 Å²	80	42.8 Å²	42.8	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-102.4	-51.7	175	-62.1	-162.1	-109.7	0	0	111.5	Q536 Y644 S645 M649	Q536-E647 HydrophobicContact CG-CB 4.47Å; Q536-E647 VanDerWaalsContact NE2-CD 3.29Å; Q536-E647 PolarHBondContact NE2-OE1 2.88Å; Q536-E647 PolarHBondContact NE2-OE2 2.87Å; Q536-E647 VanDerWaalsContact NE2-OE2 3.08Å; Y644-E647 PolarHBondContact O-N 3.44Å; S645-E647 VanDerWaalsContact C-N 3.25Å; S645-E647 PolarHBondContact O-N 2.95Å; E647-M649 PolarHBondContact O-N 2.97Å
648	N	94.6	Very high	95.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-82.9	-9.5	-173.8	72	25.6	0	0	0	114	L535 Q537 Q538 G539 I540 L641 Y644 S645 M650	L535-N648 WeakPolarHBondContact O-CB 3.26Å; L535-N648 PolarHBondContact O-ND2 3.05Å; Q537-N648 WeakPolarHBondContact O-CB 3.49Å; Q538-N648 WeakPolarHBondContact CA-O 3.39Å; G539-N648 PolarHBondContact N-O 3.12Å; I540-N648 HydrophobicContact CG2-CB 4.39Å; L641-N648 PolarHBondContact O-ND2 2.97Å; Y644-N648 WeakPolarHBondContact CB-ND2 3.43Å; Y644-N648 PolarHBondContact O-N 3.37Å; Y644-N648 PolarHBondContact O-OD1 3.32Å; S645-N648 WeakPolarHBondContact CA-OD1 3.5Å; N648-M650 PolarHBondContact O-N 2.83Å; N648-M650 WeakPolarHBondContact OD1-CA 3.29Å; N648-M650 WeakPolarHBondContact OD1-CB 3.22Å; N648-M650 PolarHBondContact OD1-N 3.17Å
649	M	95.4	Very high	95.6	Very high	96 Å²	96	43.8 Å²	43.8	47%	0.473	22%	0.218	S	C	.	.			trans	62.2	16.4	-178.6	-53	-76.2	151.3	0	0	114.8	Q538 S645 D646 E647 N654	Q538-M649 HydrophobicContact CG-CB 4.35Å; Q538-M649 HydrophobicContact CG-CG 3.8Å; S645-M649 WeakPolarHBondContact O-CA 3.41Å; S645-M649 PolarHBondContact O-N 3.19Å; D646-M649 WeakPolarHBondContact O-CE 3.43Å; E647-M649 PolarHBondContact O-N 2.97Å; M649-N654 PolarHBondContact O-ND2 3.29Å
650	M	96.4	Very high	95.4	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.214	C	C	.	.			trans	-114.2	74.1	-175.5	-64.9	-59	-61.2	0	0	111.2	I540 R542 N648 N654 L655	I540-M650 HydrophobicContact CG2-CB 4.4Å; I540-M650 HydrophobicContact CG2-CG 3.93Å; I540-M650 WeakPolarHBondContact O-CE 3.33Å; I540-M650 WeakPolarHBondContact O-CG 3.37Å; R542-M650 HydrophobicContact CB-CE 4Å; R542-M650 HydrophobicContact CB-SD 3.76Å; N648-M650 PolarHBondContact O-N 2.83Å; N648-M650 WeakPolarHBondContact OD1-CA 3.29Å; N648-M650 WeakPolarHBondContact OD1-CB 3.22Å; N648-M650 PolarHBondContact OD1-N 3.17Å; M650-N654 HydrophobicContact CE-CB 3.74Å; M650-N654 WeakPolarHBondContact CE-O 3.45Å; M650-N654 HydrophobicContact SD-CB 3.92Å; M650-L655 HydrophobicContact CB-CD2 3.96Å; M650-L655 HydrophobicContact CB-CG 4.08Å; M650-L655 HydrophobicContact CE-CD2 3.83Å; M650-L655 HydrophobicContact CE-CG 4.25Å
651	D	95.8	Very high	95.1	Very high	60 Å²	60	45.2 Å²	45.2	32%	0.321	23%	0.23	S	C	.	.			trans	-63.8	169.1	169	79	-24	0	0	0	112.1	Y653 N654 L655	D651-Y653 PolarHBondContact O-N 3.39Å; D651-Y653 PolarHBondContact OD1-N 3.32Å; D651-N654 PolarHBondContact O-N 3.26Å; D651-N654 VanDerWaalsContact O-N 3.16Å; D651-N654 WeakPolarHBondContact OD1-CB 3.42Å; D651-N654 PolarHBondContact OD1-N 3.19Å; D651-N654 PolarHBondContact OD1-ND2 3.36Å; D651-L655 PolarHBondContact O-N 3.09Å
652	P	96.9	Very high	95	Very high	29 Å²	29	45.9 Å²	45.9	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-25.9	-179.4	-27.2	36	0	0	0	114.2	A656 I687 I688	P652-A656 WeakPolarHBondContact O-CB 3.27Å; P652-A656 PolarHBondContact O-N 2.98Å; P652-I687 HydrophobicContact CB-CB 4.42Å; P652-I687 HydrophobicContact CB-CG2 3.94Å; P652-I687 HydrophobicContact CG-CG2 4.36Å; P652-I688 HydrophobicContact CB-CD1 4.21Å; P652-I688 HydrophobicContact CB-CG1 3.85Å; P652-I688 HydrophobicContact CG-CG1 4.04Å
653	Y	95.9	Very high	94.9	Very high	113 Å²	113	45.3 Å²	45.3	44%	0.443	23%	0.23	S	C	.	.	H	α-helix	trans	-75.5	-47.6	176.7	-179.2	-108.8	0	0	0	112.2	D651 L655 A656 I657 K684	D651-Y653 PolarHBondContact O-N 3.39Å; D651-Y653 PolarHBondContact OD1-N 3.32Å; Y653-L655 VanDerWaalsContact C-N 3.33Å; Y653-L655 PolarHBondContact O-N 3.49Å; Y653-A656 PolarHBondContact O-N 3.32Å; Y653-I657 HydrophobicContact CD1-CD1 3.92Å; Y653-I657 HydrophobicContact CE1-CD1 3.54Å; Y653-I657 HydrophobicContact CE2-CD1 4.49Å; Y653-I657 WeakPolarHBondContact O-CG1 3.21Å; Y653-I657 PolarHBondContact O-N 3.2Å; Y653-K684 HydrophobicContact CD2-CD 3.97Å
654	N	96.6	Very high	94.7	Very high	39 Å²	39	40.1 Å²	40.1	21%	0.209	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-38.7	174.9	-73.7	-23.8	0	0	0	111.6	M649 M650 D651 I657 C658	M649-N654 PolarHBondContact O-ND2 3.29Å; M650-N654 HydrophobicContact CE-CB 3.74Å; M650-N654 WeakPolarHBondContact CE-O 3.45Å; M650-N654 HydrophobicContact SD-CB 3.92Å; D651-N654 PolarHBondContact O-N 3.26Å; D651-N654 VanDerWaalsContact O-N 3.16Å; D651-N654 WeakPolarHBondContact OD1-CB 3.42Å; D651-N654 PolarHBondContact OD1-N 3.19Å; D651-N654 PolarHBondContact OD1-ND2 3.36Å; N654-I657 PolarHBondContact O-N 3.4Å; N654-C658 PolarHBondContact O-N 2.86Å; N654-C658 PolarHBondContact O-SG 2.77Å
655	L	97.3	Very high	94.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-43.4	172.7	-70.4	172.6	0	0	0	111.5	F541 L638 L641 M650 D651 Y653 I657 C658 F659 I687	F541-L655 HydrophobicContact CD2-CD2 4.21Å; L638-L655 HydrophobicContact CD2-CD2 4.43Å; L638-L655 WeakPolarHBondContact O-CD1 3.5Å; L641-L655 HydrophobicContact CD2-CD1 4.47Å; L641-L655 HydrophobicContact CD2-CD2 3.87Å; M650-L655 HydrophobicContact CB-CD2 3.96Å; M650-L655 HydrophobicContact CB-CG 4.08Å; M650-L655 HydrophobicContact CE-CD2 3.83Å; M650-L655 HydrophobicContact CE-CG 4.25Å; D651-L655 PolarHBondContact O-N 3.09Å; Y653-L655 VanDerWaalsContact C-N 3.33Å; Y653-L655 PolarHBondContact O-N 3.49Å; L655-I657 VanDerWaalsContact C-N 3.33Å; L655-I657 PolarHBondContact O-N 3.08Å; L655-C658 PolarHBondContact O-N 2.75Å; L655-F659 PolarHBondContact O-N 3.47Å; L655-I687 HydrophobicContact CB-CD1 3.92Å
656	A	96.2	Very high	94.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-33.5	176.8	0	0	0	0	0	113.5	P652 Y653 C658 G660 N680 I683 K684 I687	P652-A656 WeakPolarHBondContact O-CB 3.27Å; P652-A656 PolarHBondContact O-N 2.98Å; Y653-A656 PolarHBondContact O-N 3.32Å; A656-C658 VanDerWaalsContact C-N 3.28Å; A656-C658 PolarHBondContact O-N 2.9Å; A656-G660 WeakPolarHBondContact O-CA 3.49Å; A656-G660 PolarHBondContact O-N 2.86Å; A656-N680 VanDerWaalsContact CB-O 3.31Å; A656-N680 WeakPolarHBondContact CB-O 3.43Å; A656-I683 HydrophobicContact CB-CB 4.11Å; A656-I683 HydrophobicContact CB-CG2 3.86Å; A656-K684 HydrophobicContact CB-CB 3.82Å; A656-I687 HydrophobicContact CB-CD1 4.36Å
657	I	94.9	Very high	93.8	Very high	70 Å²	70	33.1 Å²	33.1	36%	0.359	18%	0.175	S	C	.	.	H	α-helix	trans	-61.6	-37.1	170.3	-71.5	164.8	0	0	0	111.4	Y653 N654 L655 P661	Y653-I657 HydrophobicContact CD1-CD1 3.92Å; Y653-I657 HydrophobicContact CE1-CD1 3.54Å; Y653-I657 HydrophobicContact CE2-CD1 4.49Å; Y653-I657 WeakPolarHBondContact O-CG1 3.21Å; Y653-I657 PolarHBondContact O-N 3.2Å; N654-I657 PolarHBondContact O-N 3.4Å; L655-I657 VanDerWaalsContact C-N 3.33Å; L655-I657 PolarHBondContact O-N 3.08Å; I657-P661 VanDerWaalsContact O-CD 3.3Å; I657-P661 WeakPolarHBondContact O-CD 3.4Å
658	C	95.9	Very high	93.2	Very high	21 Å²	21	36.8 Å²	36.8	14%	0.142	20%	0.197	C	C	.	.	H	α-helix	trans	-80.9	-36.6	-178.1	-61.7	0	0	0	0	113.1	F541 N654 L655 A656 T662	F541-C658 HydrophobicContact CB-CB 4.2Å; N654-C658 PolarHBondContact O-N 2.86Å; N654-C658 PolarHBondContact O-SG 2.77Å; L655-C658 PolarHBondContact O-N 2.75Å; A656-C658 VanDerWaalsContact C-N 3.28Å; A656-C658 PolarHBondContact O-N 2.9Å; C658-T662 PolarHBondContact O-OG1 2.78Å
659	F	96.7	Very high	92.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-93.6	-23.2	-178	-83.4	-84.7	0	0	0	114.4	F541 K581 L634 L638 L655 T662 L663 I683	F541-F659 HydrophobicContact CB-CE2 4.11Å; F541-F659 AromaticContact CD1-CE2 3.66Å; F541-F659 HydrophobicContact CD1-CE2 3.66Å; F541-F659 AromaticContact CD1-CZ 3.61Å; F541-F659 HydrophobicContact CD1-CZ 3.61Å; F541-F659 AromaticContact CD2-CE2 3.83Å; F541-F659 HydrophobicContact CD2-CE2 3.83Å; F541-F659 HydrophobicContact CD2-CZ 4.36Å; F541-F659 AromaticContact CE1-CE2 3.99Å; F541-F659 HydrophobicContact CE1-CE2 3.99Å; F541-F659 AromaticContact CE1-CZ 3.56Å; F541-F659 HydrophobicContact CE1-CZ 3.56Å; F541-F659 HydrophobicContact CE2-CE2 4.14Å; F541-F659 HydrophobicContact CE2-CZ 4.32Å; F541-F659 AromaticContact CG-CE2 3.58Å; F541-F659 HydrophobicContact CG-CE2 3.58Å; F541-F659 HydrophobicContact CG-CZ 4.03Å; F541-F659 HydrophobicContact CZ-CE2 4.22Å; F541-F659 AromaticContact CZ-CZ 3.94Å; F541-F659 HydrophobicContact CZ-CZ 3.94Å; K581-F659 HydrophobicContact CG-CE1 4.09Å; K581-F659 HydrophobicContact CG-CZ 4.07Å; L634-F659 HydrophobicContact CD1-CE1 4.43Å; L638-F659 HydrophobicContact CD1-CD1 4.25Å; L638-F659 HydrophobicContact CD1-CD2 3.93Å; L638-F659 HydrophobicContact CD1-CE1 4.45Å; L638-F659 HydrophobicContact CD1-CE2 4.15Å; L638-F659 HydrophobicContact CD1-CG 3.98Å; L638-F659 HydrophobicContact CD1-CZ 4.4Å; L638-F659 HydrophobicContact CD2-CD2 3.91Å; L638-F659 HydrophobicContact CD2-CE2 3.44Å; L638-F659 VanDerWaalsContact CD2-CE2 3.44Å; L638-F659 HydrophobicContact CD2-CZ 3.89Å; L638-F659 HydrophobicContact CG-CE2 4.45Å; L655-F659 PolarHBondContact O-N 3.47Å; F659-T662 HydrophobicContact CD1-CG2 4.37Å; F659-T662 CarbonylContact O-C 3.54Å; F659-T662 WeakPolarHBondContact O-CA 3.49Å; F659-T662 WeakPolarHBondContact O-CB 3.41Å; F659-T662 PolarHBondContact O-N 3.44Å; F659-L663 HydrophobicContact CB-CD1 4.04Å; F659-L663 HydrophobicContact CB-CG 4.23Å; F659-L663 HydrophobicContact CD1-CD1 3.99Å; F659-L663 HydrophobicContact CD1-CD2 4.1Å; F659-L663 HydrophobicContact CD1-CG 3.96Å; F659-L663 HydrophobicContact CG-CD1 4.43Å; F659-L663 WeakPolarHBondContact O-CG 3.34Å; F659-L663 PolarHBondContact O-N 3.4Å; F659-I683 HydrophobicContact CB-CG2 4.44Å
660	G	93.7	Very high	91.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-53.9	-59	179.3	0	0	0	0	0	114.1	A656 T662 M664	A656-G660 WeakPolarHBondContact O-CA 3.49Å; A656-G660 PolarHBondContact O-N 2.86Å; G660-T662 PolarHBondContact O-N 3.26Å; G660-T662 VanDerWaalsContact O-N 3.14Å; G660-M664 PolarHBondContact O-N 3.04Å
661	P	90.8	Very high	91.2	Very high	61 Å²	61	43.5 Å²	43.5	40%	0.396	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-16.9	174.6	-17.2	28.3	0	0	0	114.4	I657	I657-P661 VanDerWaalsContact O-CD 3.3Å; I657-P661 WeakPolarHBondContact O-CD 3.4Å
662	T	93.1	Very high	90.6	Very high	14 Å²	14	44.5 Å²	44.5	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-90	-39.8	-174.4	-61.5	0	0	0	0	111.8	K581 F584 R585 C658 F659 G660	K581-T662 HydrophobicContact CB-CG2 4.02Å; K581-T662 HydrophobicContact CG-CG2 4.29Å; K581-T662 WeakPolarHBondContact O-CG2 3.37Å; F584-T662 HydrophobicContact CB-CG2 4.1Å; R585-T662 HydrophobicContact CB-CG2 4.22Å; C658-T662 PolarHBondContact O-OG1 2.78Å; F659-T662 HydrophobicContact CD1-CG2 4.37Å; F659-T662 CarbonylContact O-C 3.54Å; F659-T662 WeakPolarHBondContact O-CA 3.49Å; F659-T662 WeakPolarHBondContact O-CB 3.41Å; F659-T662 PolarHBondContact O-N 3.44Å; G660-T662 PolarHBondContact O-N 3.26Å; G660-T662 VanDerWaalsContact O-N 3.14Å
663	L	94.6	Very high	89.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-98.3	-31.3	-175.3	-56.1	-177.6	0	0	0	113.1	F584 L591 F592 L634 F635 F659 I683	F584-L663 HydrophobicContact CB-CD2 3.61Å; F584-L663 HydrophobicContact CD1-CD2 4.16Å; F584-L663 HydrophobicContact CD2-CD2 4.12Å; F584-L663 HydrophobicContact CG-CD2 3.71Å; L591-L663 HydrophobicContact CB-CD2 4.45Å; L591-L663 HydrophobicContact CD2-CD1 4.44Å; L591-L663 HydrophobicContact CD2-CD2 3.96Å; F592-L663 HydrophobicContact CD2-CB 3.78Å; F592-L663 HydrophobicContact CE2-CB 3.86Å; F592-L663 HydrophobicContact CE2-CD1 4.21Å; F592-L663 PolarHBondContact N-O 3.25Å; L634-L663 HydrophobicContact CD2-CD1 3.84Å; L634-L663 HydrophobicContact CD2-CD2 3.9Å; F635-L663 HydrophobicContact CE1-CD1 4.47Å; F635-L663 HydrophobicContact CE2-CD1 4.21Å; F635-L663 HydrophobicContact CZ-CD1 3.72Å; F659-L663 HydrophobicContact CB-CD1 4.04Å; F659-L663 HydrophobicContact CB-CG 4.23Å; F659-L663 HydrophobicContact CD1-CD1 3.99Å; F659-L663 HydrophobicContact CD1-CD2 4.1Å; F659-L663 HydrophobicContact CD1-CG 3.96Å; F659-L663 HydrophobicContact CG-CD1 4.43Å; F659-L663 WeakPolarHBondContact O-CG 3.34Å; F659-L663 PolarHBondContact O-N 3.4Å; L663-I683 HydrophobicContact CD1-CD1 4.46Å
664	M	92.1	Very high	89.1	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	29%	0.287	C	S	.	.	S	Bend	trans	-131.4	69.9	-170.9	-170.5	-179.3	-178.1	0	0	110.9	F592 F597 F600 I601 G660 I666 V679	F592-M664 HydrophobicContact CB-CB 3.95Å; F592-M664 HydrophobicContact CB-CG 3.87Å; F592-M664 HydrophobicContact CD1-SD 4.37Å; F592-M664 HydrophobicContact CD2-CB 4.18Å; F592-M664 HydrophobicContact CG-CB 4.07Å; F592-M664 HydrophobicContact CG-CG 4.22Å; F597-M664 HydrophobicContact CD2-CE 3.55Å; F597-M664 HydrophobicContact CD2-CG 3.9Å; F597-M664 HydrophobicContact CE2-CE 3.89Å; F597-M664 HydrophobicContact CE2-CG 4.04Å; F597-M664 HydrophobicContact CG-CE 4.1Å; F600-M664 HydrophobicContact CB-CE 3.53Å; F600-M664 HydrophobicContact CD2-CE 4.31Å; F600-M664 HydrophobicContact CG-CE 4.24Å; I601-M664 HydrophobicContact CD1-CE 4.22Å; I601-M664 HydrophobicContact CG1-CE 4.03Å; G660-M664 PolarHBondContact O-N 3.04Å; M664-I666 PolarHBondContact O-N 3.37Å; M664-V679 HydrophobicContact CB-CG1 3.99Å; M664-V679 HydrophobicContact CG-CG1 4.3Å; M664-V679 HydrophobicContact CG-CG2 4.44Å; M664-V679 HydrophobicContact SD-CG1 4.12Å; M664-V679 HydrophobicContact SD-CG2 4.2Å
665	P	88.8	Confident	88.7	Confident	46 Å²	46	44.6 Å²	44.6	30%	0.299	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-65.9	133.2	-178.9	28	-34.6	0	0	0	111.5	P590 P667	P590-P665 HydrophobicContact CB-CG 3.8Å; P590-P665 HydrophobicContact CG-CG 3.55Å; P665-P667 WeakPolarHBondContact O-CD 3.35Å
666	I	88.1	Confident	88.3	Confident	37 Å²	37	47 Å²	47	19%	0.19	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-66.4	123.8	-176.4	-56.6	170.2	0	0	0	109.6	F597 M664 Q670 P672 C675 Q676 V679	F597-I666 HydrophobicContact CE1-CG2 4.47Å; F597-I666 HydrophobicContact CE2-CB 4.36Å; F597-I666 HydrophobicContact CE2-CG1 4.12Å; F597-I666 HydrophobicContact CZ-CB 4.17Å; F597-I666 HydrophobicContact CZ-CG1 3.95Å; F597-I666 HydrophobicContact CZ-CG2 3.98Å; M664-I666 PolarHBondContact O-N 3.37Å; I666-Q670 HydrophobicContact CG2-CB 3.93Å; I666-P672 HydrophobicContact CD1-CB 4.28Å; I666-P672 WeakPolarHBondContact CD1-O 3.49Å; I666-C675 HydrophobicContact CD1-CB 3.94Å; I666-C675 HydrophobicContact CG1-CB 4.28Å; I666-C675 HydrophobicContact CG2-CB 4.01Å; I666-Q676 HydrophobicContact CD1-CB 4.25Å; I666-V679 HydrophobicContact CG1-CG2 4.24Å
667	P	85.4	Confident	88	Confident	27 Å²	27	50.3 Å²	50.3	18%	0.175	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-65.9	147.2	-178.3	-24.4	34.6	0	0	0	114.3	K594 F597 P665 G669 Q670	K594-P667 HydrophobicContact CB-CG 4.23Å; K594-P667 HydrophobicContact CG-CG 4.47Å; F597-P667 HydrophobicContact CB-CG 3.84Å; F597-P667 HydrophobicContact CD1-CG 4.07Å; F597-P667 VanDerWaalsContact CD2-CD 3.47Å; F597-P667 HydrophobicContact CD2-CG 4.12Å; F597-P667 VanDerWaalsContact CG-CD 3.43Å; F597-P667 HydrophobicContact CG-CG 3.75Å; P665-P667 WeakPolarHBondContact O-CD 3.35Å; P667-G669 PolarHBondContact O-N 3.45Å; P667-G669 VanDerWaalsContact O-N 3.16Å; P667-Q670 PolarHBondContact O-N 3.03Å
668	D	79.1	Confident	87.8	Confident	157 Å²	157	50.9 Å²	50.9	84%	0.84	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	114.3	178.2	-55.5	-82.4	0	0	0	111.4
669	G	77.3	Confident	87.7	Confident	85 Å²	85	49.9 Å²	49.9	88%	0.876	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.6	-8.7	-177.7	0	0	0	0	0	115.2	P667	P667-G669 PolarHBondContact O-N 3.45Å; P667-G669 VanDerWaalsContact O-N 3.16Å
670	Q	81.4	Confident	87.5	Confident	67 Å²	67	50.7 Å²	50.7	31%	0.313	32%	0.318	S	S	.	.	S	Bend	trans	-96.8	152.8	169.3	-58.8	-125.2	49.9	0	0	111	L598 I666 P667 P672	L598-Q670 VanDerWaalsContact CD2-NE2 3.31Å; I666-Q670 HydrophobicContact CG2-CB 3.93Å; P667-Q670 PolarHBondContact O-N 3.03Å; Q670-P672 VanDerWaalsContact O-CD 3.23Å; Q670-P672 WeakPolarHBondContact O-CD 3.43Å
671	D	84.5	Confident	87.5	Confident	85 Å²	85	52.8 Å²	52.8	46%	0.455	33%	0.328	S	S	.	.			trans	-69.6	116.3	174.2	171.6	23.2	0	0	0	110.4	V673 A674 C675	D671-V673 VanDerWaalsContact C-N 3.25Å; D671-V673 PolarHBondContact O-N 3.11Å; D671-V673 PolarHBondContact OD1-N 3.4Å; D671-A674 HydrophobicContact CB-CB 4.25Å; D671-A674 WeakPolarHBondContact OD2-CB 3.37Å; D671-A674 PolarHBondContact OD2-N 3.45Å; D671-C675 VanDerWaalsContact O-CB 3.23Å; D671-C675 WeakPolarHBondContact O-CB 3.28Å; D671-C675 PolarHBondContact O-N 3.12Å; D671-C675 PolarHBondContact O-SG 2.95Å
672	P	83.1	Confident	87.7	Confident	81 Å²	81	49.9 Å²	49.9	53%	0.526	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-32.9	178.9	-21.9	34.9	0	0	0	112.9	I666 Q670 Q676	I666-P672 HydrophobicContact CD1-CB 4.28Å; I666-P672 WeakPolarHBondContact CD1-O 3.49Å; Q670-P672 VanDerWaalsContact O-CD 3.23Å; Q670-P672 WeakPolarHBondContact O-CD 3.43Å; P672-Q676 VanDerWaalsContact O-CB 3.3Å; P672-Q676 WeakPolarHBondContact O-CB 3.34Å; P672-Q676 PolarHBondContact O-N 3.34Å
673	V	81.5	Confident	87.9	Confident	121 Å²	121	49.2 Å²	49.2	73%	0.733	31%	0.305	S	S	*	.	H	α-helix	trans	-74	-50.7	-174.2	-174.8	0	0	0	0	110.6	D671 C675	D671-V673 VanDerWaalsContact C-N 3.25Å; D671-V673 PolarHBondContact O-N 3.11Å; D671-V673 PolarHBondContact OD1-N 3.4Å; V673-C675 VanDerWaalsContact C-N 3.35Å; V673-C675 PolarHBondContact O-N 2.94Å
674	A	80.8	Confident	87.9	Confident	50 Å²	50	51.4 Å²	51.4	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-33.4	175	0	0	0	0	0	113	D671 H678	D671-A674 HydrophobicContact CB-CB 4.25Å; D671-A674 WeakPolarHBondContact OD2-CB 3.37Å; D671-A674 PolarHBondContact OD2-N 3.45Å; A674-H678 PolarHBondContact O-ND1 2.88Å
675	C	87.3	Confident	88.1	Confident	12 Å²	12	51.3 Å²	51.3	8%	0.081	31%	0.314	C	S	.	.	H	α-helix	trans	-81.2	-25.7	-177.4	-63.3	0	0	0	0	113.8	F597 I666 D671 V673 A677 H678 V679	F597-C675 HydrophobicContact CZ-CB 4.2Å; I666-C675 HydrophobicContact CD1-CB 3.94Å; I666-C675 HydrophobicContact CG1-CB 4.28Å; I666-C675 HydrophobicContact CG2-CB 4.01Å; D671-C675 VanDerWaalsContact O-CB 3.23Å; D671-C675 WeakPolarHBondContact O-CB 3.28Å; D671-C675 PolarHBondContact O-N 3.12Å; D671-C675 PolarHBondContact O-SG 2.95Å; V673-C675 VanDerWaalsContact C-N 3.35Å; V673-C675 PolarHBondContact O-N 2.94Å; C675-A677 PolarHBondContact O-N 2.94Å; C675-H678 WeakPolarHBondContact O-CB 3.29Å; C675-H678 PolarHBondContact O-N 3.05Å; C675-V679 WeakPolarHBondContact O-CG2 3.5Å; C675-V679 PolarHBondContact O-N 3.28Å
676	Q	89	Confident	88.5	Confident	52 Å²	52	49.1 Å²	49.1	24%	0.243	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-41.3	-176.1	-170.6	62.2	70.7	0	0	113.4	I666 P672 H678 V679 N680	I666-Q676 HydrophobicContact CD1-CB 4.25Å; P672-Q676 VanDerWaalsContact O-CB 3.3Å; P672-Q676 WeakPolarHBondContact O-CB 3.34Å; P672-Q676 PolarHBondContact O-N 3.34Å; Q676-H678 VanDerWaalsContact C-N 3.25Å; Q676-H678 PolarHBondContact O-N 2.89Å; Q676-V679 PolarHBondContact O-N 3.22Å; Q676-N680 PolarHBondContact NE2-OD1 3.48Å; Q676-N680 PolarHBondContact O-N 3.22Å; Q676-N680 PolarHBondContact O-OD1 2.92Å; Q676-N680 VanDerWaalsContact O-OD1 3.1Å
677	A	89.1	Confident	88.9	Confident	69 Å²	69	47.4 Å²	47.4	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-61.1	-38.3	176	0	0	0	0	0	111.6	C675 N680 E681	C675-A677 PolarHBondContact O-N 2.94Å; A677-N680 PolarHBondContact O-N 3.48Å; A677-E681 PolarHBondContact O-N 3.01Å
678	H	91.8	Very high	89.4	Confident	81 Å²	81	49.3 Å²	49.3	38%	0.375	30%	0.299	S	S	.	.	H	α-helix	trans	-67.7	-45.7	177.2	-69.9	113	0	0	0	112.3	I601 I604 A674 C675 Q676 N680 E681 V682	I601-H678 HydrophobicContact CD1-CB 3.62Å; I601-H678 HydrophobicContact CG2-CB 4.19Å; I604-H678 VanDerWaalsContact CD1-CA 3.5Å; I604-H678 HydrophobicContact CD1-CB 3.36Å; I604-H678 WeakPolarHBondContact CD1-O 3.43Å; A674-H678 PolarHBondContact O-ND1 2.88Å; C675-H678 WeakPolarHBondContact O-CB 3.29Å; C675-H678 PolarHBondContact O-N 3.05Å; Q676-H678 VanDerWaalsContact C-N 3.25Å; Q676-H678 PolarHBondContact O-N 2.89Å; H678-N680 VanDerWaalsContact C-N 3.29Å; H678-N680 PolarHBondContact O-N 3.36Å; H678-E681 PolarHBondContact O-N 3.39Å; H678-V682 PolarHBondContact O-N 3.5Å
679	V	93.4	Very high	90.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.9	-44.6	173.7	169.7	0	0	0	0	111.1	F597 I601 M664 I666 C675 Q676 E681 V682 I683	F597-V679 HydrophobicContact CE2-CG2 3.66Å; F597-V679 HydrophobicContact CZ-CG2 3.81Å; I601-V679 HydrophobicContact CD1-CG2 3.83Å; M664-V679 HydrophobicContact CB-CG1 3.99Å; M664-V679 HydrophobicContact CG-CG1 4.3Å; M664-V679 HydrophobicContact CG-CG2 4.44Å; M664-V679 HydrophobicContact SD-CG1 4.12Å; M664-V679 HydrophobicContact SD-CG2 4.2Å; I666-V679 HydrophobicContact CG1-CG2 4.24Å; C675-V679 WeakPolarHBondContact O-CG2 3.5Å; C675-V679 PolarHBondContact O-N 3.28Å; Q676-V679 PolarHBondContact O-N 3.22Å; V679-E681 PolarHBondContact O-N 2.91Å; V679-V682 PolarHBondContact O-N 3.17Å; V679-I683 HydrophobicContact CG1-CG1 4.37Å; V679-I683 VanDerWaalsContact O-CG1 3.29Å; V679-I683 WeakPolarHBondContact O-CG1 3.32Å; V679-I683 PolarHBondContact O-N 2.95Å; V679-I683 VanDerWaalsContact O-N 3.08Å
680	N	93.8	Very high	91	Very high	17 Å²	17	40.4 Å²	40.4	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-40.4	-179.1	-63.7	-0.6	0	0	0	111.9	A656 Q676 A677 H678 I683 K684	A656-N680 VanDerWaalsContact CB-O 3.31Å; A656-N680 WeakPolarHBondContact CB-O 3.43Å; Q676-N680 PolarHBondContact NE2-OD1 3.48Å; Q676-N680 PolarHBondContact O-N 3.22Å; Q676-N680 PolarHBondContact O-OD1 2.92Å; Q676-N680 VanDerWaalsContact O-OD1 3.1Å; A677-N680 PolarHBondContact O-N 3.48Å; H678-N680 VanDerWaalsContact C-N 3.29Å; H678-N680 PolarHBondContact O-N 3.36Å; N680-I683 PolarHBondContact O-N 3.45Å; N680-K684 VanDerWaalsContact O-CB 3.28Å; N680-K684 WeakPolarHBondContact O-CB 3.48Å; N680-K684 PolarHBondContact O-N 3.18Å
681	E	93.1	Very high	91.5	Very high	45 Å²	45	44 Å²	44	21%	0.21	25%	0.247	C	C	.	.	H	α-helix	trans	-71.6	-32.4	-179.4	-169.9	54.8	-141	0	0	113	I604 R612 A677 H678 V679 K684 T685	I604-E681 HydrophobicContact CG2-CG 4.38Å; R612-E681 IonicContact NH2-OE1 3.85Å; A677-E681 PolarHBondContact O-N 3.01Å; H678-E681 PolarHBondContact O-N 3.39Å; V679-E681 PolarHBondContact O-N 2.91Å; E681-K684 IonicContact OE1-NZ 2.71Å; E681-K684 PolarHBondContact OE1-NZ 2.89Å; E681-K684 IonicContact OE2-NZ 2.73Å; E681-K684 PolarHBondContact OE2-NZ 3.24Å; E681-T685 WeakPolarHBondContact O-CB 3.44Å; E681-T685 PolarHBondContact O-N 2.9Å; E681-T685 PolarHBondContact O-OG1 2.89Å
682	V	94.6	Very high	91.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-52	169.6	171.5	0	0	0	0	110.3	F600 I604 I616 H678 V679 K684 T685 I686	F600-V682 HydrophobicContact CB-CG1 4.37Å; F600-V682 HydrophobicContact CD1-CG1 4.31Å; I604-V682 HydrophobicContact CD1-CG2 3.72Å; I604-V682 HydrophobicContact CG1-CG2 3.68Å; I616-V682 HydrophobicContact CD1-CG1 4.31Å; H678-V682 PolarHBondContact O-N 3.5Å; V679-V682 PolarHBondContact O-N 3.17Å; V682-K684 VanDerWaalsContact C-N 3.34Å; V682-K684 PolarHBondContact O-N 3.06Å; V682-T685 WeakPolarHBondContact O-CB 3.3Å; V682-T685 PolarHBondContact O-N 3.48Å; V682-T685 VanDerWaalsContact O-N 3.14Å; V682-I686 HydrophobicContact CG1-CD1 3.84Å; V682-I686 WeakPolarHBondContact O-CG1 3.39Å; V682-I686 PolarHBondContact O-N 2.95Å
683	I	96.7	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-38.7	-177	-64.6	-73.5	0	0	0	111.2	F592 F635 A656 F659 L663 V679 N680 I686 I687	F592-I683 HydrophobicContact CD2-CD1 4.28Å; F592-I683 HydrophobicContact CE1-CD1 4.23Å; F592-I683 HydrophobicContact CE2-CD1 3.53Å; F592-I683 HydrophobicContact CZ-CD1 3.5Å; F635-I683 HydrophobicContact CE1-CG2 4.15Å; F635-I683 HydrophobicContact CZ-CD1 4.01Å; A656-I683 HydrophobicContact CB-CB 4.11Å; A656-I683 HydrophobicContact CB-CG2 3.86Å; F659-I683 HydrophobicContact CB-CG2 4.44Å; L663-I683 HydrophobicContact CD1-CD1 4.46Å; V679-I683 HydrophobicContact CG1-CG1 4.37Å; V679-I683 VanDerWaalsContact O-CG1 3.29Å; V679-I683 WeakPolarHBondContact O-CG1 3.32Å; V679-I683 PolarHBondContact O-N 2.95Å; V679-I683 VanDerWaalsContact O-N 3.08Å; N680-I683 PolarHBondContact O-N 3.45Å; I683-I686 PolarHBondContact O-N 3.46Å; I683-I687 HydrophobicContact CG2-CD1 4.16Å; I683-I687 WeakPolarHBondContact O-CG1 3.42Å; I683-I687 PolarHBondContact O-N 2.94Å
684	K	96.1	Very high	93.1	Very high	46 Å²	46	34.6 Å²	34.6	20%	0.2	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-46.6	170.7	164.9	167.3	158.6	-87.5	0	112.2	Y653 A656 N680 E681 V682 I686 I687 I688	Y653-K684 HydrophobicContact CD2-CD 3.97Å; A656-K684 HydrophobicContact CB-CB 3.82Å; N680-K684 VanDerWaalsContact O-CB 3.28Å; N680-K684 WeakPolarHBondContact O-CB 3.48Å; N680-K684 PolarHBondContact O-N 3.18Å; E681-K684 IonicContact OE1-NZ 2.71Å; E681-K684 PolarHBondContact OE1-NZ 2.89Å; E681-K684 IonicContact OE2-NZ 2.73Å; E681-K684 PolarHBondContact OE2-NZ 3.24Å; V682-K684 VanDerWaalsContact C-N 3.34Å; V682-K684 PolarHBondContact O-N 3.06Å; K684-I686 PolarHBondContact O-N 3.37Å; K684-I687 PolarHBondContact O-N 3.24Å; K684-I688 HydrophobicContact CG-CD1 3.83Å; K684-I688 WeakPolarHBondContact O-CG1 3.39Å; K684-I688 PolarHBondContact O-N 2.99Å
685	T	95.6	Very high	93.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-37.8	176.6	-55.8	0	0	0	0	110.9	E609 R612 I616 E681 V682 N689	E609-T685 HydrophobicContact CG-CG2 4.38Å; R612-T685 HydrophobicContact CG-CG2 4.27Å; R612-T685 PolarHBondContact NE-OG1 3.36Å; R612-T685 PolarHBondContact NH2-OG1 3.29Å; I616-T685 HydrophobicContact CD1-CG2 3.95Å; E681-T685 WeakPolarHBondContact O-CB 3.44Å; E681-T685 PolarHBondContact O-N 2.9Å; E681-T685 PolarHBondContact O-OG1 2.89Å; V682-T685 WeakPolarHBondContact O-CB 3.3Å; V682-T685 PolarHBondContact O-N 3.48Å; V682-T685 VanDerWaalsContact O-N 3.14Å; T685-N689 WeakPolarHBondContact O-CB 3.24Å; T685-N689 PolarHBondContact O-N 3.31Å; T685-N689 PolarHBondContact O-ND2 3.31Å
686	I	96.9	Very high	93.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.4	-41.9	177.3	-62.7	166.3	0	0	0	112.4	F592 I616 F635 V682 I683 K684 I688 H690 I693 F694	F592-I686 HydrophobicContact CE1-CD1 3.57Å; F592-I686 HydrophobicContact CZ-CD1 3.62Å; I616-I686 HydrophobicContact CD1-CG1 4.43Å; I616-I686 HydrophobicContact CG2-CD1 3.94Å; I616-I686 HydrophobicContact CG2-CG1 3.7Å; F635-I686 HydrophobicContact CB-CG2 4.26Å; F635-I686 HydrophobicContact CD1-CB 4.22Å; F635-I686 HydrophobicContact CD1-CG2 3.52Å; F635-I686 HydrophobicContact CD2-CG2 3.72Å; F635-I686 HydrophobicContact CE1-CB 4.03Å; F635-I686 HydrophobicContact CE1-CG2 3.64Å; F635-I686 HydrophobicContact CE2-CG2 3.86Å; F635-I686 HydrophobicContact CG-CG2 3.56Å; F635-I686 HydrophobicContact CZ-CB 4.36Å; F635-I686 HydrophobicContact CZ-CG2 3.82Å; V682-I686 HydrophobicContact CG1-CD1 3.84Å; V682-I686 WeakPolarHBondContact O-CG1 3.39Å; V682-I686 PolarHBondContact O-N 2.95Å; I683-I686 PolarHBondContact O-N 3.46Å; K684-I686 PolarHBondContact O-N 3.37Å; I686-I688 VanDerWaalsContact C-N 3.34Å; I686-I688 PolarHBondContact O-N 3Å; I686-H690 WeakPolarHBondContact O-CA 3.44Å; I686-H690 WeakPolarHBondContact O-CB 3.5Å; I686-H690 PolarHBondContact O-N 3.42Å; I686-H690 VanDerWaalsContact O-N 3.15Å; I686-I693 HydrophobicContact CB-CD1 4.43Å; I686-I693 HydrophobicContact CG1-CD1 4.13Å; I686-F694 HydrophobicContact CG2-CE2 3.58Å; I686-F694 HydrophobicContact CG2-CZ 3.65Å
687	I	97	Very high	93	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-44.6	175.6	-67.5	164.8	0	0	0	110.5	F635 L638 N639 P652 L655 A656 I683 K684	F635-I687 HydrophobicContact CD1-CG1 3.7Å; F635-I687 HydrophobicContact CE1-CG1 3.85Å; L638-I687 HydrophobicContact CB-CG1 4.19Å; N639-I687 WeakPolarHBondContact CB-O 3.2Å; N639-I687 PolarHBondContact ND2-O 3.27Å; P652-I687 HydrophobicContact CB-CB 4.42Å; P652-I687 HydrophobicContact CB-CG2 3.94Å; P652-I687 HydrophobicContact CG-CG2 4.36Å; L655-I687 HydrophobicContact CB-CD1 3.92Å; A656-I687 HydrophobicContact CB-CD1 4.36Å; I683-I687 HydrophobicContact CG2-CD1 4.16Å; I683-I687 WeakPolarHBondContact O-CG1 3.42Å; I683-I687 PolarHBondContact O-N 2.94Å; K684-I687 PolarHBondContact O-N 3.24Å
688	I	95.8	Very high	92.6	Very high	67 Å²	67	46.3 Å²	46.3	34%	0.344	22%	0.221	S	C	.	.	H	α-helix	trans	-69.3	-44.9	-177.8	-65.4	168.6	0	0	0	111.2	P652 K684 I686	P652-I688 HydrophobicContact CB-CD1 4.21Å; P652-I688 HydrophobicContact CB-CG1 3.85Å; P652-I688 HydrophobicContact CG-CG1 4.04Å; K684-I688 HydrophobicContact CG-CD1 3.83Å; K684-I688 WeakPolarHBondContact O-CG1 3.39Å; K684-I688 PolarHBondContact O-N 2.99Å; I686-I688 VanDerWaalsContact C-N 3.34Å; I686-I688 PolarHBondContact O-N 3Å
689	N	95.1	Very high	92.3	Very high	34 Å²	34	48.8 Å²	48.8	18%	0.182	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	27.5	-168.5	-57.1	-89.9	0	0	0	113.4	E609 A613 T685 E691 V692 I693	E609-N689 PolarHBondContact OE1-ND2 2.98Å; A613-N689 HydrophobicContact CB-CB 4.03Å; T685-N689 WeakPolarHBondContact O-CB 3.24Å; T685-N689 PolarHBondContact O-N 3.31Å; T685-N689 PolarHBondContact O-ND2 3.31Å; N689-E691 VanDerWaalsContact C-N 3.31Å; N689-E691 PolarHBondContact O-N 2.99Å; N689-V692 PolarHBondContact O-N 3.49Å; N689-I693 HydrophobicContact CB-CD1 3.82Å; N689-I693 HydrophobicContact CB-CG1 4.41Å; N689-I693 WeakPolarHBondContact O-CG1 3.5Å; N689-I693 PolarHBondContact O-N 2.93Å
690	H	94.6	Very high	92	Very high	22 Å²	22	49.4 Å²	49.4	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-36.8	-171.2	74.5	92	0	0	0	113.9	F635 N639 I686 V692 I693 F694	F635-H690 HydrophobicContact CB-CB 4.19Å; N639-H690 WeakPolarHBondContact CB-CD2 3.25Å; N639-H690 WeakPolarHBondContact CB-NE2 3.13Å; N639-H690 VanDerWaalsContact CG-CD2 3.41Å; N639-H690 VanDerWaalsContact CG-NE2 3.33Å; N639-H690 PolarHBondContact ND2-CD2 2.87Å; I686-H690 WeakPolarHBondContact O-CA 3.44Å; I686-H690 WeakPolarHBondContact O-CB 3.5Å; I686-H690 PolarHBondContact O-N 3.42Å; I686-H690 VanDerWaalsContact O-N 3.15Å; H690-V692 PolarHBondContact O-N 2.86Å; H690-I693 PolarHBondContact O-N 2.93Å; H690-F694 HydrophobicContact CB-CD2 4.02Å; H690-F694 HydrophobicContact CB-CE2 4.22Å; H690-F694 WeakPolarHBondContact O-CD2 3.15Å; H690-F694 PolarHBondContact O-N 3.41Å
691	E	92.3	Very high	91.5	Very high	143 Å²	143	54.8 Å²	54.8	67%	0.668	27%	0.265	S	S	*	.	H	α-helix	trans	-65	-20.2	177.4	-57.8	-173.7	162	0	0	113.5	N689	N689-E691 VanDerWaalsContact C-N 3.31Å; N689-E691 PolarHBondContact O-N 2.99Å
692	V	93.1	Very high	91.1	Very high	82 Å²	82	54 Å²	54	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-97.3	-29.6	177.2	-176	0	0	0	0	111.2	Q617 N689 H690	Q617-V692 VanDerWaalsContact CD-O 3.3Å; Q617-V692 PolarHBondContact NE2-O 3.31Å; N689-V692 PolarHBondContact O-N 3.49Å; H690-V692 PolarHBondContact O-N 2.86Å
693	I	94.5	Very high	90.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-86.7	-31.7	-173.3	-72.8	165.2	0	0	0	112.9	A613 I616 V620 I686 N689 H690	A613-I693 HydrophobicContact CB-CD1 4.07Å; A613-I693 HydrophobicContact CB-CG1 4.14Å; I616-I693 HydrophobicContact CB-CD1 4.46Å; I616-I693 HydrophobicContact CG2-CD1 4.02Å; I616-I693 HydrophobicContact CG2-CG1 4.3Å; I616-I693 HydrophobicContact CG2-CG2 3.85Å; V620-I693 HydrophobicContact CG2-CG2 4.13Å; I686-I693 HydrophobicContact CB-CD1 4.43Å; I686-I693 HydrophobicContact CG1-CD1 4.13Å; N689-I693 HydrophobicContact CB-CD1 3.82Å; N689-I693 HydrophobicContact CB-CG1 4.41Å; N689-I693 WeakPolarHBondContact O-CG1 3.5Å; N689-I693 PolarHBondContact O-N 2.93Å; H690-I693 PolarHBondContact O-N 2.93Å
694	F	94.8	Very high	90.3	Very high	7 Å²	7	58.8 Å²	58.8	3%	0.031	30%	0.298	C	S	.	.	S	Bend	trans	-106.5	143.4	-179.4	-60.9	-69.5	0	0	0	111.8	V620 I628 M631 R632 F635 I686 H690	V620-F694 HydrophobicContact CG1-CD1 3.8Å; V620-F694 HydrophobicContact CG1-CE1 3.73Å; V620-F694 HydrophobicContact CG2-CE1 4.4Å; I628-F694 HydrophobicContact CG2-CD1 4.34Å; M631-F694 HydrophobicContact CB-CD1 4.22Å; M631-F694 HydrophobicContact CB-CE1 3.42Å; M631-F694 VanDerWaalsContact CB-CE1 3.42Å; M631-F694 HydrophobicContact CB-CZ 3.78Å; M631-F694 HydrophobicContact CG-CE1 4.39Å; M631-F694 HydrophobicContact SD-CE1 4.25Å; R632-F694 HydrophobicContact CB-CB 3.97Å; R632-F694 HydrophobicContact CB-CD1 4.41Å; R632-F694 HydrophobicContact CB-CG 4.1Å; R632-F694 HydrophobicContact CG-CB 3.92Å; R632-F694 HydrophobicContact CG-CG 4.47Å; F635-F694 HydrophobicContact CB-CD2 4.44Å; F635-F694 HydrophobicContact CB-CE2 3.64Å; F635-F694 HydrophobicContact CB-CZ 4.31Å; F635-F694 AromaticContact CD2-CE2 3.85Å; F635-F694 HydrophobicContact CD2-CE2 3.85Å; F635-F694 AromaticContact CD2-CZ 3.62Å; F635-F694 HydrophobicContact CD2-CZ 3.62Å; F635-F694 HydrophobicContact CE2-CZ 4.3Å; F635-F694 AromaticContact CG-CE2 3.96Å; F635-F694 HydrophobicContact CG-CE2 3.96Å; F635-F694 HydrophobicContact CG-CZ 4.2Å; I686-F694 HydrophobicContact CG2-CE2 3.58Å; I686-F694 HydrophobicContact CG2-CZ 3.65Å; H690-F694 HydrophobicContact CB-CD2 4.02Å; H690-F694 HydrophobicContact CB-CE2 4.22Å; H690-F694 WeakPolarHBondContact O-CD2 3.15Å; H690-F694 PolarHBondContact O-N 3.41Å
695	P	90	Very high	90	Very high	21 Å²	21	57.3 Å²	57.3	14%	0.136	29%	0.292	C	S	.	.			trans	-65	140	179.2	26.6	-34.4	0	0	0	111.7	I628 R632 E699 L700	I628-P695 HydrophobicContact CG2-CG 3.8Å; R632-P695 WeakPolarHBondContact CD-O 3.22Å; R632-P695 PolarHBondContact NH1-O 3Å; P695-E699 VanDerWaalsContact CA-OE2 3.32Å; P695-E699 WeakPolarHBondContact CA-OE2 3.22Å; P695-E699 HydrophobicContact CB-CB 3.84Å; P695-L700 HydrophobicContact CB-CB 4.04Å; P695-L700 HydrophobicContact CG-CB 3.77Å; P695-L700 HydrophobicContact CG-CD2 3.71Å; P695-L700 HydrophobicContact CG-CG 4.41Å
696	N	83.6	Confident	89.5	Confident	94 Å²	94	63.3 Å²	63.3	50%	0.503	32%	0.32	S	S	.	.			trans	-67.2	166.8	178.7	-75.3	-58.8	0	0	0	111.8	R632 R698 E699 L700	R632-N696 PolarHBondContact NH1-O 2.83Å; N696-R698 PolarHBondContact O-N 3.48Å; N696-E699 HydrophobicContact CB-CG 4.49Å; N696-E699 PolarHBondContact N-OE2 3.42Å; N696-E699 PolarHBondContact O-N 3.11Å; N696-L700 PolarHBondContact O-N 3.09Å
697	Q	80.9	Confident	88.9	Confident	125 Å²	125	67.5 Å²	67.5	58%	0.584	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-35	-177.6	-166.9	175.2	4.7	0	0	112.9	E699 L700 V704	Q697-E699 VanDerWaalsContact C-N 3.28Å; Q697-E699 PolarHBondContact O-N 3.28Å; Q697-L700 CarbonylContact O-C 3.49Å; Q697-V704 HydrophobicContact CB-CG2 4.12Å; Q697-V704 HydrophobicContact CG-CG2 4.08Å
698	R	81.1	Confident	86.9	Confident	189 Å²	189	72.3 Å²	72.3	71%	0.713	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-13.6	175.6	-57.2	-173.4	-172.6	-159.2	-6	114.8	N696 E722	N696-R698 PolarHBondContact O-N 3.48Å; R698-E722 IonicContact CZ-OE1 2.65Å; R698-E722 VanDerWaalsContact CZ-OE1 3.28Å; R698-E722 IonicContact NE-OE1 3.88Å; R698-E722 IonicContact NH1-OE1 3.7Å; R698-E722 PolarHBondContact NH1-OE1 3.34Å; R698-E722 IonicContact NH2-OE1 3.87Å
699	E	85.2	Confident	84.6	Confident	133 Å²	133	71.6 Å²	71.6	62%	0.621	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-25.5	-177.6	-62.3	173.1	149.2	0	0	111.8	P695 N696 Q697	P695-E699 VanDerWaalsContact CA-OE2 3.32Å; P695-E699 WeakPolarHBondContact CA-OE2 3.22Å; P695-E699 HydrophobicContact CB-CB 3.84Å; N696-E699 HydrophobicContact CB-CG 4.49Å; N696-E699 PolarHBondContact N-OE2 3.42Å; N696-E699 PolarHBondContact O-N 3.11Å; Q697-E699 VanDerWaalsContact C-N 3.28Å; Q697-E699 PolarHBondContact O-N 3.28Å
700	L	87	Confident	81.8	Confident	12 Å²	12	75.9 Å²	75.9	6%	0.063	39%	0.394	C	S	.	.	S	Bend	trans	-150.4	107.5	176	-177.4	60.4	0	0	0	111	R625 I628 I629 R632 P695 N696 Q697	R625-L700 HydrophobicContact CB-CD1 4.23Å; R625-L700 HydrophobicContact CG-CD1 4.03Å; I628-L700 HydrophobicContact CB-CD2 4.01Å; I628-L700 HydrophobicContact CG2-CD2 3.69Å; I629-L700 HydrophobicContact CD1-CG 4.36Å; I629-L700 HydrophobicContact CG1-CD2 3.86Å; I629-L700 HydrophobicContact CG1-CG 4.06Å; R632-L700 PolarHBondContact NH1-O 3.4Å; R632-L700 PolarHBondContact NH2-O 3.26Å; R632-L700 VanDerWaalsContact NH2-O 3.11Å; P695-L700 HydrophobicContact CB-CB 4.04Å; P695-L700 HydrophobicContact CG-CB 3.77Å; P695-L700 HydrophobicContact CG-CD2 3.71Å; P695-L700 HydrophobicContact CG-CG 4.41Å; N696-L700 PolarHBondContact O-N 3.09Å; Q697-L700 CarbonylContact O-C 3.49Å
701	D	83.2	Confident	78.9	Confident	131 Å²	131	78.6 Å²	78.6	70%	0.701	43%	0.428	S	S	*	.			trans	-59.5	150.8	174.9	-54	-61	0	0	0	112.5	I629	I629-D701 WeakPolarHBondContact CD1-O 3.33Å
702	G	84.5	Confident	75.9	Confident	29 Å²	29	75.3 Å²	75.3	30%	0.299	43%	0.433	S	S	.	.	S	Bend	trans	129.2	170.3	-177.9	0	0	0	0	0	111.4	R632	R632-G702 PolarHBondContact NH2-O 3.33Å
703	P	87.4	Confident	72.6	Confident	40 Å²	40	80.6 Å²	80.6	26%	0.26	45%	0.452	S	S	.	.			trans	-55.3	152.6	-175.1	-29.1	37.5	0	0	0	114.1	P518 I519 R632 Y633	P518-P703 HydrophobicContact CB-CG 4.19Å; P518-P703 HydrophobicContact CG-CG 3.62Å; I519-P703 HydrophobicContact CG1-CB 4.01Å; I519-P703 HydrophobicContact CG1-CG 3.96Å; R632-P703 PolarHBondContact NH2-O 3.38Å; Y633-P703 HydrophobicContact CD2-CB 4.42Å
704	V	87.4	Confident	69.4	Low	60 Å²	60	90.4 Å²	90.4	36%	0.364	50%	0.497	S	S	.	.			trans	-123.1	144.4	170	-178.5	0	0	0	0	106	Q697	Q697-V704 HydrophobicContact CB-CG2 4.12Å; Q697-V704 HydrophobicContact CG-CG2 4.08Å
705	Y	90.4	Very high	66.2	Low	14 Å²	14	99.1 Å²	99.1	6%	0.055	53%	0.532	C	S	.	.			trans	-81	125.9	178	163.7	-96.2	0	0	0	110	V527 N531 Y633 A636 F637 H640 K707	V527-Y705 HydrophobicContact CG1-CD2 3.67Å; V527-Y705 HydrophobicContact CG1-CE2 3.64Å; N531-Y705 VanDerWaalsContact CG-OH 3.28Å; N531-Y705 PolarHBondContact OD1-OH 2.92Å; Y633-Y705 HydrophobicContact CE2-CD2 4.33Å; A636-Y705 HydrophobicContact CB-CD1 4Å; A636-Y705 HydrophobicContact CB-CG 4.46Å; F637-Y705 HydrophobicContact CB-CD1 4.11Å; F637-Y705 HydrophobicContact CB-CD2 3.89Å; F637-Y705 HydrophobicContact CB-CE1 4.12Å; F637-Y705 HydrophobicContact CB-CE2 3.9Å; F637-Y705 HydrophobicContact CB-CG 3.98Å; F637-Y705 AromaticContact CD2-CE2 3.83Å; F637-Y705 HydrophobicContact CD2-CE2 3.83Å; F637-Y705 AromaticContact CD2-CZ 3.83Å; F637-Y705 HydrophobicContact CG-CE2 4.31Å; H640-Y705 HydrophobicContact CB-CE1 3.72Å; H640-Y705 AromaticContact ND1-CE1 3.92Å; H640-Y705 AromaticContact ND1-CZ 3.81Å; H640-Y705 PolarHBondContact ND1-OH 3.39Å; Y705-K707 HydrophobicContact CE1-CG 4.29Å
706	E	85.6	Confident	63.5	Low	126 Å²	126	103.3 Å²	103.3	59%	0.589	56%	0.56	S	S	*	*			trans	-100.3	137.4	179	-62.8	-169.3	171.1	0	0	111.6	M709	E706-M709 HydrophobicContact CB-SD 4.32Å
707	K	82.9	Confident	60.6	Low	88 Å²	88	105.3 Å²	105.3	38%	0.383	57%	0.571	S	S	.	*	S	Bend	trans	-71.7	-39.3	-177.4	-67	-171.4	169.7	-174.1	0	112	N531 H640 Q643 Y705	N531-K707 PolarHBondContact ND2-O 3.14Å; H640-K707 HydrophobicContact CB-CD 4.49Å; H640-K707 HydrophobicContact CB-CG 4.3Å; H640-K707 VanDerWaalsContact CD2-CD 3.44Å; H640-K707 WeakPolarHBondContact CD2-CD 3.41Å; Q643-K707 VanDerWaalsContact CD-NZ 3.31Å; Y705-K707 HydrophobicContact CE1-CG 4.29Å
708	C	55.9	Low	58.9	Low	101 Å²	101	103.1 Å²	103.1	68%	0.682	57%	0.57	S	S	*	*	S	Bend	trans	-100	84.7	178.6	-63.4	0	0	0	0	109.7	T710	C708-T710 PolarHBondContact O-N 2.91Å
709	M	47.2	Very low	56.7	Low	52 Å²	52	98.8 Å²	98.8	26%	0.256	57%	0.566	S	S	.	*			trans	-74.3	77.4	172.8	-64	-68.8	-80	0	0	109.6	R528 N531 E706 G711	R528-M709 HydrophobicContact CB-CE 4.05Å; R528-M709 HydrophobicContact CG-CE 3.91Å; N531-M709 HydrophobicContact CB-CG 4.48Å; N531-M709 VanDerWaalsContact ND2-CG 3.34Å; N531-M709 WeakPolarHBondContact ND2-CG 3.44Å; E706-M709 HydrophobicContact CB-SD 4.32Å; M709-G711 PolarHBondContact O-N 2.72Å
710	T	36	Very low	53.8	Low	124 Å²	124	100.8 Å²	100.8	76%	0.761	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-60	120	163.4	38.5	0	0	0	0	108.4	C708 G712	C708-T710 PolarHBondContact O-N 2.91Å; T710-G712 PolarHBondContact O-N 2.66Å
711	G	33.1	Very low	51.2	Low	80 Å²	80	104.5 Å²	104.5	83%	0.825	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-57.9	121.9	173.5	0	0	0	0	0	109.6	M709 E713	M709-G711 PolarHBondContact O-N 2.72Å; G711-E713 PolarHBondContact O-N 2.93Å
712	G	30.4	Very low	48.6	Very low	74 Å²	74	104.7 Å²	104.7	76%	0.763	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-75.1	118.3	-169.3	0	0	0	0	0	113.2	T710	T710-G712 PolarHBondContact O-N 2.66Å
713	E	24.3	Very low	46.3	Very low	192 Å²	192	108.6 Å²	108.6	90%	0.897	62%	0.619	S	S	*	*	S	Bend		-86.5	142.4	125.4	-66.2	-168.2	147.7	0	0	107.3	G711 Y715	G711-E713 PolarHBondContact O-N 2.93Å; E713-Y715 PolarHBondContact O-N 2.85Å; E713-Y715 VanDerWaalsContact O-N 3.14Å
714	E	27.1	Very low	43.7	Very low	206 Å²	206	109.7 Å²	109.7	96%	0.963	64%	0.637	S	S	*	*			trans	-75.4	105.8	-160.8	-66.7	176.1	121.5	0	0	113.3
715	Y	27.7	Very low	41.1	Very low	190 Å²	190	113.4 Å²	113.4	75%	0.745	66%	0.66	S	S	*	*			trans	-110	110	155.2	-172.2	-87.8	0	0	0	109.8	E713	E713-Y715 PolarHBondContact O-N 2.85Å; E713-Y715 VanDerWaalsContact O-N 3.14Å
716	C	31.9	Very low	38.1	Very low	110 Å²	110	119.7 Å²	119.7	74%	0.743	69%	0.693	S	S	*	*			trans	174.8	124.3	141.8	-95.2	0	0	0	0	111.4
717	D	22.6	Very low	35.5	Very low	135 Å²	135	120.4 Å²	120.4	72%	0.722	70%	0.701	S	S	*	*				-139.1	144.5	100.4	-162	-0.2	0	0	0	109.2
718	S	45.3	Very low	33.1	Very low	80 Å²	80	125.1 Å²	125.1	56%	0.559	73%	0.725	S	S	*	*			trans	-147.9	87.2	175.3	-89.6	0	0	0	0	109.5
719	P	35.4	Very low	31.8	Very low	98 Å²	98	125 Å²	125	64%	0.636	73%	0.731	S	S	*	*			trans	-88.5	130.5	172	33.4	-31	0	0	0	111.1
720	H	25.5	Very low	30.9	Very low	174 Å²	174	129 Å²	129	81%	0.806	75%	0.753	S	S	*	*			cis	-159.5	165.9	-4.3	-109.6	9.3	0	0	0	107.7
721	S	31	Very low	30.6	Very low	90 Å²	90	130 Å²	130	63%	0.629	75%	0.754	S	S	*	*			trans	-82.5	134	150.6	-70.9	0	0	0	0	109.2
722	E	28.3	Very low	30.3	Very low	135 Å²	135	129 Å²	129	63%	0.631	74%	0.744	S	S	*	*			trans	179.7	164.7	142	-96.5	-51.6	90.1	0	0	109.7	R698	R698-E722 IonicContact CZ-OE1 2.65Å; R698-E722 VanDerWaalsContact CZ-OE1 3.28Å; R698-E722 IonicContact NE-OE1 3.88Å; R698-E722 IonicContact NH1-OE1 3.7Å; R698-E722 PolarHBondContact NH1-OE1 3.34Å; R698-E722 IonicContact NH2-OE1 3.87Å
723	P	36.1	Very low	30.2	Very low	111 Å²	111	132.9 Å²	132.9	72%	0.721	75%	0.753	S	S	*	*			trans	-104.8	139.4	-163.3	37.4	-33.3	0	0	0	116.4
724	G	32.8	Very low	30.4	Very low	63 Å²	63	130.7 Å²	130.7	65%	0.649	74%	0.743	S	S	*	*			trans	92.4	91.4	137.5	0	0	0	0	0	120.5
725	T	32.9	Very low	30.9	Very low	138 Å²	138	126.6 Å²	126.6	85%	0.847	73%	0.734	S	S	*	*			trans	74.3	148.8	143.9	66.4	0	0	0	0	121.5
726	I	29	Very low	30.8	Very low	146 Å²	146	124.9 Å²	124.9	75%	0.749	73%	0.733	S	S	*	*			trans	94.8	101.8	162.3	-51.1	-178.7	0	0	0	118.3
727	D	30.8	Very low	30.5	Very low	142 Å²	142	126.2 Å²	126.2	76%	0.759	74%	0.737	S	S	*	*			trans	52.6	109.4	137	-52.4	-5.3	0	0	0	125.1
728	E	30.9	Very low	30.7	Very low	187 Å²	187	125.1 Å²	125.1	87%	0.874	74%	0.741	S	S	*	*				65.6	148.1	124.8	-60.5	-149.9	147.2	0	0	125.9
729	A	29.4	Very low	30.1	Very low	99 Å²	99	129 Å²	129	82%	0.818	76%	0.755	S	S	*	*			trans	74.9	142.6	154	0	0	0	0	0	119.7
730	D	28.8	Very low	29.9	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	77%	0.768	S	S	*	*			cis	-165	156.7	-14	176.4	42.6	0	0	0	110.2
731	N	29.5	Very low	30.3	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	77%	0.773	S	S	*	*			trans	35.9	132.9	164.9	-81.2	-58.3	0	0	0	121.5
732	G	27.1	Very low	30.8	Very low	60 Å²	60	136.7 Å²	136.7	62%	0.619	78%	0.781	S	S	*	*			cis	154	174.2	-0.7	0	0	0	0	0	113.3
733	T	28.4	Very low	31.7	Very low	156 Å²	156	136.8 Å²	136.8	96%	0.957	78%	0.782	S	S	*	*			trans	111.2	135.6	172.6	-40.5	0	0	0	0	116.3
734	E	28.2	Very low	32.8	Very low	145 Å²	145	137.3 Å²	137.3	68%	0.678	78%	0.775	S	S	*	*			trans	-105.7	172.8	-160.8	-119.7	167.8	-145.2	0	0	112.9	H736	E734-H736 IonicContact OE2-CD2 2.76Å; E734-H736 IonicContact OE2-NE2 2.69Å
735	P	36.6	Very low	35.2	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	76%	0.755	S	S	*	*				-149	144.9	55.6	39	-17.2	0	0	0	120.6
736	H	27	Very low	37.9	Very low	155 Å²	155	134.5 Å²	134.5	72%	0.718	74%	0.736	S	S	*	*			trans	6.1	128.1	151.5	-63	-89.2	0	0	0	122.7	E734	E734-H736 IonicContact OE2-CD2 2.76Å; E734-H736 IonicContact OE2-NE2 2.69Å
737	T	25.7	Very low	40.9	Very low	137 Å²	137	127.6 Å²	127.6	84%	0.84	70%	0.7	S	S	*	*			trans	-146.5	126	135.1	46.7	0	0	0	0	111.9
738	S	26.7	Very low	43.8	Very low	113 Å²	113	124 Å²	124	79%	0.79	68%	0.681	S	S	*	*			trans	9.6	127.7	162.2	52.9	0	0	0	0	122.2
739	D	31.6	Very low	46.8	Very low	160 Å²	160	115.2 Å²	115.2	86%	0.856	64%	0.64	S	S	*	*			trans	-73.8	157.1	159.9	-44	-92.8	0	0	0	113.5
740	E	31.9	Very low	49.7	Very low	197 Å²	197	115.4 Å²	115.4	92%	0.921	62%	0.622	S	S	*	*			trans	-130.7	135.4	153.7	-75.6	-167.4	143.1	0	0	109.3
741	E	33.8	Very low	52.4	Low	196 Å²	196	113.7 Å²	113.7	92%	0.916	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-90	131.1	-178.1	-64.8	178.9	116.2	0	0	111
742	V	42.1	Very low	55.3	Low	131 Å²	131	110.7 Å²	110.7	79%	0.794	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-88.6	120.7	173.3	-179.4	0	0	0	0	109.5	Q744	V742-Q744 PolarHBondContact O-N 3.05Å
743	E	45.7	Very low	58.4	Low	137 Å²	137	108.8 Å²	108.8	64%	0.64	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-59.3	129.6	179.6	-69.1	-173.8	119.3	0	0	112.3	L801	E743-L801 HydrophobicContact CB-CD1 4.34Å; E743-L801 HydrophobicContact CG-CD1 4.37Å; E743-L801 WeakPolarHBondContact OE1-CD1 3.31Å
744	Q	60.6	Low	61.5	Low	122 Å²	122	106 Å²	106	57%	0.57	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-92	120.6	169.8	-83.6	-178	12.8	0	0	109.9	V742 L770	V742-Q744 PolarHBondContact O-N 3.05Å; Q744-L770 HydrophobicContact CB-CD1 3.96Å; Q744-L770 HydrophobicContact CG-CD1 4.4Å
745	I	83.7	Confident	64.3	Low	45 Å²	45	100 Å²	100	23%	0.231	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.8	-174.3	-62.6	171.9	0	0	0	108.7	L771 W780 V798	I745-L771 HydrophobicContact CB-CB 4.19Å; I745-L771 HydrophobicContact CG2-CB 4.37Å; I745-L771 HydrophobicContact CG2-CD1 4.21Å; I745-L771 PolarHBondContact N-O 2.61Å; I745-L771 WeakPolarHBondContact O-CB 3.43Å; I745-L771 PolarHBondContact O-N 2.87Å; I745-W780 HydrophobicContact CD1-CH2 4.47Å; I745-W780 HydrophobicContact CD1-CZ3 4.23Å; I745-V798 HydrophobicContact CG2-CG1 3.46Å; I745-V798 VanDerWaalsContact CG2-CG1 3.46Å
746	E	89	Confident	66.3	Low	98 Å²	98	104.8 Å²	104.8	46%	0.458	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	147.3	172.3	-75.7	-155.5	-150.5	0	0	112.1	S768 L770 Q799	E746-S768 PolarHBondContact OE2-OG 3.43Å; E746-S768 VanDerWaalsContact OE2-OG 3.07Å; E746-L770 HydrophobicContact CG-CD1 4.09Å; E746-Q799 PolarHBondContact O-N 3.3Å
747	A	91.7	Very high	69	Low	0 Å²	0	99.7 Å²	99.7	0%	0	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.3	177.9	0	0	0	0	0	111.7	S768 L769 L771 I796 V797	A747-S768 CarbonylContact O-C 3.57Å; A747-S768 WeakPolarHBondContact O-CA 3.47Å; A747-L769 PolarHBondContact N-O 3.32Å; A747-L769 WeakPolarHBondContact O-CB 3.33Å; A747-L769 PolarHBondContact O-N 2.8Å; A747-L771 HydrophobicContact CB-CD1 3.67Å; A747-L771 HydrophobicContact CB-CD2 4.23Å; A747-L771 HydrophobicContact CB-CG 3.84Å; A747-I796 HydrophobicContact CB-CB 4.45Å; A747-I796 HydrophobicContact CB-CD1 4.1Å; A747-V797 CarbonylContact C-O 3.34Å; A747-V797 WeakPolarHBondContact CA-O 3.4Å; A747-V797 WeakPolarHBondContact CB-O 3.12Å
748	I	91.8	Very high	71.3	Confident	67 Å²	67	100.1 Å²	100.1	34%	0.344	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.4	179.7	-60.5	179.8	0	0	0	110.8	K750 A767 I796 V797	I748-K750 PolarHBondContact O-N 3.02Å; I748-K750 VanDerWaalsContact O-N 3.15Å; I748-A767 WeakPolarHBondContact CA-O 3.41Å; I748-I796 CarbonylContact O-C 3.58Å; I748-I796 WeakPolarHBondContact O-CA 3.4Å; I748-V797 PolarHBondContact N-O 3.24Å; I748-V797 PolarHBondContact O-N 2.63Å
749	A	93.5	Very high	74	Confident	2 Å²	2	103.9 Å²	103.9	2%	0.017	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	112.4	175	0	0	0	0	0	112.3	F751 F763 K764 K765 G766 A767 L769 Y795	A749-F751 VanDerWaalsContact C-N 3.35Å; A749-F763 HydrophobicContact CB-CD2 3.48Å; A749-F763 VanDerWaalsContact CB-CD2 3.48Å; A749-F763 HydrophobicContact CB-CE2 3.81Å; A749-F763 HydrophobicContact CB-CG 4.49Å; A749-K764 WeakPolarHBondContact CB-O 3.29Å; A749-K765 CarbonylContact O-C 3.56Å; A749-K765 WeakPolarHBondContact O-CA 3.34Å; A749-G766 PolarHBondContact O-N 2.87Å; A749-A767 HydrophobicContact CB-CB 4.27Å; A749-A767 PolarHBondContact N-O 3.49Å; A749-L769 HydrophobicContact CB-CD1 4.04Å; A749-Y795 CarbonylContact C-O 3.5Å
750	K	89.5	Confident	76.9	Confident	104 Å²	104	98 Å²	98	45%	0.452	48%	0.48	S	S	.	.	S	Bend	trans	-72.8	-28.3	177.3	-166.1	174.1	-176.8	169.7	0	112.7	I748 K765 Y795 V797	I748-K750 PolarHBondContact O-N 3.02Å; I748-K750 VanDerWaalsContact O-N 3.15Å; K750-K765 VanDerWaalsContact O-CD 3.24Å; K750-K765 WeakPolarHBondContact O-CD 3.45Å; K750-K765 WeakPolarHBondContact O-CE 3.36Å; K750-K765 WeakPolarHBondContact O-CG 3.39Å; K750-K765 PolarHBondContact O-NZ 3.32Å; K750-Y795 WeakPolarHBondContact CB-O 3.24Å; K750-Y795 PolarHBondContact N-O 3.3Å; K750-V797 HydrophobicContact CB-CG2 4.21Å; K750-V797 HydrophobicContact CD-CG2 3.94Å; K750-V797 HydrophobicContact CG-CG2 4.25Å
751	F	87.1	Confident	79.7	Confident	97 Å²	97	89.2 Å²	89.2	43%	0.425	44%	0.44	S	S	.	.	S	Bend	trans	-141.7	163.8	-177.4	-57.1	-68.7	0	0	0	111.1	A749 Y795	A749-F751 VanDerWaalsContact C-N 3.35Å; F751-Y795 HydrophobicContact CB-CD1 3.84Å; F751-Y795 HydrophobicContact CB-CE1 4.33Å; F751-Y795 PolarHBondContact N-O 3.18Å
752	D	89.7	Confident	82.5	Confident	82 Å²	82	82.8 Å²	82.8	44%	0.439	42%	0.417	S	S	.	.			trans	-67.3	137.7	166.4	-86.3	17.9	0	0	0	109.9	K764 K765	D752-K764 HydrophobicContact CB-CD 4.36Å; D752-K764 WeakPolarHBondContact OD1-CA 3.36Å; D752-K764 WeakPolarHBondContact OD1-CD 3.47Å; D752-K764 WeakPolarHBondContact OD2-CD 3.42Å; D752-K764 WeakPolarHBondContact OD2-CE 3.31Å; D752-K764 IonicContact OD2-NZ 2.69Å; D752-K764 PolarHBondContact OD2-NZ 3.39Å; D752-K765 PolarHBondContact OD1-N 3.33Å
753	Y	93.1	Very high	85	Confident	20 Å²	20	76.8 Å²	76.8	8%	0.078	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-136.1	140.7	175.6	-173.3	-106.3	0	0	0	111.7	E760 L761 F763 W779 P792 Y795	Y753-E760 HydrophobicContact CE1-CB 4.41Å; Y753-E760 PolarHBondContact OH-OE2 2.96Å; Y753-L761 VanDerWaalsContact CD1-O 3.31Å; Y753-L761 WeakPolarHBondContact CD1-O 3.48Å; Y753-F763 HydrophobicContact CD1-CD1 4.35Å; Y753-F763 AromaticContact CD1-CE1 3.79Å; Y753-F763 HydrophobicContact CD1-CE1 3.79Å; Y753-F763 HydrophobicContact CD1-CZ 4.02Å; Y753-F763 HydrophobicContact CG-CE1 4.26Å; Y753-F763 HydrophobicContact CG-CE2 4.42Å; Y753-F763 HydrophobicContact CG-CZ 4.03Å; Y753-F763 PolarHBondContact N-O 3.39Å; Y753-F763 PolarHBondContact O-N 2.73Å; Y753-W779 HydrophobicContact CE1-CZ3 4.49Å; Y753-W779 VanDerWaalsContact OH-CH2 3.32Å; Y753-W779 WeakPolarHBondContact OH-CH2 3.37Å; Y753-P792 HydrophobicContact CD1-CG 3.79Å; Y753-P792 HydrophobicContact CD2-CG 3.85Å; Y753-P792 HydrophobicContact CE1-CG 3.7Å; Y753-P792 HydrophobicContact CE2-CG 3.77Å; Y753-P792 HydrophobicContact CG-CG 3.87Å; Y753-Y795 AromaticContact CD2-CD1 3.72Å; Y753-Y795 HydrophobicContact CD2-CD1 3.72Å; Y753-Y795 HydrophobicContact CD2-CD2 4.27Å; Y753-Y795 AromaticContact CD2-CE1 3.74Å; Y753-Y795 HydrophobicContact CD2-CE1 3.74Å; Y753-Y795 HydrophobicContact CD2-CE2 4.29Å; Y753-Y795 HydrophobicContact CD2-CG 4.02Å; Y753-Y795 HydrophobicContact CG-CD1 4.16Å; Y753-Y795 HydrophobicContact CG-CG 4.4Å
754	T	92.7	Very high	87.2	Confident	97 Å²	97	76.1 Å²	76.1	60%	0.595	38%	0.375	S	S	*	.			trans	-130.5	114.5	178.1	-55.1	0	0	0	0	107.7
755	G	87.4	Confident	88.7	Confident	20 Å²	20	76.7 Å²	76.7	21%	0.206	38%	0.375	C	S	.	.			trans	-62.4	142.3	-179.7	0	0	0	0	0	112.3	E760 S762	G755-E760 VanDerWaalsContact CA-CB 3.44Å; G755-S762 PolarHBondContact N-OG 3.07Å
756	R	78.1	Confident	88.7	Confident	221 Å²	221	77.2 Å²	77.2	83%	0.834	39%	0.392	S	S	*	.	S	Bend	trans	-98.6	-19	-177.2	-57.6	179.5	179.2	-178.1	0.4	112.6	E760	R756-E760 WeakPolarHBondContact CB-OE2 3.44Å; R756-E760 PolarHBondContact N-OE2 3.3Å
757	S	83.4	Confident	88.8	Confident	48 Å²	48	73.5 Å²	73.5	34%	0.336	38%	0.378	S	S	.	.	S	Bend	trans	-124.6	163.9	171.7	73	0	0	0	0	111.4	R759 E760	S757-R759 PolarHBondContact O-N 3.42Å; S757-R759 VanDerWaalsContact O-N 3.07Å; S757-E760 WeakPolarHBondContact CB-OE1 3.4Å; S757-E760 PolarHBondContact N-OE1 3.05Å; S757-E760 PolarHBondContact O-N 2.92Å; S757-E760 PolarHBondContact OG-OE1 2.74Å
758	P	74	Confident	88.8	Confident	145 Å²	145	76.5 Å²	76.5	94%	0.942	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.4	177	-23.1	34.8	0	0	0	115.1
759	R	83.8	Confident	88.8	Confident	193 Å²	193	73.3 Å²	73.3	73%	0.728	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-10.9	175.5	-67.9	-172.6	177	-161.3	-1.3	113.3	S757 G789 L790	S757-R759 PolarHBondContact O-N 3.42Å; S757-R759 VanDerWaalsContact O-N 3.07Å; R759-G789 WeakPolarHBondContact O-CA 3.44Å; R759-L790 HydrophobicContact CB-CD1 4.37Å; R759-L790 PolarHBondContact O-N 2.84Å
760	E	92.6	Very high	88.7	Confident	35 Å²	35	74.8 Å²	74.8	16%	0.164	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-96.5	118.1	-176.2	-69.5	159.1	-118.1	0	0	110.8	Y753 G755 R756 S757 S762 W779	Y753-E760 HydrophobicContact CE1-CB 4.41Å; Y753-E760 PolarHBondContact OH-OE2 2.96Å; G755-E760 VanDerWaalsContact CA-CB 3.44Å; R756-E760 WeakPolarHBondContact CB-OE2 3.44Å; R756-E760 PolarHBondContact N-OE2 3.3Å; S757-E760 WeakPolarHBondContact CB-OE1 3.4Å; S757-E760 PolarHBondContact N-OE1 3.05Å; S757-E760 PolarHBondContact O-N 2.92Å; S757-E760 PolarHBondContact OG-OE1 2.74Å; E760-S762 PolarHBondContact O-N 3.47Å; E760-W779 HydrophobicContact CB-CZ3 4.48Å; E760-W779 HydrophobicContact CG-CH2 3.76Å; E760-W779 HydrophobicContact CG-CZ3 3.8Å
761	L	90.8	Very high	88.8	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.068	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-72.6	124.6	-177.8	-70	176.3	0	0	0	111	Y753 F763 G782 H784 V787 L790 I791	Y753-L761 VanDerWaalsContact CD1-O 3.31Å; Y753-L761 WeakPolarHBondContact CD1-O 3.48Å; L761-F763 WeakPolarHBondContact O-CD1 3.41Å; L761-F763 WeakPolarHBondContact O-CE1 3.31Å; L761-G782 WeakPolarHBondContact CD1-O 3.15Å; L761-H784 HydrophobicContact CB-CB 4.46Å; L761-H784 HydrophobicContact CD1-CB 4.03Å; L761-V787 WeakPolarHBondContact CD1-O 3.47Å; L761-V787 HydrophobicContact CD2-CB 3.96Å; L761-V787 HydrophobicContact CD2-CG1 3.81Å; L761-V787 WeakPolarHBondContact CD2-O 3.16Å; L761-L790 PolarHBondContact N-O 3.03Å; L761-I791 HydrophobicContact CB-CG1 4.25Å; L761-I791 HydrophobicContact CD1-CD1 3.89Å; L761-I791 HydrophobicContact CD1-CG1 3.73Å; L761-I791 HydrophobicContact CG-CG1 4.48Å
762	S	92.6	Very high	88.7	Confident	61 Å²	61	68.5 Å²	68.5	43%	0.427	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-86.5	131.1	174	-61.5	0	0	0	0	110.8	G755 E760 H784	G755-S762 PolarHBondContact N-OG 3.07Å; E760-S762 PolarHBondContact O-N 3.47Å; S762-H784 PolarHBondContact O-CE1 3.36Å; S762-H784 PolarHBondContact O-ND1 3.29Å
763	F	93.9	Very high	88.3	Confident	5 Å²	5	69.3 Å²	69.3	2%	0.022	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-147.7	164.9	-176.8	52.2	-99.8	0	0	0	113.1	A749 Y753 L761 A767 L769 H784 I791 P792 I796	A749-F763 HydrophobicContact CB-CD2 3.48Å; A749-F763 VanDerWaalsContact CB-CD2 3.48Å; A749-F763 HydrophobicContact CB-CE2 3.81Å; A749-F763 HydrophobicContact CB-CG 4.49Å; Y753-F763 HydrophobicContact CD1-CD1 4.35Å; Y753-F763 AromaticContact CD1-CE1 3.79Å; Y753-F763 HydrophobicContact CD1-CE1 3.79Å; Y753-F763 HydrophobicContact CD1-CZ 4.02Å; Y753-F763 HydrophobicContact CG-CE1 4.26Å; Y753-F763 HydrophobicContact CG-CE2 4.42Å; Y753-F763 HydrophobicContact CG-CZ 4.03Å; Y753-F763 PolarHBondContact N-O 3.39Å; Y753-F763 PolarHBondContact O-N 2.73Å; L761-F763 WeakPolarHBondContact O-CD1 3.41Å; L761-F763 WeakPolarHBondContact O-CE1 3.31Å; F763-A767 HydrophobicContact CB-CB 4.37Å; F763-L769 HydrophobicContact CB-CD2 4.07Å; F763-L769 HydrophobicContact CD1-CD1 4.18Å; F763-L769 HydrophobicContact CD1-CD2 4.06Å; F763-L769 HydrophobicContact CD2-CD1 4.07Å; F763-L769 HydrophobicContact CE1-CD1 4.18Å; F763-L769 HydrophobicContact CE2-CD1 4.05Å; F763-L769 HydrophobicContact CG-CD1 4.12Å; F763-L769 HydrophobicContact CG-CD2 4.07Å; F763-L769 HydrophobicContact CZ-CD1 4.1Å; F763-H784 VanDerWaalsContact CB-CE1 3.43Å; F763-H784 WeakPolarHBondContact CB-CE1 3.26Å; F763-I791 HydrophobicContact CE1-CB 4.48Å; F763-I791 HydrophobicContact CE1-CG2 3.79Å; F763-I791 HydrophobicContact CZ-CG2 4.02Å; F763-P792 HydrophobicContact CZ-CG 4.32Å; F763-I796 HydrophobicContact CE2-CG2 4.22Å; F763-I796 HydrophobicContact CZ-CG2 4Å
764	K	91.8	Very high	87.9	Confident	124 Å²	124	74 Å²	74	54%	0.539	38%	0.38	S	S	.	.			trans	-110.5	150.5	-179.8	-69.5	-58.7	-170.8	-173	0	110.9	A749 D752 G766 A767	A749-K764 WeakPolarHBondContact CB-O 3.29Å; D752-K764 HydrophobicContact CB-CD 4.36Å; D752-K764 WeakPolarHBondContact OD1-CA 3.36Å; D752-K764 WeakPolarHBondContact OD1-CD 3.47Å; D752-K764 WeakPolarHBondContact OD2-CD 3.42Å; D752-K764 WeakPolarHBondContact OD2-CE 3.31Å; D752-K764 IonicContact OD2-NZ 2.69Å; D752-K764 PolarHBondContact OD2-NZ 3.39Å; K764-G766 PolarHBondContact O-N 2.93Å; K764-A767 VanDerWaalsContact O-CB 3.22Å; K764-A767 WeakPolarHBondContact O-CB 3.47Å; K764-A767 PolarHBondContact O-N 2.98Å
765	K	91.6	Very high	86.9	Confident	133 Å²	133	71.6 Å²	71.6	58%	0.578	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	126.5	174.9	179.1	170.7	-178.4	135.1	0	110.4	A749 K750 D752	A749-K765 CarbonylContact O-C 3.56Å; A749-K765 WeakPolarHBondContact O-CA 3.34Å; K750-K765 VanDerWaalsContact O-CD 3.24Å; K750-K765 WeakPolarHBondContact O-CD 3.45Å; K750-K765 WeakPolarHBondContact O-CE 3.36Å; K750-K765 WeakPolarHBondContact O-CG 3.39Å; K750-K765 PolarHBondContact O-NZ 3.32Å; D752-K765 PolarHBondContact OD1-N 3.33Å
766	G	84.4	Confident	86.3	Confident	56 Å²	56	73.2 Å²	73.2	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	1.5	-175.8	0	0	0	0	0	115.6	A749 K764	A749-G766 PolarHBondContact O-N 2.87Å; K764-G766 PolarHBondContact O-N 2.93Å
767	A	91.1	Very high	85.6	Confident	21 Å²	21	69.6 Å²	69.6	17%	0.174	37%	0.37	C	S	.	.			trans	-67.3	137.3	166.2	0	0	0	0	0	110.7	I748 A749 F763 K764	I748-A767 WeakPolarHBondContact CA-O 3.41Å; A749-A767 HydrophobicContact CB-CB 4.27Å; A749-A767 PolarHBondContact N-O 3.49Å; F763-A767 HydrophobicContact CB-CB 4.37Å; K764-A767 VanDerWaalsContact O-CB 3.22Å; K764-A767 WeakPolarHBondContact O-CB 3.47Å; K764-A767 PolarHBondContact O-N 2.98Å
768	S	91.4	Very high	85.7	Confident	62 Å²	62	72.4 Å²	72.4	43%	0.434	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	144.4	162.3	177.5	0	0	0	0	109.4	E746 A747	E746-S768 PolarHBondContact OE2-OG 3.43Å; E746-S768 VanDerWaalsContact OE2-OG 3.07Å; A747-S768 CarbonylContact O-C 3.57Å; A747-S768 WeakPolarHBondContact O-CA 3.47Å
769	L	92.9	Very high	86.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	125.4	-171.1	-61.7	171.7	0	0	0	106.9	A747 A749 F763 H784 I791 I796	A747-L769 PolarHBondContact N-O 3.32Å; A747-L769 WeakPolarHBondContact O-CB 3.33Å; A747-L769 PolarHBondContact O-N 2.8Å; A749-L769 HydrophobicContact CB-CD1 4.04Å; F763-L769 HydrophobicContact CB-CD2 4.07Å; F763-L769 HydrophobicContact CD1-CD1 4.18Å; F763-L769 HydrophobicContact CD1-CD2 4.06Å; F763-L769 HydrophobicContact CD2-CD1 4.07Å; F763-L769 HydrophobicContact CE1-CD1 4.18Å; F763-L769 HydrophobicContact CE2-CD1 4.05Å; F763-L769 HydrophobicContact CG-CD1 4.12Å; F763-L769 HydrophobicContact CG-CD2 4.07Å; F763-L769 HydrophobicContact CZ-CD1 4.1Å; L769-H784 HydrophobicContact CD2-CB 3.59Å; L769-H784 VanDerWaalsContact CD2-CD2 3.43Å; L769-H784 WeakPolarHBondContact CD2-CD2 3.49Å; L769-I791 HydrophobicContact CB-CD1 4.15Å; L769-I791 HydrophobicContact CD1-CG2 3.96Å; L769-I791 HydrophobicContact CD2-CD1 4.29Å; L769-I796 HydrophobicContact CD1-CB 4.47Å; L769-I796 HydrophobicContact CD1-CG2 3.39Å
770	L	91.4	Very high	86.9	Confident	33 Å²	33	60.7 Å²	60.7	17%	0.173	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.3	177	-166.8	65.8	0	0	0	108.3	Q744 E746 Y772 G782 R783	Q744-L770 HydrophobicContact CB-CD1 3.96Å; Q744-L770 HydrophobicContact CG-CD1 4.4Å; E746-L770 HydrophobicContact CG-CD1 4.09Å; L770-Y772 HydrophobicContact CD2-CE1 3.73Å; L770-Y772 HydrophobicContact CG-CE1 4.07Å; L770-G782 CarbonylContact O-C 3.35Å; L770-G782 WeakPolarHBondContact O-CA 3.38Å; L770-R783 HydrophobicContact CB-CB 4.24Å; L770-R783 PolarHBondContact N-O 3.42Å; L770-R783 PolarHBondContact O-N 3.06Å
771	L	91.6	Very high	86.8	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.1	177.4	-47	-177.6	0	0	0	109.4	I745 A747 W780 I791 I796 V798	I745-L771 HydrophobicContact CB-CB 4.19Å; I745-L771 HydrophobicContact CG2-CB 4.37Å; I745-L771 HydrophobicContact CG2-CD1 4.21Å; I745-L771 PolarHBondContact N-O 2.61Å; I745-L771 WeakPolarHBondContact O-CB 3.43Å; I745-L771 PolarHBondContact O-N 2.87Å; A747-L771 HydrophobicContact CB-CD1 3.67Å; A747-L771 HydrophobicContact CB-CD2 4.23Å; A747-L771 HydrophobicContact CB-CG 3.84Å; L771-W780 HydrophobicContact CB-CD2 4.37Å; L771-W780 HydrophobicContact CB-CE3 3.82Å; L771-W780 HydrophobicContact CB-CZ3 4.33Å; L771-W780 HydrophobicContact CD1-CD2 3.73Å; L771-W780 HydrophobicContact CD1-CE3 3.88Å; L771-W780 HydrophobicContact CD1-CG 4.02Å; L771-W780 HydrophobicContact CD1-CZ3 4.31Å; L771-W780 HydrophobicContact CD2-CB 4Å; L771-W780 HydrophobicContact CD2-CG 4.33Å; L771-W780 HydrophobicContact CG-CE3 4.42Å; L771-I791 HydrophobicContact CD2-CB 4.49Å; L771-I791 HydrophobicContact CD2-CD1 3.95Å; L771-I791 HydrophobicContact CD2-CG2 4.33Å; L771-I796 HydrophobicContact CD1-CD1 3.71Å; L771-I796 HydrophobicContact CD2-CD1 3.87Å; L771-I796 HydrophobicContact CG-CD1 4.42Å; L771-V798 HydrophobicContact CD1-CG2 3.86Å
772	Y	83.6	Confident	86.8	Confident	70 Å²	70	62.5 Å²	62.5	28%	0.275	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-55.6	178.3	-59.5	-50.9	0	0	0	111.2	L770 E781 R783	L770-Y772 HydrophobicContact CD2-CE1 3.73Å; L770-Y772 HydrophobicContact CG-CE1 4.07Å; Y772-E781 PolarHBondContact N-O 3.33Å; Y772-R783 HydrophobicContact CE2-CB 4.01Å; Y772-R783 WeakPolarHBondContact OH-CB 3.35Å; Y772-R783 WeakPolarHBondContact OH-CD 3.28Å; Y772-R783 PolarHBondContact OH-NE 2.89Å; Y772-R783 VanDerWaalsContact OH-NE 3.12Å; Y772-R783 PolarHBondContact OH-NH1 3.05Å
773	H	81.5	Confident	86.7	Confident	98 Å²	98	64.3 Å²	64.3	45%	0.454	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	164.9	177.3	71.6	-82	0	0	0	110.9	A775 E781	H773-A775 PolarHBondContact O-N 2.98Å; H773-E781 IonicContact CE1-OE2 3.93Å; H773-E781 PolarHBondContact CE1-OE2 2.81Å; H773-E781 VanDerWaalsContact CE1-OE2 3.28Å; H773-E781 PolarHBondContact N-O 3.35Å; H773-E781 IonicContact NE2-OE2 3.04Å; H773-E781 PolarHBondContact O-N 3.37Å
774	R	84.2	Confident	86.6	Confident	120 Å²	120	65.3 Å²	65.3	45%	0.453	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	88.1	-173.5	-171.3	169.5	-175.8	169.2	0.3	111.2	S776 E777 W780 H793	R774-S776 WeakPolarHBondContact CG-O 3.38Å; R774-S776 PolarHBondContact NE-O 2.95Å; R774-S776 PolarHBondContact O-N 3.14Å; R774-E777 PolarHBondContact NE-O 3.46Å; R774-E777 PolarHBondContact NH2-O 3.16Å; R774-W780 HydrophobicContact CB-CD2 4.02Å; R774-W780 HydrophobicContact CB-CE3 3.9Å; R774-W780 HydrophobicContact CB-CH2 4.13Å; R774-W780 HydrophobicContact CB-CZ2 4.22Å; R774-W780 HydrophobicContact CB-CZ3 3.96Å; R774-W780 HydrophobicContact CG-CD2 4.19Å; R774-W780 HydrophobicContact CG-CZ2 4.25Å; R774-H793 PolarHBondContact NH2-CD2 2.66Å; R774-H793 PolarHBondContact NH2-NE2 2.9Å
775	A	71.9	Confident	86.3	Confident	46 Å²	46	66.1 Å²	66.1	38%	0.38	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	-24.2	-178.9	0	0	0	0	0	114.4	H773 W779 E781 L790	H773-A775 PolarHBondContact O-N 2.98Å; A775-W779 PolarHBondContact N-O 3.41Å; A775-W779 VanDerWaalsContact N-O 3.14Å; A775-E781 HydrophobicContact CB-CG 3.95Å; A775-L790 HydrophobicContact CB-CD2 4.11Å
776	S	75.9	Confident	85.7	Confident	53 Å²	53	62.7 Å²	62.7	37%	0.371	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	176.3	165.6	61.2	0	0	0	0	111.9	R774 D778 W779	R774-S776 WeakPolarHBondContact CG-O 3.38Å; R774-S776 PolarHBondContact NE-O 2.95Å; R774-S776 PolarHBondContact O-N 3.14Å; S776-D778 PolarHBondContact O-N 3.33Å; S776-W779 PolarHBondContact N-O 3.08Å; S776-W779 PolarHBondContact O-N 2.82Å; S776-W779 WeakPolarHBondContact OG-CB 3.44Å; S776-W779 PolarHBondContact OG-N 3Å
777	E	63.4	Low	85.6	Confident	146 Å²	146	64.3 Å²	64.3	68%	0.682	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-39.3	176.3	-70.2	176.4	-160.2	0	0	112.8	R774	R774-E777 PolarHBondContact NE-O 3.46Å; R774-E777 PolarHBondContact NH2-O 3.16Å
778	D	84.5	Confident	85.6	Confident	107 Å²	107	67.3 Å²	67.3	57%	0.572	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-12.6	-178.5	-77.5	-46.5	0	0	0	114.7	S776 P792 H793	S776-D778 PolarHBondContact O-N 3.33Å; D778-P792 CarbonylContact O-C 3.57Å; D778-P792 WeakPolarHBondContact O-CA 3.47Å; D778-H793 WeakPolarHBondContact O-CB 3.31Å; D778-H793 PolarHBondContact O-N 3.24Å
779	W	90.9	Very high	85.5	Confident	67 Å²	67	65 Å²	65	25%	0.254	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138.8	-170	-57.1	86.7	0	0	0	113.8	Y753 E760 A775 S776 L790 P792	Y753-W779 HydrophobicContact CE1-CZ3 4.49Å; Y753-W779 VanDerWaalsContact OH-CH2 3.32Å; Y753-W779 WeakPolarHBondContact OH-CH2 3.37Å; E760-W779 HydrophobicContact CB-CZ3 4.48Å; E760-W779 HydrophobicContact CG-CH2 3.76Å; E760-W779 HydrophobicContact CG-CZ3 3.8Å; A775-W779 PolarHBondContact N-O 3.41Å; A775-W779 VanDerWaalsContact N-O 3.14Å; S776-W779 PolarHBondContact N-O 3.08Å; S776-W779 PolarHBondContact O-N 2.82Å; S776-W779 WeakPolarHBondContact OG-CB 3.44Å; S776-W779 PolarHBondContact OG-N 3Å; W779-L790 HydrophobicContact CB-CD2 4.35Å; W779-L790 HydrophobicContact CD2-CB 4.49Å; W779-L790 HydrophobicContact CE3-CB 3.74Å; W779-L790 HydrophobicContact CZ3-CB 4.15Å; W779-P792 HydrophobicContact CD2-CB 4.22Å; W779-P792 HydrophobicContact CE3-CB 3.74Å; W779-P792 HydrophobicContact CE3-CG 4.24Å; W779-P792 HydrophobicContact CH2-CB 4.25Å; W779-P792 HydrophobicContact CH2-CG 4.49Å; W779-P792 HydrophobicContact CZ3-CB 3.77Å; W779-P792 HydrophobicContact CZ3-CG 3.9Å
780	W	92.4	Very high	85.5	Confident	25 Å²	25	67 Å²	67	10%	0.095	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	147.2	169	-68	78.1	0	0	0	110.2	I745 L771 R774 L790 I791 H793 V798	I745-W780 HydrophobicContact CD1-CH2 4.47Å; I745-W780 HydrophobicContact CD1-CZ3 4.23Å; L771-W780 HydrophobicContact CB-CD2 4.37Å; L771-W780 HydrophobicContact CB-CE3 3.82Å; L771-W780 HydrophobicContact CB-CZ3 4.33Å; L771-W780 HydrophobicContact CD1-CD2 3.73Å; L771-W780 HydrophobicContact CD1-CE3 3.88Å; L771-W780 HydrophobicContact CD1-CG 4.02Å; L771-W780 HydrophobicContact CD1-CZ3 4.31Å; L771-W780 HydrophobicContact CD2-CB 4Å; L771-W780 HydrophobicContact CD2-CG 4.33Å; L771-W780 HydrophobicContact CG-CE3 4.42Å; R774-W780 HydrophobicContact CB-CD2 4.02Å; R774-W780 HydrophobicContact CB-CE3 3.9Å; R774-W780 HydrophobicContact CB-CH2 4.13Å; R774-W780 HydrophobicContact CB-CZ2 4.22Å; R774-W780 HydrophobicContact CB-CZ3 3.96Å; R774-W780 HydrophobicContact CG-CD2 4.19Å; R774-W780 HydrophobicContact CG-CZ2 4.25Å; W780-L790 CarbonylContact O-C 3.59Å; W780-L790 WeakPolarHBondContact O-CA 3.27Å; W780-I791 PolarHBondContact N-O 3.45Å; W780-I791 PolarHBondContact O-N 3.47Å; W780-H793 AromaticContact CD1-CG 3.97Å; W780-H793 AromaticContact CD1-ND1 3.85Å; W780-H793 AromaticContact NE1-CE1 3.79Å; W780-H793 AromaticContact NE1-CG 3.44Å; W780-H793 AromaticContact NE1-ND1 3.09Å; W780-H793 PolarHBondContact NE1-ND1 3.47Å; W780-V798 HydrophobicContact CZ2-CG2 4.3Å
781	E	90.7	Very high	85.5	Confident	84 Å²	84	65.4 Å²	65.4	39%	0.393	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.8	157.3	-83.9	-176.1	-164.5	0	0	109.1	Y772 H773 A775 L790	Y772-E781 PolarHBondContact N-O 3.33Å; H773-E781 IonicContact CE1-OE2 3.93Å; H773-E781 PolarHBondContact CE1-OE2 2.81Å; H773-E781 VanDerWaalsContact CE1-OE2 3.28Å; H773-E781 PolarHBondContact N-O 3.35Å; H773-E781 IonicContact NE2-OE2 3.04Å; H773-E781 PolarHBondContact O-N 3.37Å; A775-E781 HydrophobicContact CB-CG 3.95Å; E781-L790 HydrophobicContact CG-CD2 3.73Å
782	G	91.5	Very high	85.6	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	-175.9	-171.9	0	0	0	0	0	112.5	L761 L770 D788 G789	L761-G782 WeakPolarHBondContact CD1-O 3.15Å; L770-G782 CarbonylContact O-C 3.35Å; L770-G782 WeakPolarHBondContact O-CA 3.38Å; G782-D788 CarbonylContact O-C 3.19Å; G782-D788 WeakPolarHBondContact O-CA 3.35Å; G782-G789 PolarHBondContact N-O 3.43Å; G782-G789 PolarHBondContact O-N 3.15Å; G782-G789 VanDerWaalsContact O-O 3.1Å
783	R	90.8	Very high	86	Confident	100 Å²	100	65 Å²	65	38%	0.377	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.9	-173.5	-174.1	171.5	-77.8	165.4	5.3	111.8	L770 Y772 V787 D788	L770-R783 HydrophobicContact CB-CB 4.24Å; L770-R783 PolarHBondContact N-O 3.42Å; L770-R783 PolarHBondContact O-N 3.06Å; Y772-R783 HydrophobicContact CE2-CB 4.01Å; Y772-R783 WeakPolarHBondContact OH-CB 3.35Å; Y772-R783 WeakPolarHBondContact OH-CD 3.28Å; Y772-R783 PolarHBondContact OH-NE 2.89Å; Y772-R783 VanDerWaalsContact OH-NE 3.12Å; Y772-R783 PolarHBondContact OH-NH1 3.05Å; R783-V787 WeakPolarHBondContact CA-O 3.39Å; R783-D788 VanDerWaalsContact CB-OD1 3.29Å; R783-D788 WeakPolarHBondContact CB-OD1 3.5Å; R783-D788 WeakPolarHBondContact CG-OD1 3.24Å; R783-D788 IonicContact CZ-OD1 2.72Å; R783-D788 VanDerWaalsContact CZ-OD1 3.31Å; R783-D788 IonicContact CZ-OD2 2.67Å; R783-D788 IonicContact NE-OD1 3.28Å; R783-D788 PolarHBondContact NE-OD1 3.36Å; R783-D788 IonicContact NE-OD2 2.67Å; R783-D788 VanDerWaalsContact NH2-CG 3.34Å; R783-D788 IonicContact NH2-OD1 3.72Å; R783-D788 PolarHBondContact NH2-OD1 3.02Å; R783-D788 VanDerWaalsContact NH2-OD1 3.15Å; R783-D788 IonicContact NH2-OD2 2.77Å; R783-D788 PolarHBondContact NH2-OD2 3.27Å
784	H	91.8	Very high	86.4	Confident	25 Å²	25	67 Å²	67	12%	0.116	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125	170.4	178.7	-128.4	0	0	0	109.6	L761 S762 F763 L769 G786 V787	L761-H784 HydrophobicContact CB-CB 4.46Å; L761-H784 HydrophobicContact CD1-CB 4.03Å; S762-H784 PolarHBondContact O-CE1 3.36Å; S762-H784 PolarHBondContact O-ND1 3.29Å; F763-H784 VanDerWaalsContact CB-CE1 3.43Å; F763-H784 WeakPolarHBondContact CB-CE1 3.26Å; L769-H784 HydrophobicContact CD2-CB 3.59Å; L769-H784 VanDerWaalsContact CD2-CD2 3.43Å; L769-H784 WeakPolarHBondContact CD2-CD2 3.49Å; H784-G786 PolarHBondContact O-N 3.17Å; H784-G786 VanDerWaalsContact O-N 3.13Å; H784-V787 PolarHBondContact N-O 2.84Å; H784-V787 PolarHBondContact O-N 3.23Å
785	N	84.8	Confident	86.8	Confident	142 Å²	142	65.5 Å²	65.5	76%	0.759	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	35.3	-178.4	-60.3	-42.2	0	0	0	114.8
786	G	79.4	Confident	87.7	Confident	61 Å²	61	63.7 Å²	63.7	63%	0.629	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	5.9	179.6	0	0	0	0	0	115.6	H784	H784-G786 PolarHBondContact O-N 3.17Å; H784-G786 VanDerWaalsContact O-N 3.13Å
787	V	82.8	Confident	88.4	Confident	89 Å²	89	64.8 Å²	64.8	54%	0.539	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.4	172.8	-171.7	0	0	0	0	109.2	L761 R783 H784	L761-V787 WeakPolarHBondContact CD1-O 3.47Å; L761-V787 HydrophobicContact CD2-CB 3.96Å; L761-V787 HydrophobicContact CD2-CG1 3.81Å; L761-V787 WeakPolarHBondContact CD2-O 3.16Å; R783-V787 WeakPolarHBondContact CA-O 3.39Å; H784-V787 PolarHBondContact N-O 2.84Å; H784-V787 PolarHBondContact O-N 3.23Å
788	D	90.4	Very high	89.5	Confident	84 Å²	84	59.5 Å²	59.5	45%	0.449	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	148.6	177.4	-62.6	-41.3	0	0	0	112.1	G782 R783	G782-D788 CarbonylContact O-C 3.19Å; G782-D788 WeakPolarHBondContact O-CA 3.35Å; R783-D788 VanDerWaalsContact CB-OD1 3.29Å; R783-D788 WeakPolarHBondContact CB-OD1 3.5Å; R783-D788 WeakPolarHBondContact CG-OD1 3.24Å; R783-D788 IonicContact CZ-OD1 2.72Å; R783-D788 VanDerWaalsContact CZ-OD1 3.31Å; R783-D788 IonicContact CZ-OD2 2.67Å; R783-D788 IonicContact NE-OD1 3.28Å; R783-D788 PolarHBondContact NE-OD1 3.36Å; R783-D788 IonicContact NE-OD2 2.67Å; R783-D788 VanDerWaalsContact NH2-CG 3.34Å; R783-D788 IonicContact NH2-OD1 3.72Å; R783-D788 PolarHBondContact NH2-OD1 3.02Å; R783-D788 VanDerWaalsContact NH2-OD1 3.15Å; R783-D788 IonicContact NH2-OD2 2.77Å; R783-D788 PolarHBondContact NH2-OD2 3.27Å
789	G	88.9	Confident	89	Confident	15 Å²	15	59.3 Å²	59.3	16%	0.155	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.7	-165.9	175.4	0	0	0	0	0	113.8	R759 G782	R759-G789 WeakPolarHBondContact O-CA 3.44Å; G782-G789 PolarHBondContact N-O 3.43Å; G782-G789 PolarHBondContact O-N 3.15Å; G782-G789 VanDerWaalsContact O-O 3.1Å
790	L	92.2	Very high	87.4	Confident	41 Å²	41	62.3 Å²	62.3	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128	-174.4	-64	172.2	0	0	0	111.7	R759 L761 A775 W779 W780 E781	R759-L790 HydrophobicContact CB-CD1 4.37Å; R759-L790 PolarHBondContact O-N 2.84Å; L761-L790 PolarHBondContact N-O 3.03Å; A775-L790 HydrophobicContact CB-CD2 4.11Å; W779-L790 HydrophobicContact CB-CD2 4.35Å; W779-L790 HydrophobicContact CD2-CB 4.49Å; W779-L790 HydrophobicContact CE3-CB 3.74Å; W779-L790 HydrophobicContact CZ3-CB 4.15Å; W780-L790 CarbonylContact O-C 3.59Å; W780-L790 WeakPolarHBondContact O-CA 3.27Å; E781-L790 HydrophobicContact CG-CD2 3.73Å
791	I	93.1	Very high	85.3	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.3	-179.8	-59.1	-178	0	0	0	107.8	L761 F763 L769 L771 W780 H793 I796	L761-I791 HydrophobicContact CB-CG1 4.25Å; L761-I791 HydrophobicContact CD1-CD1 3.89Å; L761-I791 HydrophobicContact CD1-CG1 3.73Å; L761-I791 HydrophobicContact CG-CG1 4.48Å; F763-I791 HydrophobicContact CE1-CB 4.48Å; F763-I791 HydrophobicContact CE1-CG2 3.79Å; F763-I791 HydrophobicContact CZ-CG2 4.02Å; L769-I791 HydrophobicContact CB-CD1 4.15Å; L769-I791 HydrophobicContact CD1-CG2 3.96Å; L769-I791 HydrophobicContact CD2-CD1 4.29Å; L771-I791 HydrophobicContact CD2-CB 4.49Å; L771-I791 HydrophobicContact CD2-CD1 3.95Å; L771-I791 HydrophobicContact CD2-CG2 4.33Å; W780-I791 PolarHBondContact N-O 3.45Å; W780-I791 PolarHBondContact O-N 3.47Å; I791-H793 PolarHBondContact O-N 3Å; I791-I796 HydrophobicContact CG2-CD1 4Å; I791-I796 HydrophobicContact CG2-CG2 3.61Å
792	P	92.8	Very high	82.8	Confident	8 Å²	8	69.8 Å²	69.8	5%	0.052	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	121.9	-176.3	24.6	-29	0	0	0	111.1	Y753 F763 D778 W779 Q794 Y795	Y753-P792 HydrophobicContact CD1-CG 3.79Å; Y753-P792 HydrophobicContact CD2-CG 3.85Å; Y753-P792 HydrophobicContact CE1-CG 3.7Å; Y753-P792 HydrophobicContact CE2-CG 3.77Å; Y753-P792 HydrophobicContact CG-CG 3.87Å; F763-P792 HydrophobicContact CZ-CG 4.32Å; D778-P792 CarbonylContact O-C 3.57Å; D778-P792 WeakPolarHBondContact O-CA 3.47Å; W779-P792 HydrophobicContact CD2-CB 4.22Å; W779-P792 HydrophobicContact CE3-CB 3.74Å; W779-P792 HydrophobicContact CE3-CG 4.24Å; W779-P792 HydrophobicContact CH2-CB 4.25Å; W779-P792 HydrophobicContact CH2-CG 4.49Å; W779-P792 HydrophobicContact CZ3-CB 3.77Å; W779-P792 HydrophobicContact CZ3-CG 3.9Å; P792-Q794 VanDerWaalsContact C-N 3.25Å; P792-Q794 PolarHBondContact O-N 2.95Å; P792-Y795 HydrophobicContact CB-CD2 4Å; P792-Y795 HydrophobicContact CG-CD2 3.89Å; P792-Y795 HydrophobicContact CG-CG 4.13Å; P792-Y795 PolarHBondContact O-N 3.45Å
793	H	92.7	Very high	80.2	Confident	53 Å²	53	76.2 Å²	76.2	25%	0.245	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-54.5	-39	-174.1	-177.3	39.5	0	0	0	112.8	R774 D778 W780 I791 Y795 I796	R774-H793 PolarHBondContact NH2-CD2 2.66Å; R774-H793 PolarHBondContact NH2-NE2 2.9Å; D778-H793 WeakPolarHBondContact O-CB 3.31Å; D778-H793 PolarHBondContact O-N 3.24Å; W780-H793 AromaticContact CD1-CG 3.97Å; W780-H793 AromaticContact CD1-ND1 3.85Å; W780-H793 AromaticContact NE1-CE1 3.79Å; W780-H793 AromaticContact NE1-CG 3.44Å; W780-H793 AromaticContact NE1-ND1 3.09Å; W780-H793 PolarHBondContact NE1-ND1 3.47Å; I791-H793 PolarHBondContact O-N 3Å; H793-Y795 PolarHBondContact O-N 2.87Å; H793-Y795 VanDerWaalsContact O-N 3.15Å; H793-I796 VanDerWaalsContact O-CG1 3.27Å; H793-I796 WeakPolarHBondContact O-CG1 3.48Å; H793-I796 PolarHBondContact O-N 3.48Å
794	Q	89.8	Confident	77.4	Confident	141 Å²	141	75.6 Å²	75.6	66%	0.659	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-67.5	-13.8	-179.3	-160.8	63.4	7.4	0	0	114	P792	P792-Q794 VanDerWaalsContact C-N 3.25Å; P792-Q794 PolarHBondContact O-N 2.95Å
795	Y	91.2	Very high	74.6	Confident	87 Å²	87	83.9 Å²	83.9	34%	0.341	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-99.5	-1	-179.7	-74.2	-108.1	0	0	0	113.5	A749 K750 F751 Y753 P792 H793	A749-Y795 CarbonylContact C-O 3.5Å; K750-Y795 WeakPolarHBondContact CB-O 3.24Å; K750-Y795 PolarHBondContact N-O 3.3Å; F751-Y795 HydrophobicContact CB-CD1 3.84Å; F751-Y795 HydrophobicContact CB-CE1 4.33Å; F751-Y795 PolarHBondContact N-O 3.18Å; Y753-Y795 AromaticContact CD2-CD1 3.72Å; Y753-Y795 HydrophobicContact CD2-CD1 3.72Å; Y753-Y795 HydrophobicContact CD2-CD2 4.27Å; Y753-Y795 AromaticContact CD2-CE1 3.74Å; Y753-Y795 HydrophobicContact CD2-CE1 3.74Å; Y753-Y795 HydrophobicContact CD2-CE2 4.29Å; Y753-Y795 HydrophobicContact CD2-CG 4.02Å; Y753-Y795 HydrophobicContact CG-CD1 4.16Å; Y753-Y795 HydrophobicContact CG-CG 4.4Å; P792-Y795 HydrophobicContact CB-CD2 4Å; P792-Y795 HydrophobicContact CG-CD2 3.89Å; P792-Y795 HydrophobicContact CG-CG 4.13Å; P792-Y795 PolarHBondContact O-N 3.45Å; H793-Y795 PolarHBondContact O-N 2.87Å; H793-Y795 VanDerWaalsContact O-N 3.15Å
796	I	92.6	Very high	71.9	Confident	9 Å²	9	82 Å²	82	5%	0.046	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	170.6	-176.1	66.6	175.6	0	0	0	111.6	A747 I748 F763 L769 L771 I791 H793	A747-I796 HydrophobicContact CB-CB 4.45Å; A747-I796 HydrophobicContact CB-CD1 4.1Å; I748-I796 CarbonylContact O-C 3.58Å; I748-I796 WeakPolarHBondContact O-CA 3.4Å; F763-I796 HydrophobicContact CE2-CG2 4.22Å; F763-I796 HydrophobicContact CZ-CG2 4Å; L769-I796 HydrophobicContact CD1-CB 4.47Å; L769-I796 HydrophobicContact CD1-CG2 3.39Å; L771-I796 HydrophobicContact CD1-CD1 3.71Å; L771-I796 HydrophobicContact CD2-CD1 3.87Å; L771-I796 HydrophobicContact CG-CD1 4.42Å; I791-I796 HydrophobicContact CG2-CD1 4Å; I791-I796 HydrophobicContact CG2-CG2 3.61Å; H793-I796 VanDerWaalsContact O-CG1 3.27Å; H793-I796 WeakPolarHBondContact O-CG1 3.48Å; H793-I796 PolarHBondContact O-N 3.48Å
797	V	90.3	Very high	69.5	Low	75 Å²	75	84.4 Å²	84.4	46%	0.455	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121	164.9	-179.9	0	0	0	0	106.4	A747 I748 K750	A747-V797 CarbonylContact C-O 3.34Å; A747-V797 WeakPolarHBondContact CA-O 3.4Å; A747-V797 WeakPolarHBondContact CB-O 3.12Å; I748-V797 PolarHBondContact N-O 3.24Å; I748-V797 PolarHBondContact O-N 2.63Å; K750-V797 HydrophobicContact CB-CG2 4.21Å; K750-V797 HydrophobicContact CD-CG2 3.94Å; K750-V797 HydrophobicContact CG-CG2 4.25Å
798	V	86.4	Confident	66.8	Low	36 Å²	36	87.5 Å²	87.5	22%	0.218	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	141.8	172.5	177	0	0	0	0	108.9	I745 L771 W780	I745-V798 HydrophobicContact CG2-CG1 3.46Å; I745-V798 VanDerWaalsContact CG2-CG1 3.46Å; L771-V798 HydrophobicContact CD1-CG2 3.86Å; W780-V798 HydrophobicContact CZ2-CG2 4.3Å
799	Q	73.9	Confident	63.8	Low	102 Å²	102	91.5 Å²	91.5	48%	0.477	49%	0.49	S	S	.	.			trans	-100.5	111.7	166.6	-61.8	-168.7	-57.8	0	0	108.1	E746	E746-Q799 PolarHBondContact O-N 3.3Å
800	D	56.6	Low	60.9	Low	130 Å²	130	95.7 Å²	95.7	70%	0.695	52%	0.518	S	S	*	.			trans	-73.6	137.8	176.8	-56.1	-48.5	0	0	0	109.6	D802	D800-D802 PolarHBondContact O-N 2.93Å; D800-D802 VanDerWaalsContact O-N 3.17Å
801	L	47.7	Very low	57.9	Low	104 Å²	104	101.3 Å²	101.3	55%	0.545	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-69.1	-13.7	-168.2	-90.8	162.4	0	0	0	115.1	E743 D803	E743-L801 HydrophobicContact CB-CD1 4.34Å; E743-L801 HydrophobicContact CG-CD1 4.37Å; E743-L801 WeakPolarHBondContact OE1-CD1 3.31Å; L801-D803 VanDerWaalsContact C-N 3.35Å; L801-D803 PolarHBondContact O-N 3.44Å
802	D	38.6	Very low	54.8	Low	162 Å²	162	110.2 Å²	110.2	87%	0.866	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-73.6	-16.3	-177.6	-86.2	-38.6	0	0	0	114.8	D800 A804	D800-D802 PolarHBondContact O-N 2.93Å; D800-D802 VanDerWaalsContact O-N 3.17Å; D802-A804 PolarHBondContact O-N 2.74Å; D802-A804 VanDerWaalsContact O-N 3.16Å
803	D	37.4	Very low	51.7	Low	136 Å²	136	113.5 Å²	113.5	73%	0.727	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-75.4	-1.5	-177.5	-119.5	-6.7	0	0	0	113.6	L801 F805 S806	L801-D803 VanDerWaalsContact C-N 3.35Å; L801-D803 PolarHBondContact O-N 3.44Å; D803-F805 PolarHBondContact O-N 2.86Å; D803-S806 PolarHBondContact O-N 3.3Å
804	A	32.7	Very low	48.6	Very low	87 Å²	87	118.1 Å²	118.1	72%	0.719	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-64.1	0.1	180	0	0	0	0	0	115.2	D802	D802-A804 PolarHBondContact O-N 2.74Å; D802-A804 VanDerWaalsContact O-N 3.16Å
805	F	31.7	Very low	45.6	Very low	200 Å²	200	117.5 Å²	117.5	88%	0.877	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-127.9	23.6	177	-105	-73.6	0	0	0	115.4	D803	D803-F805 PolarHBondContact O-N 2.86Å
806	S	29.5	Very low	42.6	Very low	101 Å²	101	122.5 Å²	122.5	71%	0.706	67%	0.674	S	S	*	*	S	Bend	trans	-142.2	41.8	175.3	-81.7	0	0	0	0	118.3	D803	D803-S806 PolarHBondContact O-N 3.3Å
807	D	28.3	Very low	39.4	Very low	113 Å²	113	126.7 Å²	126.7	60%	0.604	71%	0.71	S	S	*	*			trans	-150.1	117.1	144	-156.3	-2.9	0	0	0	114.5
808	N	26.2	Very low	36.3	Very low	153 Å²	153	128 Å²	128	82%	0.818	72%	0.722	S	S	*	*	S	Bend	trans	-170.8	38.4	137	-109.7	-77	0	0	0	114.8
809	L	26.8	Very low	33.4	Very low	168 Å²	168	131.7 Å²	131.7	88%	0.88	75%	0.749	S	S	*	*	S	Bend	trans	-170.9	129.2	145.2	-127.5	66.5	0	0	0	108.8
810	S	27.9	Very low	30.9	Very low	104 Å²	104	130.3 Å²	130.3	73%	0.727	76%	0.763	S	S	*	*			cis	-143.4	137.6	12.8	56.6	0	0	0	0	112.7
811	Q	29.8	Very low	29.8	Very low	158 Å²	158	129.7 Å²	129.7	74%	0.738	77%	0.766	S	S	*	*			trans	-72.9	158.9	179	-62.3	-175	-13.3	0	0	114.7
812	K	28.2	Very low	28.7	Very low	187 Å²	187	132 Å²	132	81%	0.813	78%	0.778	S	S	*	*			trans	82	98.9	158.4	-68.8	-175.8	-179.7	178.6	0	119.7
813	A	28.3	Very low	27.9	Very low	77 Å²	77	131.5 Å²	131.5	64%	0.636	77%	0.774	S	S	*	*				96.4	132.2	110.1	0	0	0	0	0	119.1
814	D	25.9	Very low	27.2	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	78%	0.781	S	S	*	*			trans	53.5	98.8	148.9	-48	-19.2	0	0	0	118.9
815	S	27.3	Very low	26.9	Very low	127 Å²	127	132.9 Å²	132.9	89%	0.888	78%	0.779	S	S	*	*				-173.6	160.8	113.1	-79.6	0	0	0	0	113
816	E	27.9	Very low	26.5	Very low	193 Å²	193	128.7 Å²	128.7	90%	0.902	78%	0.775	S	S	*	*			trans	-78.7	161.3	-178.6	-55.7	175.1	112.3	0	0	113.9
817	A	26.9	Very low	26.3	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	78%	0.778	S	S	*	*			trans	110.2	140.9	136.8	0	0	0	0	0	121.2
818	S	24.5	Very low	26.2	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	78%	0.784	S	S	*	*			trans	80.9	99.7	139.2	-169.6	0	0	0	0	122.3
819	S	25.8	Very low	26.1	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	78%	0.784	S	S	*	*				61	102.5	118.9	-32.8	0	0	0	0	121.5
820	G	22.1	Very low	25.9	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	77%	0.771	S	S	*	*			trans	81.5	-170.9	139.4	0	0	0	0	0	118.2
821	P	33.3	Very low	25.9	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	77%	0.774	S	S	*	*				-136.3	161.8	-72.2	38.7	-28	0	0	0	115.7
822	L	22.7	Very low	25.9	Very low	153 Å²	153	129.7 Å²	129.7	80%	0.801	78%	0.775	S	S	*	*			trans	71.9	139.3	151.2	-90.2	167.2	0	0	0	120.7
823	L	23.6	Very low	25.7	Very low	151 Å²	151	126.7 Å²	126.7	79%	0.791	78%	0.778	S	S	*	*			trans	69.9	149.1	166.1	-54.9	168.9	0	0	0	115
824	E	22.6	Very low	26	Very low	187 Å²	187	128 Å²	128	87%	0.874	78%	0.78	S	S	*	*			cis	-148.8	164.5	14	-133.2	165.8	-147.6	0	0	108.3
825	G	24.7	Very low	25.9	Very low	66 Å²	66	126.4 Å²	126.4	68%	0.68	78%	0.779	S	S	*	*			cis	168.2	174.7	-6.1	0	0	0	0	0	114.3
826	S	23.5	Very low	25.8	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	78%	0.78	S	S	*	*			trans	47.2	118.8	155	-166.2	0	0	0	0	123.1
827	S	25.6	Very low	25.6	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	78%	0.778	S	S	*	*				161.5	119.5	109.9	-65	0	0	0	0	109.3
828	K	25.8	Very low	26	Very low	169 Å²	169	129.9 Å²	129.9	74%	0.735	77%	0.774	S	S	*	*			cis	88.5	107.4	39.6	-153.1	-167.2	-171.9	-158.1	0	115
829	N	24.7	Very low	26	Very low	152 Å²	152	129 Å²	129	81%	0.813	77%	0.774	S	S	*	*			trans	175.2	129.9	149.7	-81.6	-22	0	0	0	105.5
830	D	23.8	Very low	25.9	Very low	113 Å²	113	130.2 Å²	130.2	60%	0.604	77%	0.771	S	S	*	*			cis	80.3	95.2	43.4	-68.3	-48.9	0	0	0	114.9
831	I	26.2	Very low	26	Very low	156 Å²	156	136 Å²	136	80%	0.8	77%	0.772	S	S	*	*				42.8	133.9	125.4	-67.6	171.7	0	0	0	118.1
832	P	30.9	Very low	25.6	Very low	118 Å²	118	136.9 Å²	136.9	77%	0.766	77%	0.77	S	S	*	*			cis	-142	-177.7	34.6	37.3	-16.6	0	0	0	117.4
833	S	22.9	Very low	25.6	Very low	123 Å²	123	139 Å²	139	86%	0.86	77%	0.773	S	S	*	*			trans	-150.5	126.9	152.8	-162.1	0	0	0	0	111.6
834	P	34.4	Very low	25.6	Very low	106 Å²	106	135.5 Å²	135.5	69%	0.688	77%	0.774	S	S	*	*			trans	-116.7	164.3	-179.3	40.5	-31.9	0	0	0	115.3
835	C	25	Very low	25.8	Very low	117 Å²	117	130.3 Å²	130.3	79%	0.791	77%	0.77	S	S	*	*			trans	62.5	112.8	159.1	-70	0	0	0	0	120.6
836	E	25.3	Very low	25.8	Very low	192 Å²	192	134 Å²	134	90%	0.897	78%	0.779	S	S	*	*				43.4	150.4	122.5	-61	-169.1	134.8	0	0	124
837	Q	22.5	Very low	26	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.864	78%	0.78	S	S	*	*			trans	-78.9	-172.8	175.9	-51	176.4	-18.9	0	0	110.6
838	P	36.2	Very low	26	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	78%	0.777	S	S	*	*			cis	-142	168.9	3.2	42.2	-23.2	0	0	0	118.7
839	A	24.5	Very low	26.1	Very low	84 Å²	84	136.7 Å²	136.7	69%	0.694	78%	0.781	S	S	*	*			trans	72.9	149.5	140	0	0	0	0	0	123.7
840	D	24.1	Very low	26.1	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	77%	0.772	S	S	*	*			trans	89.2	120.8	142.1	-77.1	-13.7	0	0	0	124
841	Y	24.8	Very low	26.1	Very low	197 Å²	197	139.7 Å²	139.7	77%	0.773	78%	0.784	S	S	*	*			trans	63.5	114.5	143.1	-82	-92.8	0	0	0	123.1
842	N	23.7	Very low	26.1	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	78%	0.784	S	S	*	*				71.8	124.7	128.8	-102.8	-6.1	0	0	0	122.7
843	F	24	Very low	25.8	Very low	197 Å²	197	144.6 Å²	144.6	86%	0.864	79%	0.788	S	S	*	*				71.2	100.5	124.2	-138.5	-82.8	0	0	0	120.6
844	G	23.1	Very low	26.2	Very low	79 Å²	79	142.8 Å²	142.8	81%	0.814	78%	0.775	S	S	*	*			trans	64	112.8	132.5	0	0	0	0	0	120.4
845	G	25.8	Very low	25.8	Very low	78 Å²	78	145 Å²	145	80%	0.804	78%	0.781	S	S	*	*			trans	-159.3	135.2	166.7	0	0	0	0	0	112.4
846	V	26	Very low	25.9	Very low	143 Å²	143	142.9 Å²	142.9	87%	0.867	78%	0.78	S	S	*	*			trans	-128.4	156.4	-173.8	170.9	0	0	0	0	110.4
847	M	26.1	Very low	26	Very low	161 Å²	161	138.8 Å²	138.8	79%	0.793	78%	0.779	S	S	*	*			trans	79.8	105	163.3	-94.8	-80.8	-171.9	0	0	120.3
848	G	25.9	Very low	26.2	Very low	70 Å²	70	134.3 Å²	134.3	72%	0.722	77%	0.773	S	S	*	*			trans	85.6	173.5	132	0	0	0	0	0	119
849	R	27.5	Very low	25.8	Very low	217 Å²	217	135.5 Å²	135.5	82%	0.819	78%	0.778	S	S	*	*			cis	-167.8	154.6	-7.4	-125.2	-171	173.1	179.2	-0.5	111.3
850	V	24.4	Very low	26.7	Very low	103 Å²	103	136.7 Å²	136.7	62%	0.624	78%	0.778	S	S	*	*			trans	78.2	117.5	141.6	165.2	0	0	0	0	121.9
851	R	25	Very low	26.9	Very low	224 Å²	224	140.3 Å²	140.3	85%	0.845	78%	0.782	S	S	*	*			trans	68.3	161.1	145.8	-76.2	174.9	177.5	149.5	-2.7	118.6
852	L	25.8	Very low	26.8	Very low	154 Å²	154	140.1 Å²	140.1	81%	0.806	78%	0.78	S	S	*	*			cis	-139.5	170	18.8	-163.8	61.7	0	0	0	114.2
853	R	25.5	Very low	26.9	Very low	223 Å²	223	143.9 Å²	143.9	84%	0.842	78%	0.784	S	S	*	*			trans	-71.8	171.6	170.3	-59.6	-178.2	169.7	-171.5	-4.2	111.4
854	S	29.9	Very low	26.8	Very low	86 Å²	86	140 Å²	140	60%	0.601	78%	0.781	S	S	*	*				-175.7	159.5	51.7	-117.8	0	0	0	0	114.4
855	D	26.1	Very low	26.8	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	78%	0.782	S	S	*	*			trans	39.4	144	140.7	-41.3	-41.9	0	0	0	122
856	G	26.7	Very low	26.7	Very low	73 Å²	73	140 Å²	140	75%	0.753	78%	0.781	S	S	*	*			cis	164	170.5	-6	0	0	0	0	0	115.3
857	A	27.9	Very low	26.9	Very low	106 Å²	106	139.3 Å²	139.3	88%	0.876	78%	0.778	S	S	*	*			trans	67.7	131.5	149.1	0	0	0	0	0	125.4
858	A	26.2	Very low	26.8	Very low	91 Å²	91	139.8 Å²	139.8	75%	0.752	78%	0.778	S	S	*	*			trans	77.1	90.3	135.2	0	0	0	0	0	124.5
859	V	29.3	Very low	27	Very low	137 Å²	137	141.6 Å²	141.6	83%	0.83	78%	0.775	S	S	*	*				11	129.7	111.3	-171.5	0	0	0	0	116.4
860	P	43.2	Very low	27.1	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	78%	0.776	S	S	*	*				-160.4	161.2	68	41.5	-19.3	0	0	0	122.3
861	R	27	Very low	27.2	Very low	215 Å²	215	140.3 Å²	140.3	81%	0.811	78%	0.784	S	S	*	*			trans	71.5	124.9	139.8	-82.2	-178.5	171	-174	1.4	125.1
862	R	24.5	Very low	28	Very low	192 Å²	192	134.8 Å²	134.8	73%	0.725	78%	0.777	S	S	*	*			trans	78.6	128.2	130.9	-75.6	-171.9	-179.8	-88.7	6.5	123.4
863	R	23.8	Very low	28.3	Very low	213 Å²	213	132.9 Å²	132.9	80%	0.804	77%	0.772	S	S	*	*			trans	88	128	133.4	-99.7	-170.3	175.4	175.3	-2.8	122.5
864	S	22.5	Very low	28.4	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	77%	0.771	S	S	*	*			trans	84.4	153.4	133.7	-65	0	0	0	0	121
865	G	23.6	Very low	28.5	Very low	82 Å²	82	134.8 Å²	134.8	85%	0.845	78%	0.78	S	S	*	*			trans	101.8	133.5	-164.4	0	0	0	0	0	110
866	G	24.5	Very low	29.8	Very low	76 Å²	76	132.6 Å²	132.6	78%	0.784	77%	0.774	S	S	*	*			cis	111.3	131.4	20.8	0	0	0	0	0	108.4
867	T	28.5	Very low	29.9	Very low	129 Å²	129	136.7 Å²	136.7	79%	0.791	78%	0.779	S	S	*	*			cis	-154.9	161.9	15.6	37.1	0	0	0	0	112
868	E	25.9	Very low	29.9	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.794	77%	0.771	S	S	*	*			trans	20.3	136.4	143.2	-49.3	-176.6	171.6	0	0	119.9
869	T	28.5	Very low	30.7	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	77%	0.772	S	S	*	*				-167.5	155.9	69.4	26.8	0	0	0	0	115.3
870	H	29.4	Very low	32.1	Very low	180 Å²	180	137.2 Å²	137.2	83%	0.833	77%	0.767	S	S	*	*			trans	54.6	101.9	154.9	-56.5	-45.3	0	0	0	122.4
871	S	26.6	Very low	31.4	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	78%	0.777	S	S	*	*			trans	-73.2	-176.8	155.4	-28.5	0	0	0	0	111.6
872	P	43.7	Very low	31.5	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	77%	0.771	S	S	*	*				-156.5	151.6	58.6	40.9	-18.3	0	0	0	120.9
873	T	30.6	Very low	31.7	Very low	115 Å²	115	133.3 Å²	133.3	71%	0.706	78%	0.777	S	S	*	*			trans	65.6	151.7	145.3	51.5	0	0	0	0	120.6
874	R	29.1	Very low	31.8	Very low	219 Å²	219	127.7 Å²	127.7	83%	0.826	78%	0.777	S	S	*	*			cis	-140.7	125.6	0.2	-115.9	152.3	-178.8	170.2	1.2	106.5
875	V	30.9	Very low	32	Very low	130 Å²	130	128 Å²	128	79%	0.788	78%	0.778	S	S	*	*				74	133.5	78.9	172.1	0	0	0	0	112.8
876	P	53.8	Low	32.7	Very low	106 Å²	106	129.5 Å²	129.5	69%	0.688	77%	0.772	S	S	*	*			trans	-116.7	-166.3	-154.2	44.7	-32.7	0	0	0	113.5
877	D	28.1	Very low	32.8	Very low	158 Å²	158	131.1 Å²	131.1	85%	0.845	77%	0.772	S	S	*	*			trans	-152.5	168	146.3	-118.9	-33.5	0	0	0	113.9
878	T	28.6	Very low	33.1	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	77%	0.765	S	S	*	*			trans	-145.1	-169.9	-170.2	1.5	0	0	0	0	109.9
879	P	43.1	Very low	34	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	76%	0.761	S	S	*	*			cis	-127.2	-110.9	-20.2	25.8	1.5	0	0	0	113.4
880	P	59.2	Low	34.1	Very low	111 Å²	111	129.6 Å²	129.6	72%	0.721	77%	0.767	S	S	*	*			trans	-137.4	177.2	-135.7	43	-20.8	0	0	0	118.3
881	R	28.4	Very low	34.2	Very low	246 Å²	246	129.9 Å²	129.9	93%	0.928	77%	0.766	S	S	*	*			trans	170.9	165.1	144.5	-100.8	175.5	162.4	139.9	-2.6	109.7
882	A	27.6	Very low	34.3	Very low	81 Å²	81	132 Å²	132	67%	0.669	77%	0.767	S	S	*	*			cis	176.3	143.7	-39	0	0	0	0	0	108.1
883	A	28.9	Very low	33.4	Very low	105 Å²	105	131.4 Å²	131.4	87%	0.868	77%	0.766	S	S	*	*			trans	62.2	152.3	161.6	0	0	0	0	0	117.9
884	A	26.9	Very low	33.3	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	77%	0.768	S	S	*	*			cis	-158.4	-174.9	-16.1	0	0	0	0	0	109.7
885	C	27	Very low	33.2	Very low	122 Å²	122	127 Å²	127	82%	0.824	76%	0.76	S	S	*	*			trans	-63.5	-178.4	173.7	-44.7	0	0	0	0	112.8
886	P	38.5	Very low	33.1	Very low	112 Å²	112	130.9 Å²	130.9	73%	0.727	77%	0.766	S	S	*	*			cis	-148.5	177.5	11.9	44.9	-24.7	0	0	0	119.3
887	S	25.9	Very low	31.7	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	77%	0.774	S	S	*	*			trans	38.3	144.1	140.2	66.6	0	0	0	0	124.4
888	S	34.9	Very low	31.6	Very low	93 Å²	93	133.8 Å²	133.8	65%	0.65	77%	0.774	S	S	*	*			trans	-87.5	160.7	168.1	93.7	0	0	0	0	114.8
889	P	44.3	Very low	31.4	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	77%	0.769	S	S	*	*			trans	-77.2	150.2	153.2	34.8	-32.9	0	0	0	109.9
890	H	31.1	Very low	30.6	Very low	171 Å²	171	137.1 Å²	137.1	79%	0.792	77%	0.772	S	S	*	*			cis	81.3	149.7	28.4	-74.8	58.2	0	0	0	117.3
891	K	31.4	Very low	29.3	Very low	186 Å²	186	137 Å²	137	81%	0.809	78%	0.775	S	S	*	*			cis	177.5	119.4	-46.3	-151.4	-174.2	-174.4	-178.5	0	109.2
892	I	27.8	Very low	29.9	Very low	157 Å²	157	130.9 Å²	130.9	81%	0.805	77%	0.767	S	S	*	*			trans	-153.3	121.9	162	-49.2	-177.9	0	0	0	106.1
893	S	26.3	Very low	30	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	77%	0.77	S	S	*	*				72.6	139.8	62.7	122.2	0	0	0	0	113.7
894	I	28	Very low	30.2	Very low	145 Å²	145	139 Å²	139	74%	0.744	77%	0.77	S	S	*	*			cis	-157.1	149.2	15.9	-131.9	164.1	0	0	0	113.7
895	S	26.2	Very low	30.4	Very low	96 Å²	96	145.7 Å²	145.7	67%	0.671	78%	0.775	S	S	*	*			trans	50.9	140.5	151.6	87.8	0	0	0	0	126.8
896	K	28.2	Very low	30.5	Very low	211 Å²	211	149.9 Å²	149.9	92%	0.917	77%	0.773	S	S	*	*			trans	80.2	143.8	140.6	-82.1	177.4	176.7	178.6	0	120.9
897	A	26.1	Very low	30	Very low	102 Å²	102	151.9 Å²	151.9	84%	0.843	78%	0.777	S	S	*	*			trans	-103.7	152.9	-170.1	0	0	0	0	0	113.7
898	R	25.6	Very low	30.1	Very low	224 Å²	224	149.9 Å²	149.9	85%	0.845	77%	0.774	S	S	*	*			trans	-159.5	139.8	150.2	-164	165.9	-179.4	165.4	0.1	112.7
899	M	24.8	Very low	29.8	Very low	125 Å²	125	150.2 Å²	150.2	62%	0.616	77%	0.772	S	S	*	*			trans	10.3	145.7	154.7	-53.3	167.1	78	0	0	122.5
900	E	24.6	Very low	29.1	Very low	179 Å²	179	154.9 Å²	154.9	84%	0.836	78%	0.781	S	S	*	*			trans	78.3	149.9	140.9	-77.7	169	141.8	0	0	121.9
901	S	32.1	Very low	28.9	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	78%	0.778	S	S	*	*			trans	-134.1	129.2	-179.3	174.6	0	0	0	0	109.5
902	P	41.6	Very low	28.8	Very low	117 Å²	117	147 Å²	147	76%	0.76	78%	0.78	S	S	*	*			trans	-105.2	115.7	171.8	34.3	-26	0	0	0	111.3
903	E	30.8	Very low	28.9	Very low	157 Å²	157	144.6 Å²	144.6	73%	0.734	78%	0.784	S	S	*	*				73.9	118.7	77	-84.3	-131.3	131.7	0	0	116.6
904	K	31.3	Very low	28.9	Very low	199 Å²	199	143.2 Å²	143.2	87%	0.865	79%	0.785	S	S	*	*			trans	178.3	125	145.9	-97.6	148.8	-171.1	169.8	0	107.7
905	R	30.8	Very low	28.8	Very low	236 Å²	236	141.8 Å²	141.8	89%	0.891	79%	0.787	S	S	*	*			cis	-142.9	145.8	7	-62.9	175.4	170.2	117.4	-8.1	111.9
906	R	30.3	Very low	28.9	Very low	210 Å²	210	143.7 Å²	143.7	79%	0.792	79%	0.788	S	S	*	*			trans	-6.5	149.5	138.2	-75.2	175	-169.5	-113.7	-4.7	117.8
907	L	28.2	Very low	28.9	Very low	153 Å²	153	140.9 Å²	140.9	80%	0.801	78%	0.783	S	S	*	*			cis	-174.6	154.1	0.7	171.7	70.3	0	0	0	109.8
908	G	28.1	Very low	28.9	Very low	69 Å²	69	145.8 Å²	145.8	71%	0.711	78%	0.782	S	S	*	*			trans	123.3	136.5	158.4	0	0	0	0	0	117.5
909	T	28.4	Very low	29.8	Very low	99 Å²	99	140.7 Å²	140.7	61%	0.607	78%	0.777	S	S	*	*				-160.1	140	-90.7	-57.3	0	0	0	0	109.7
910	F	29.1	Very low	30.1	Very low	210 Å²	210	140.3 Å²	140.3	92%	0.921	78%	0.778	S	S	*	*			trans	63.6	160.1	176.8	-60.2	-56.3	0	0	0	116.8
911	G	27	Very low	30.5	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	77%	0.772	S	S	*	*			cis	-167.3	179.8	1.1	0	0	0	0	0	112.8
912	S	30.1	Very low	30.4	Very low	122 Å²	122	143.8 Å²	143.8	85%	0.853	77%	0.771	S	S	*	*			trans	-90	147.9	-162.4	-53.5	0	0	0	0	117.7
913	A	30.1	Very low	29.6	Very low	106 Å²	106	142.8 Å²	142.8	88%	0.876	77%	0.773	S	S	*	*			trans	53.5	133.5	138	0	0	0	0	0	123.3
914	G	26.6	Very low	29.4	Very low	68 Å²	68	146.2 Å²	146.2	70%	0.701	78%	0.781	S	S	*	*			trans	134.1	139.6	137.6	0	0	0	0	0	118.4
915	S	25.9	Very low	30.3	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	77%	0.771	S	S	*	*			trans	70.5	154.2	151.5	-65.8	0	0	0	0	119.4
916	I	28.3	Very low	30.1	Very low	135 Å²	135	139.6 Å²	139.6	69%	0.692	77%	0.772	S	S	*	*			cis	-164	147	-13.5	-111.6	164.8	0	0	0	108.6
917	N	27	Very low	29.9	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	77%	0.773	S	S	*	*			trans	165.9	153.6	132	-92.6	-49.9	0	0	0	116.3
918	Y	26.9	Very low	30	Very low	206 Å²	206	135.1 Å²	135.1	81%	0.808	78%	0.777	S	S	*	*			trans	-127.4	155.7	171.4	-114.2	-92.5	0	0	0	108.2
919	P	43.9	Very low	31.1	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	77%	0.774	S	S	*	*				-141.3	155.8	81.5	37.7	-20.4	0	0	0	113.4
920	D	31.6	Very low	31.1	Very low	118 Å²	118	139.9 Å²	139.9	63%	0.631	79%	0.787	S	S	*	*				56.9	125.2	64.4	-146.5	31.1	0	0	0	113
921	R	32.3	Very low	31.1	Very low	187 Å²	187	140.9 Å²	140.9	71%	0.706	79%	0.785	S	S	*	*			cis	-151.9	156.3	32.8	-90.8	-169.5	162.7	-170.8	-3.1	115.6
922	K	30.6	Very low	31.4	Very low	174 Å²	174	143 Å²	143	76%	0.757	79%	0.786	S	S	*	*			trans	44.6	141.6	141.2	-57.1	-175.4	178.2	-166.9	0	119.9
923	A	24	Very low	31.3	Very low	97 Å²	97	143.1 Å²	143.1	80%	0.802	78%	0.781	S	S	*	*			cis	-161.5	-176.4	39.2	0	0	0	0	0	114.5
924	Y	26.4	Very low	31.5	Very low	229 Å²	229	143.9 Å²	143.9	90%	0.898	78%	0.777	S	S	*	*			trans	-117.8	174.9	175	-97.6	-95.1	0	0	0	109.6
925	P	50	Low	31.6	Very low	101 Å²	101	144.4 Å²	144.4	66%	0.656	78%	0.782	S	S	*	*			cis	-137	-165.5	7.7	41.4	-21.5	0	0	0	116.7
926	E	28.4	Very low	31.9	Very low	195 Å²	195	143.5 Å²	143.5	91%	0.911	78%	0.781	S	S	*	*			trans	81.4	139.4	152.6	-89.6	173.5	-174.2	0	0	122.3
927	G	25.7	Very low	32.1	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	78%	0.78	S	S	*	*			trans	136.3	106.9	166.4	0	0	0	0	0	117.5
928	H	29.1	Very low	32.3	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.875	79%	0.785	S	S	*	*			trans	-134.5	164.7	164.1	-113.5	-20.3	0	0	0	107.4
929	P	51.9	Low	32.7	Very low	100 Å²	100	145.1 Å²	145.1	65%	0.649	79%	0.786	S	S	*	*			cis	-134	-160.4	-15.5	34.8	-12.8	0	0	0	112.7
930	L	28.2	Very low	32	Very low	168 Å²	168	145.1 Å²	145.1	88%	0.88	79%	0.788	S	S	*	*			trans	125.3	150.4	149.4	-64.7	175.8	0	0	0	119.1
931	R	28.4	Very low	32.3	Very low	232 Å²	232	144.8 Å²	144.8	88%	0.875	80%	0.795	S	S	*	*			trans	-73.8	163.5	174.3	-107	177	178	177	-1	111.2
932	P	34.1	Very low	32.3	Very low	115 Å²	115	144.5 Å²	144.5	75%	0.747	81%	0.807	S	S	*	*				-151.5	168.9	53.7	40.8	-19.5	0	0	0	120.2
933	V	27.8	Very low	32.5	Very low	124 Å²	124	139.8 Å²	139.8	75%	0.752	81%	0.807	S	S	*	*			trans	23.7	129.8	145.4	-175.1	0	0	0	0	120.6
934	P	34.3	Very low	33.4	Very low	122 Å²	122	141 Å²	141	79%	0.792	80%	0.8	S	S	*	*			trans	-84.7	151.5	170.2	35.6	-35	0	0	0	114.1
935	G	28.5	Very low	33.9	Very low	79 Å²	79	139.1 Å²	139.1	81%	0.814	80%	0.799	S	S	*	*			trans	-107.7	159.7	167.8	0	0	0	0	0	112.7
936	A	32.5	Very low	33.6	Very low	95 Å²	95	142.8 Å²	142.8	79%	0.785	81%	0.805	S	S	*	*			trans	-88.8	169.9	-171.1	0	0	0	0	0	114.7
937	T	31.8	Very low	34.3	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	78%	0.78	S	S	*	*				156.2	130.7	107	-48.7	0	0	0	0	111.9
938	R	32	Very low	35	Very low	239 Å²	239	139.5 Å²	139.5	90%	0.902	78%	0.777	S	S	*	*				163.7	161.6	125.3	-85.6	178.3	-175.1	-153.1	-3.7	113.9
939	H	36.2	Very low	35.8	Very low	179 Å²	179	138.1 Å²	138.1	83%	0.829	77%	0.771	S	S	*	*			trans	-129.4	160.4	-157.2	-61.2	-112.7	0	0	0	114.8
940	S	29.4	Very low	35.9	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	76%	0.764	S	S	*	*			trans	-163	112.7	142.7	53.7	0	0	0	0	107.8
941	S	37.6	Very low	36.9	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	75%	0.753	S	S	*	*			cis	87.9	111.2	44.4	-171	0	0	0	0	114.3
942	L	32.6	Very low	38.4	Very low	182 Å²	182	127.7 Å²	127.7	95%	0.953	74%	0.735	S	S	*	*			trans	175.6	137.9	141.1	-100	169.2	0	0	0	111.1
943	G	33.4	Very low	39.4	Very low	74 Å²	74	127.4 Å²	127.4	76%	0.763	73%	0.726	S	S	*	*			trans	122.6	63.5	159.5	0	0	0	0	0	118.2
944	D	43.1	Very low	41	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	71%	0.712	S	S	*	*			trans	-72.4	139.1	170.8	-80.4	-75.3	0	0	0	113.5	T947	D944-T947 PolarHBondContact OD1-OG1 3.23Å
945	H	38	Very low	42.6	Very low	189 Å²	189	125.1 Å²	125.1	88%	0.875	71%	0.707	S	S	*	*	S	Bend	trans	-176.5	-17.7	153.1	-108.1	-60.7	0	0	0	113.5
946	K	43.4	Very low	44.4	Very low	178 Å²	178	125.9 Å²	125.9	77%	0.774	69%	0.692	S	S	*	*	S	Bend	trans	-87.7	-14.3	176.9	-84.7	-171.3	168.8	-173.1	0	115.1	L948 T950	K946-L948 PolarHBondContact O-N 2.62Å; K946-T950 PolarHBondContact O-OG1 3.05Å
947	T	41.8	Very low	46.4	Very low	63 Å²	63	125.7 Å²	125.7	39%	0.387	68%	0.677	S	S	.	*	H	α-helix	trans	-64.4	-42.5	-164.9	15.1	0	0	0	0	113.5	D944 E949 T950 E951	D944-T947 PolarHBondContact OD1-OG1 3.23Å; T947-E949 PolarHBondContact O-N 2.57Å; T947-T950 PolarHBondContact O-N 2.82Å; T947-T950 PolarHBondContact O-OG1 2.81Å; T947-E951 PolarHBondContact O-N 3.29Å; T947-E951 VanDerWaalsContact O-N 3.11Å
948	L	41.6	Very low	48.4	Very low	142 Å²	142	127.1 Å²	127.1	74%	0.743	68%	0.676	S	S	*	*	H	α-helix	trans	-64.9	-34.1	-177.9	-99.3	118.2	0	0	0	114.9	K946 A952	K946-L948 PolarHBondContact O-N 2.62Å; L948-A952 PolarHBondContact O-N 3.26Å
949	E	46	Very low	50.4	Low	160 Å²	160	122.1 Å²	122.1	75%	0.748	66%	0.66	S	S	*	*	H	α-helix	trans	-73.3	-34.4	177.8	-67	-175	149.2	0	0	111.3	T947 L953	T947-E949 PolarHBondContact O-N 2.57Å; E949-L953 WeakPolarHBondContact O-CB 3.47Å; E949-L953 PolarHBondContact O-N 3.31Å; E949-L953 VanDerWaalsContact O-N 3.09Å
950	T	52.5	Low	52.4	Low	85 Å²	85	117.7 Å²	117.7	52%	0.521	65%	0.646	S	S	.	*	H	α-helix	trans	-71.9	-34.7	176.1	36.7	0	0	0	0	113.8	K946 T947 A954	K946-T950 PolarHBondContact O-OG1 3.05Å; T947-T950 PolarHBondContact O-N 2.82Å; T947-T950 PolarHBondContact O-OG1 2.81Å; T950-A954 WeakPolarHBondContact O-CB 3.48Å; T950-A954 PolarHBondContact O-N 2.91Å
951	E	50.6	Low	54	Low	136 Å²	136	117.7 Å²	117.7	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-69.8	-43.6	175.1	-72.6	-176.7	137.8	0	0	111.3	T947 L953 A954 E955	T947-E951 PolarHBondContact O-N 3.29Å; T947-E951 VanDerWaalsContact O-N 3.11Å; E951-L953 VanDerWaalsContact C-N 3.33Å; E951-L953 PolarHBondContact O-N 3.33Å; E951-A954 PolarHBondContact O-N 2.93Å; E951-E955 WeakPolarHBondContact O-CB 3.43Å; E951-E955 PolarHBondContact O-N 3.05Å
952	A	59.5	Low	55.5	Low	60 Å²	60	115.8 Å²	115.8	50%	0.496	62%	0.621	S	S	.	*	H	α-helix	trans	-60.5	-40.6	175	0	0	0	0	0	112.5	L948 D956	L948-A952 PolarHBondContact O-N 3.26Å; A952-D956 PolarHBondContact O-N 2.97Å; A952-D956 VanDerWaalsContact O-N 3.14Å
953	L	55.4	Low	57.8	Low	109 Å²	109	110.7 Å²	110.7	57%	0.571	60%	0.598	S	S	*	*	H	α-helix	trans	-68.7	-37	176	-176.3	62.3	0	0	0	112.3	E949 E951 I957	E949-L953 WeakPolarHBondContact O-CB 3.47Å; E949-L953 PolarHBondContact O-N 3.31Å; E949-L953 VanDerWaalsContact O-N 3.09Å; E951-L953 VanDerWaalsContact C-N 3.33Å; E951-L953 PolarHBondContact O-N 3.33Å; L953-I957 HydrophobicContact CD1-CD1 4.25Å; L953-I957 HydrophobicContact CG-CD1 4.02Å; L953-I957 WeakPolarHBondContact O-CB 3.34Å; L953-I957 WeakPolarHBondContact O-CD1 3.37Å; L953-I957 WeakPolarHBondContact O-CG1 3.34Å; L953-I957 PolarHBondContact O-N 2.85Å; L953-I957 VanDerWaalsContact O-N 3.08Å
954	A	61.9	Low	59.2	Low	55 Å²	55	109.3 Å²	109.3	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-67.2	-43.1	176.4	0	0	0	0	0	112	T950 E951 I957 E958	T950-A954 WeakPolarHBondContact O-CB 3.48Å; T950-A954 PolarHBondContact O-N 2.91Å; E951-A954 PolarHBondContact O-N 2.93Å; A954-I957 PolarHBondContact O-N 2.96Å; A954-E958 PolarHBondContact O-N 3.22Å
955	E	66.2	Low	60.5	Low	144 Å²	144	107.8 Å²	107.8	67%	0.673	57%	0.571	S	S	*	*	H	α-helix	trans	-64.4	-39.4	178.2	-167.9	175.3	-142.1	0	0	111.6	E951 E958 K959	E951-E955 WeakPolarHBondContact O-CB 3.43Å; E951-E955 PolarHBondContact O-N 3.05Å; E955-E958 PolarHBondContact O-N 3.24Å; E955-K959 WeakPolarHBondContact O-CB 3.49Å; E955-K959 PolarHBondContact O-N 3.45Å
956	D	67.7	Low	62.2	Low	94 Å²	94	104.4 Å²	104.4	50%	0.503	56%	0.555	S	S	.	*	H	α-helix	trans	-72.6	-31	177.3	-148.7	45	0	0	0	112.6	A952 T960	A952-D956 PolarHBondContact O-N 2.97Å; A952-D956 VanDerWaalsContact O-N 3.14Å; D956-T960 VanDerWaalsContact O-CB 3.25Å; D956-T960 WeakPolarHBondContact O-CB 3.31Å; D956-T960 PolarHBondContact O-N 2.85Å; D956-T960 PolarHBondContact O-OG1 3.2Å
957	I	73.7	Confident	63.5	Low	92 Å²	92	101.8 Å²	101.8	47%	0.472	55%	0.546	S	S	.	.	H	α-helix	trans	-67.7	-48	170.5	-72.5	166.9	0	0	0	111	L953 A954 K959 T960 M961	L953-I957 HydrophobicContact CD1-CD1 4.25Å; L953-I957 HydrophobicContact CG-CD1 4.02Å; L953-I957 WeakPolarHBondContact O-CB 3.34Å; L953-I957 WeakPolarHBondContact O-CD1 3.37Å; L953-I957 WeakPolarHBondContact O-CG1 3.34Å; L953-I957 PolarHBondContact O-N 2.85Å; L953-I957 VanDerWaalsContact O-N 3.08Å; A954-I957 PolarHBondContact O-N 2.96Å; I957-K959 VanDerWaalsContact C-N 3.31Å; I957-K959 PolarHBondContact O-N 2.79Å; I957-T960 PolarHBondContact O-N 2.85Å; I957-M961 PolarHBondContact O-N 2.94Å
958	E	73.9	Confident	64.5	Low	138 Å²	138	103.7 Å²	103.7	65%	0.645	55%	0.553	S	S	*	*	H	α-helix	trans	-63.7	-38.7	179.4	-177.5	167.8	-160	0	0	111.5	A954 E955 S962	A954-E958 PolarHBondContact O-N 3.22Å; E955-E958 PolarHBondContact O-N 3.24Å; E958-S962 VanDerWaalsContact O-CB 3.27Å; E958-S962 WeakPolarHBondContact O-CB 3.34Å; E958-S962 PolarHBondContact O-N 3.28Å; E958-S962 PolarHBondContact O-OG 3.32Å
959	K	73.5	Confident	65.6	Low	134 Å²	134	105.5 Å²	105.5	58%	0.583	55%	0.55	S	S	*	.	H	α-helix	trans	-64.8	-45.5	173.3	-171.6	178.6	-176.4	-176.9	0	111.9	E955 I957 S962 T963	E955-K959 WeakPolarHBondContact O-CB 3.49Å; E955-K959 PolarHBondContact O-N 3.45Å; I957-K959 VanDerWaalsContact C-N 3.31Å; I957-K959 PolarHBondContact O-N 2.79Å; K959-S962 PolarHBondContact O-N 2.86Å; K959-T963 PolarHBondContact O-N 2.62Å; K959-T963 PolarHBondContact O-OG1 3.32Å
960	T	78.1	Confident	66.4	Low	86 Å²	86	100.8 Å²	100.8	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-45.4	175.8	-62.8	0	0	0	0	111.7	D956 I957 S962 T963 A964	D956-T960 VanDerWaalsContact O-CB 3.25Å; D956-T960 WeakPolarHBondContact O-CB 3.31Å; D956-T960 PolarHBondContact O-N 2.85Å; D956-T960 PolarHBondContact O-OG1 3.2Å; I957-T960 PolarHBondContact O-N 2.85Å; T960-S962 VanDerWaalsContact C-N 3.35Å; T960-S962 PolarHBondContact O-N 3.26Å; T960-T963 PolarHBondContact O-N 3.15Å; T960-A964 WeakPolarHBondContact O-CB 3.47Å; T960-A964 PolarHBondContact O-N 2.94Å
961	M	62.5	Low	66.6	Low	117 Å²	117	101.5 Å²	101.5	58%	0.576	53%	0.528	S	S	*	.	H	α-helix	trans	-61.1	-42.2	173.5	-79.6	-174.8	57.6	0	0	112	I957 T963 A964 L965	I957-M961 PolarHBondContact O-N 2.94Å; M961-T963 PolarHBondContact O-N 3.45Å; M961-A964 PolarHBondContact O-N 3.05Å; M961-L965 WeakPolarHBondContact O-CB 3.11Å; M961-L965 VanDerWaalsContact O-CG 3.26Å; M961-L965 WeakPolarHBondContact O-CG 3.41Å; M961-L965 PolarHBondContact O-N 3.17Å
962	S	69.8	Low	66.7	Low	70 Å²	70	101.4 Å²	101.4	49%	0.49	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-39	177.8	-63.4	0	0	0	0	112.1	E958 K959 T960 H966	E958-S962 VanDerWaalsContact O-CB 3.27Å; E958-S962 WeakPolarHBondContact O-CB 3.34Å; E958-S962 PolarHBondContact O-N 3.28Å; E958-S962 PolarHBondContact O-OG 3.32Å; K959-S962 PolarHBondContact O-N 2.86Å; T960-S962 VanDerWaalsContact C-N 3.35Å; T960-S962 PolarHBondContact O-N 3.26Å; S962-H966 WeakPolarHBondContact O-CB 3.31Å; S962-H966 PolarHBondContact O-N 3.1Å
963	T	80.6	Confident	66.2	Low	75 Å²	75	106.6 Å²	106.6	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-47.8	174	-54	0	0	0	0	111.3	K959 T960 M961 L965 H966 E967	K959-T963 PolarHBondContact O-N 2.62Å; K959-T963 PolarHBondContact O-OG1 3.32Å; T960-T963 PolarHBondContact O-N 3.15Å; M961-T963 PolarHBondContact O-N 3.45Å; T963-L965 VanDerWaalsContact C-N 3.32Å; T963-L965 PolarHBondContact O-N 3.24Å; T963-H966 WeakPolarHBondContact O-CA 3.38Å; T963-H966 WeakPolarHBondContact O-CB 3.47Å; T963-H966 PolarHBondContact O-N 2.96Å; T963-E967 PolarHBondContact O-N 3.02Å
964	A	64	Low	65.7	Low	46 Å²	46	107.6 Å²	107.6	38%	0.38	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-37.6	177.5	0	0	0	0	0	112.9	T960 M961 H966 E967 L968	T960-A964 WeakPolarHBondContact O-CB 3.47Å; T960-A964 PolarHBondContact O-N 2.94Å; M961-A964 PolarHBondContact O-N 3.05Å; A964-H966 VanDerWaalsContact C-N 3.35Å; A964-E967 PolarHBondContact O-N 3.4Å; A964-L968 WeakPolarHBondContact O-CB 3.24Å; A964-L968 PolarHBondContact O-N 2.89Å
965	L	69.9	Low	64.9	Low	90 Å²	90	111.9 Å²	111.9	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-70.8	-28.4	173.8	-72	170.6	0	0	0	112.8	M961 T963 R969	M961-L965 WeakPolarHBondContact O-CB 3.11Å; M961-L965 VanDerWaalsContact O-CG 3.26Å; M961-L965 WeakPolarHBondContact O-CG 3.41Å; M961-L965 PolarHBondContact O-N 3.17Å; T963-L965 VanDerWaalsContact C-N 3.32Å; T963-L965 PolarHBondContact O-N 3.24Å; L965-R969 WeakPolarHBondContact O-CG 3.28Å; L965-R969 PolarHBondContact O-N 2.97Å
966	H	74.1	Confident	63.6	Low	118 Å²	118	110.4 Å²	110.4	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-72.2	-42.7	171.4	-165.2	-48	0	0	0	111.3	S962 T963 A964 R969 E970	S962-H966 WeakPolarHBondContact O-CB 3.31Å; S962-H966 PolarHBondContact O-N 3.1Å; T963-H966 WeakPolarHBondContact O-CA 3.38Å; T963-H966 WeakPolarHBondContact O-CB 3.47Å; T963-H966 PolarHBondContact O-N 2.96Å; A964-H966 VanDerWaalsContact C-N 3.35Å; H966-R969 PolarHBondContact O-N 3.06Å; H966-E970 IonicContact CE1-OE2 2.98Å; H966-E970 PolarHBondContact CE1-OE2 3.19Å; H966-E970 IonicContact ND1-OE2 3.3Å; H966-E970 PolarHBondContact O-N 3.1Å
967	E	70.4	Confident	62	Low	123 Å²	123	111.3 Å²	111.3	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-64.6	-41	176.3	-71	-177.9	166	0	0	111.8	T963 A964 R969 E970 L971	T963-E967 PolarHBondContact O-N 3.02Å; A964-E967 PolarHBondContact O-N 3.4Å; E967-R969 PolarHBondContact O-N 3.1Å; E967-E970 PolarHBondContact O-N 3.16Å; E967-L971 WeakPolarHBondContact O-CB 3.39Å; E967-L971 WeakPolarHBondContact O-CG 3.46Å; E967-L971 PolarHBondContact O-N 3.42Å
968	L	61.9	Low	60.2	Low	103 Å²	103	117.1 Å²	117.1	54%	0.539	58%	0.583	S	S	.	*	H	α-helix	trans	-58.4	-45.1	172.1	-88.8	161.8	0	0	0	112.4	A964 L971 E972	A964-L968 WeakPolarHBondContact O-CB 3.24Å; A964-L968 PolarHBondContact O-N 2.89Å; L968-L971 PolarHBondContact O-N 2.97Å; L968-E972 PolarHBondContact O-N 3.31Å
969	R	65.3	Low	58.3	Low	181 Å²	181	120 Å²	120	68%	0.683	60%	0.596	S	S	*	*	H	α-helix	trans	-66.8	-36.3	175.7	-74.3	177.4	-175.6	168	5.1	112.7	L965 H966 E967 L971 E972 R973	L965-R969 WeakPolarHBondContact O-CG 3.28Å; L965-R969 PolarHBondContact O-N 2.97Å; H966-R969 PolarHBondContact O-N 3.06Å; E967-R969 PolarHBondContact O-N 3.1Å; R969-L971 VanDerWaalsContact C-N 3.33Å; R969-E972 PolarHBondContact O-N 3.16Å; R969-R973 VanDerWaalsContact O-CB 3.3Å; R969-R973 WeakPolarHBondContact O-CB 3.36Å; R969-R973 PolarHBondContact O-N 3.02Å
970	E	62.9	Low	56.2	Low	61 Å²	61	118 Å²	118	29%	0.285	60%	0.604	S	S	.	*	H	α-helix	trans	-68.2	-34.8	176.1	-150.7	71.1	-125.1	0	0	111.2	H966 E967 R973 Q974	H966-E970 IonicContact CE1-OE2 2.98Å; H966-E970 PolarHBondContact CE1-OE2 3.19Å; H966-E970 IonicContact ND1-OE2 3.3Å; H966-E970 PolarHBondContact O-N 3.1Å; E967-E970 PolarHBondContact O-N 3.16Å; E970-R973 PolarHBondContact O-N 3.32Å; E970-R973 IonicContact OE1-CZ 3.48Å; E970-R973 IonicContact OE1-NE 3.89Å; E970-R973 PolarHBondContact OE1-NE 3.06Å; E970-R973 IonicContact OE1-NH2 2.75Å; E970-R973 PolarHBondContact OE1-NH2 3.36Å; E970-Q974 WeakPolarHBondContact O-CB 3.14Å; E970-Q974 VanDerWaalsContact O-CG 3.24Å; E970-Q974 WeakPolarHBondContact O-CG 3.48Å; E970-Q974 PolarHBondContact O-N 3.39Å
971	L	55.7	Low	54.8	Low	99 Å²	99	118.9 Å²	118.9	52%	0.518	61%	0.611	S	S	.	*	H	α-helix	trans	-67.8	-42.5	172.8	-78.5	163.5	0	0	0	112.7	E967 L968 R969 R973 Q974 N975	E967-L971 WeakPolarHBondContact O-CB 3.39Å; E967-L971 WeakPolarHBondContact O-CG 3.46Å; E967-L971 PolarHBondContact O-N 3.42Å; L968-L971 PolarHBondContact O-N 2.97Å; R969-L971 VanDerWaalsContact C-N 3.33Å; L971-R973 VanDerWaalsContact C-N 3.32Å; L971-R973 PolarHBondContact O-N 3.38Å; L971-Q974 PolarHBondContact O-N 2.67Å; L971-N975 PolarHBondContact O-N 3.17Å; L971-N975 VanDerWaalsContact O-N 3.09Å
972	E	52.8	Low	53.3	Low	134 Å²	134	120 Å²	120	63%	0.626	62%	0.62	S	S	*	*	H	α-helix	trans	-59.4	-44.9	171	-73.5	-175.2	135.4	0	0	110.8	L968 R969 Q974 N975 T976	L968-E972 PolarHBondContact O-N 3.31Å; R969-E972 PolarHBondContact O-N 3.16Å; E972-Q974 VanDerWaalsContact C-N 3.29Å; E972-Q974 PolarHBondContact O-N 2.9Å; E972-N975 PolarHBondContact O-N 2.85Å; E972-N975 VanDerWaalsContact O-N 3.17Å; E972-T976 PolarHBondContact O-N 3.16Å
973	R	49.7	Very low	51.5	Low	170 Å²	170	122.8 Å²	122.8	64%	0.642	63%	0.633	S	S	*	*	H	α-helix	trans	-68.4	-24.3	179.7	-151.8	177.2	76.6	85.1	1.5	113.8	R969 E970 L971 T976	R969-R973 VanDerWaalsContact O-CB 3.3Å; R969-R973 WeakPolarHBondContact O-CB 3.36Å; R969-R973 PolarHBondContact O-N 3.02Å; E970-R973 PolarHBondContact O-N 3.32Å; E970-R973 IonicContact OE1-CZ 3.48Å; E970-R973 IonicContact OE1-NE 3.89Å; E970-R973 PolarHBondContact OE1-NE 3.06Å; E970-R973 IonicContact OE1-NH2 2.75Å; E970-R973 PolarHBondContact OE1-NH2 3.36Å; L971-R973 VanDerWaalsContact C-N 3.32Å; L971-R973 PolarHBondContact O-N 3.38Å; R973-T976 PolarHBondContact O-OG1 3.28Å
974	Q	45.7	Very low	49.1	Very low	130 Å²	130	124.1 Å²	124.1	61%	0.607	64%	0.641	S	S	*	*	H	α-helix	trans	-80.4	-29.1	172.2	-76.2	173.8	44.6	0	0	112.9	E970 L971 E972 T976	E970-Q974 WeakPolarHBondContact O-CB 3.14Å; E970-Q974 VanDerWaalsContact O-CG 3.24Å; E970-Q974 WeakPolarHBondContact O-CG 3.48Å; E970-Q974 PolarHBondContact O-N 3.39Å; L971-Q974 PolarHBondContact O-N 2.67Å; E972-Q974 VanDerWaalsContact C-N 3.29Å; E972-Q974 PolarHBondContact O-N 2.9Å; Q974-T976 VanDerWaalsContact C-N 3.32Å
975	N	44.9	Very low	47.5	Very low	145 Å²	145	129 Å²	129	78%	0.775	66%	0.66	S	S	*	*	H	α-helix	trans	-73.6	-20.4	175.9	-97.5	-44.7	0	0	0	113.5	L971 E972 V977	L971-N975 PolarHBondContact O-N 3.17Å; L971-N975 VanDerWaalsContact O-N 3.09Å; E972-N975 PolarHBondContact O-N 2.85Å; E972-N975 VanDerWaalsContact O-N 3.17Å; N975-V977 VanDerWaalsContact C-N 3.34Å; N975-V977 PolarHBondContact O-N 3.01Å
976	T	39	Very low	45.7	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	67%	0.669	S	S	*	*			trans	-89.2	50.6	-179.3	56.3	0	0	0	0	114	E972 R973 Q974	E972-T976 PolarHBondContact O-N 3.16Å; R973-T976 PolarHBondContact O-OG1 3.28Å; Q974-T976 VanDerWaalsContact C-N 3.32Å
977	V	33.4	Very low	43.7	Very low	114 Å²	114	130.5 Å²	130.5	69%	0.691	68%	0.677	S	S	*	*			trans	-131	79.9	175.2	-170.3	0	0	0	0	112.9	N975	N975-V977 VanDerWaalsContact C-N 3.34Å; N975-V977 PolarHBondContact O-N 3.01Å
978	K	35.7	Very low	41.8	Very low	214 Å²	214	131 Å²	131	93%	0.93	68%	0.683	S	S	*	*			trans	-167.5	109.2	141.9	-109.3	165.7	-171.8	175.6	0	110.6
979	Q	33.8	Very low	40.1	Very low	199 Å²	199	133.1 Å²	133.1	93%	0.93	69%	0.69	S	S	*	*			trans	-138.6	138.4	178.8	-174.1	-172.5	32.9	0	0	108.9
980	A	30.9	Very low	38.2	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	69%	0.69	S	S	*	*			trans	-166.3	150.4	164.8	0	0	0	0	0	109.6
981	P	46.9	Very low	36.4	Very low	105 Å²	105	134.8 Å²	134.8	68%	0.682	71%	0.711	S	S	*	*				-137.9	165.1	-59.6	36.8	-21.2	0	0	0	114.2
982	D	32.3	Very low	34.9	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	73%	0.725	S	S	*	*			trans	59.4	159.2	158.8	-55.2	-36.6	0	0	0	119.1
983	V	32.1	Very low	33.9	Very low	127 Å²	127	140 Å²	140	77%	0.77	74%	0.735	S	S	*	*			cis	-132.6	123.1	10.8	-164.8	0	0	0	0	109.1
984	V	30.5	Very low	33.6	Very low	103 Å²	103	137.6 Å²	137.6	62%	0.624	74%	0.742	S	S	*	*				36.7	129.6	103.1	-136.8	0	0	0	0	114.4
985	L	30.5	Very low	32.6	Very low	148 Å²	148	136 Å²	136	78%	0.775	75%	0.75	S	S	*	*			cis	-141.1	150.4	32	-81.2	158.2	0	0	0	114.2
986	D	30.8	Very low	31.6	Very low	124 Å²	124	133.9 Å²	133.9	66%	0.663	75%	0.747	S	S	*	*				8.9	155.2	125.6	-63.7	-60.5	0	0	0	121
987	T	32.8	Very low	31	Very low	117 Å²	117	133.4 Å²	133.4	72%	0.718	75%	0.748	S	S	*	*			cis	-145.7	149.2	31.7	47.6	0	0	0	0	116
988	L	29.8	Very low	30.6	Very low	134 Å²	134	136.5 Å²	136.5	70%	0.702	76%	0.755	S	S	*	*				21.2	145.5	119	-44.6	174.2	0	0	0	119.3
989	E	26.9	Very low	31.1	Very low	146 Å²	146	132 Å²	132	68%	0.682	75%	0.747	S	S	*	*			cis	-163.6	161.8	0.6	-131.2	-172.8	-144.8	0	0	114.8
990	L	24.7	Very low	30.6	Very low	128 Å²	128	126.1 Å²	126.1	67%	0.67	74%	0.741	S	S	*	*			trans	52	135.1	145.8	-111.3	70.5	0	0	0	125.3
991	M	24.7	Very low	30.4	Very low	150 Å²	150	127.7 Å²	127.7	74%	0.739	75%	0.746	S	S	*	*			trans	97.2	135.1	133.8	-99.3	-167.2	-179.8	0	0	124
992	K	25.4	Very low	30.2	Very low	185 Å²	185	128.5 Å²	128.5	80%	0.804	75%	0.751	S	S	*	*			trans	83.3	96.8	149.7	-70.9	173.1	-178.8	173.5	0	122
993	N	31.7	Very low	30	Very low	156 Å²	156	128.9 Å²	128.9	83%	0.834	75%	0.753	S	S	*	*				-57.9	166	128.7	-78.4	-9.5	0	0	0	110.6
994	P	43.2	Very low	29.7	Very low	121 Å²	121	130.7 Å²	130.7	79%	0.786	75%	0.753	S	S	*	*			cis	-151.3	-172.5	33.6	44.6	-23.8	0	0	0	119.1
995	A	24.8	Very low	29.5	Very low	96 Å²	96	130.7 Å²	130.7	79%	0.793	75%	0.753	S	S	*	*			trans	74.8	163.5	157.8	0	0	0	0	0	117.3
996	S	24.2	Very low	29.3	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	75%	0.75	S	S	*	*			cis	-154.3	153.2	6.4	56.3	0	0	0	0	114.3
997	S	26.2	Very low	29	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	76%	0.755	S	S	*	*			trans	46	116.8	144.4	63.1	0	0	0	0	123.2
998	E	25.6	Very low	28.7	Very low	180 Å²	180	132.4 Å²	132.4	84%	0.841	75%	0.753	S	S	*	*				15.5	168.2	104.2	-94.8	-169.7	-156.1	0	0	121.9
999	P	44.4	Very low	28.6	Very low	118 Å²	118	137 Å²	137	77%	0.766	76%	0.761	S	S	*	*			cis	-136.5	-168.1	-17.6	35.9	-15.8	0	0	0	113.3
1000	G	24.9	Very low	28.6	Very low	77 Å²	77	136.9 Å²	136.9	79%	0.794	76%	0.764	S	S	*	*			trans	156.3	124.2	154.8	0	0	0	0	0	119.3
1001	S	25.7	Very low	29.7	Very low	123 Å²	123	135.4 Å²	135.4	86%	0.86	76%	0.763	S	S	*	*			trans	-108.4	174.5	158	-80.8	0	0	0	0	108.5
1002	P	43	Very low	30	Very low	121 Å²	121	136 Å²	136	79%	0.786	77%	0.769	S	S	*	*			cis	-145.4	-177.4	22	43.9	-23.1	0	0	0	119
1003	L	27.8	Very low	30	Very low	150 Å²	150	131.1 Å²	131.1	79%	0.785	76%	0.763	S	S	*	*			trans	-16.3	148.6	165.1	-64.4	163	0	0	0	123
1004	H	26.6	Very low	29.7	Very low	166 Å²	166	128.1 Å²	128.1	77%	0.769	76%	0.76	S	S	*	*				102.1	123.9	129.1	-104.3	33	0	0	0	122.6
1005	T	26	Very low	28.9	Very low	103 Å²	103	129.5 Å²	129.5	63%	0.632	76%	0.758	S	S	*	*			trans	97.6	119.8	131.3	-60.8	0	0	0	0	121.5
1006	I	26.7	Very low	29	Very low	141 Å²	141	134.3 Å²	134.3	72%	0.723	76%	0.755	S	S	*	*			trans	79.9	101.1	151.7	-75	169.1	0	0	0	121.3
1007	M	24.4	Very low	29.2	Very low	152 Å²	152	140.8 Å²	140.8	75%	0.749	76%	0.764	S	S	*	*				76.4	141.7	122.9	-64.4	-167.2	101.6	0	0	126.1
1008	I	25.7	Very low	29.2	Very low	132 Å²	132	140.5 Å²	140.5	68%	0.677	76%	0.762	S	S	*	*			trans	71.1	90.9	144.9	-64.8	157.3	0	0	0	119.3
1009	R	28.9	Very low	29.2	Very low	230 Å²	230	137.5 Å²	137.5	87%	0.868	76%	0.761	S	S	*	*				179.2	131	116	-96.1	162	177	165.4	0.3	109
1010	D	25.8	Very low	28.5	Very low	143 Å²	143	137.3 Å²	137.3	77%	0.765	76%	0.762	S	S	*	*			cis	79.5	133.8	34.8	-160.1	65.7	0	0	0	112.9
1011	P	48.6	Very low	28.8	Very low	97 Å²	97	138 Å²	138	63%	0.63	76%	0.755	S	S	*	*			cis	-140.9	178.8	-46.5	41.7	-25.9	0	0	0	114.6
1012	D	29.5	Very low	28.9	Very low	164 Å²	164	138 Å²	138	88%	0.877	75%	0.75	S	S	*	*			trans	42.6	163	144.5	-118.2	-38.3	0	0	0	126.2
1013	A	25.8	Very low	28.3	Very low	81 Å²	81	136.3 Å²	136.3	67%	0.669	74%	0.741	S	S	*	*			trans	77	95.7	151.5	0	0	0	0	0	122.5
1014	A	26.4	Very low	28.5	Very low	93 Å²	93	136.2 Å²	136.2	77%	0.769	74%	0.737	S	S	*	*				87	154.7	118.1	0	0	0	0	0	122.8
1015	M	26.7	Very low	28.6	Very low	151 Å²	151	134.7 Å²	134.7	74%	0.744	73%	0.732	S	S	*	*			trans	69.2	149.3	168.7	-59.2	-134.8	-166.9	0	0	117.4
1016	R	26.4	Very low	28.6	Very low	197 Å²	197	137.5 Å²	137.5	74%	0.743	74%	0.739	S	S	*	*			cis	-173.9	171.9	-21.7	-107.1	-171.1	-179.4	150.5	-9.1	105.5
1017	R	27.4	Very low	28.7	Very low	236 Å²	236	137.1 Å²	137.1	89%	0.891	74%	0.744	S	S	*	*			trans	76.4	152.4	167.7	-53	-178.8	179.7	-170	-1.1	114.9
1018	S	26.4	Very low	28.9	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	74%	0.743	S	S	*	*			cis	-170.2	159.2	-23	-94.3	0	0	0	0	108.8
1019	S	26.5	Very low	28.9	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	75%	0.754	S	S	*	*			trans	61.3	153.9	162.3	36.6	0	0	0	0	116.9
1020	S	29.1	Very low	29	Very low	114 Å²	114	137 Å²	137	80%	0.797	75%	0.751	S	S	*	*			cis	-172.7	162.6	-21.3	48.6	0	0	0	0	105.4
1021	S	31.5	Very low	29.7	Very low	92 Å²	92	135.9 Å²	135.9	64%	0.643	75%	0.752	S	S	*	*			cis	-150.5	139.4	15.4	42.3	0	0	0	0	106.8
1022	T	28	Very low	28.7	Very low	124 Å²	124	135.2 Å²	135.2	76%	0.761	75%	0.754	S	S	*	*				50.6	132.7	72.9	67.8	0	0	0	0	113
1023	S	30.6	Very low	28.6	Very low	84 Å²	84	135 Å²	135	59%	0.587	75%	0.752	S	S	*	*			cis	-164.2	-156.3	3.5	43.1	0	0	0	0	108.4
1024	E	31.8	Very low	28.6	Very low	148 Å²	148	136.2 Å²	136.2	69%	0.692	76%	0.756	S	S	*	*			cis	-168.6	159.3	1.5	-135.8	110.6	-121.7	0	0	105.6
1025	M	29.3	Very low	28.6	Very low	135 Å²	135	136.1 Å²	136.1	67%	0.665	76%	0.755	S	S	*	*			cis	-171	156.4	-28.6	-122	-171.4	-140.9	0	0	110.1
1026	M	25.9	Very low	28.7	Very low	161 Å²	161	139.7 Å²	139.7	79%	0.793	76%	0.76	S	S	*	*			trans	65.5	172	161.5	-52.9	-78.2	177.3	0	0	115
1027	T	27.3	Very low	28.8	Very low	134 Å²	134	137.7 Å²	137.7	82%	0.822	76%	0.763	S	S	*	*			cis	-138.4	168.1	15.9	55.1	0	0	0	0	114.5
1028	T	29.6	Very low	28.8	Very low	119 Å²	119	131.5 Å²	131.5	73%	0.73	76%	0.762	S	S	*	*			trans	-71.5	148	173.9	-35.2	0	0	0	0	113.3
1029	F	25.3	Very low	28.9	Very low	206 Å²	206	130.6 Å²	130.6	90%	0.904	77%	0.768	S	S	*	*				-175.8	144.2	126.4	-103.6	-70.2	0	0	0	113.7
1030	K	31.2	Very low	29	Very low	187 Å²	187	129.4 Å²	129.4	81%	0.813	77%	0.766	S	S	*	*			trans	-111.2	156.4	159.6	-93.9	-176.7	178.3	-180	0	106.2
1031	P	40.6	Very low	29	Very low	119 Å²	119	132.3 Å²	132.3	77%	0.773	77%	0.767	S	S	*	*				-160.8	-179.1	57.2	44.4	-22.3	0	0	0	119.4
1032	A	26.7	Very low	28.9	Very low	82 Å²	82	135.5 Å²	135.5	68%	0.678	78%	0.776	S	S	*	*			trans	67.3	117.9	137.3	0	0	0	0	0	124.5
1033	L	27.3	Very low	28.9	Very low	159 Å²	159	140.6 Å²	140.6	83%	0.832	78%	0.781	S	S	*	*				72.1	118.3	122	-61.7	175.4	0	0	0	123.4
1034	S	25.7	Very low	29.7	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	79%	0.787	S	S	*	*				82.5	118.1	124.1	-64.2	0	0	0	0	124.2
1035	A	28	Very low	30.3	Very low	90 Å²	90	140 Å²	140	74%	0.744	79%	0.788	S	S	*	*				93.6	120.6	123.5	0	0	0	0	0	123.9
1036	R	28	Very low	30.3	Very low	227 Å²	227	138.5 Å²	138.5	86%	0.857	80%	0.797	S	S	*	*			trans	73.6	114.5	131.2	-75	-176.5	170.2	-171.1	-2.3	123.6
1037	L	27.8	Very low	30.9	Very low	154 Å²	154	139.7 Å²	139.7	81%	0.806	80%	0.803	S	S	*	*				78.8	133.4	123.6	-79.4	163.3	0	0	0	124
1038	A	28.6	Very low	31	Very low	106 Å²	106	144.8 Å²	144.8	88%	0.876	81%	0.807	S	S	*	*			trans	63.2	145.4	155.9	0	0	0	0	0	118.7
1039	G	28.4	Very low	32.1	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	81%	0.81	S	S	*	*			cis	-177	-172.7	-2.4	0	0	0	0	0	109.4
1040	A	29.4	Very low	32.2	Very low	92 Å²	92	140.1 Å²	140.1	76%	0.76	81%	0.808	S	S	*	*			cis	-169.6	156.4	-4.9	0	0	0	0	0	111.7
1041	Q	29.2	Very low	32	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	81%	0.812	S	S	*	*			trans	65	161.4	158.1	-55.2	-81	3.1	0	0	117.6
1042	L	29	Very low	31.4	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	81%	0.807	S	S	*	*			cis	-139.4	170.4	15.6	-82.7	172	0	0	0	113.9
1043	R	27.3	Very low	31.6	Very low	231 Å²	231	141.8 Å²	141.8	87%	0.872	81%	0.811	S	S	*	*			trans	-80.7	-175.9	168.8	-109.4	179.5	-178.9	174.8	0.6	112.8
1044	P	47.4	Very low	32.4	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	81%	0.805	S	S	*	*			cis	-126.5	-126.9	-17.5	35.5	-12.1	0	0	0	109.7
1045	P	44.6	Very low	32.7	Very low	108 Å²	108	139.5 Å²	139.5	70%	0.701	80%	0.801	S	S	*	*			cis	-133.4	159.9	-36.1	35.7	-17.3	0	0	0	117.7
1046	A	29.2	Very low	32.7	Very low	104 Å²	104	143.1 Å²	143.1	86%	0.86	80%	0.802	S	S	*	*			trans	43.1	147.1	141.3	0	0	0	0	0	125.3
1047	M	38.8	Very low	32.7	Very low	187 Å²	187	139.8 Å²	139.8	92%	0.921	80%	0.796	S	S	*	*			trans	-123	145.4	171.2	-72.4	-171.9	74.1	0	0	114.4
1048	R	30.1	Very low	32.7	Very low	240 Å²	240	142.9 Å²	142.9	91%	0.906	80%	0.797	S	S	*	*			trans	175.8	173.2	161.8	-107.1	-176.1	-177.8	178.8	2.6	108.7
1049	P	51.4	Low	32.6	Very low	121 Å²	121	144 Å²	144	79%	0.786	80%	0.798	S	S	*	*			cis	-132.8	179.7	-32.8	39.4	-23.9	0	0	0	112.9
1050	A	28.3	Very low	32.6	Very low	106 Å²	106	145.8 Å²	145.8	88%	0.876	80%	0.799	S	S	*	*			trans	-150.5	161	162.3	0	0	0	0	0	111.9
1051	R	27	Very low	32.6	Very low	238 Å²	238	146.6 Å²	146.6	90%	0.898	80%	0.799	S	S	*	*			trans	-155.5	137.9	-169	-162.8	-170.5	-177.6	-177.4	0.4	114
1052	S	26.8	Very low	32.6	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	80%	0.796	S	S	*	*			trans	56	120.8	153.2	57.4	0	0	0	0	123
1053	A	31.1	Very low	32.6	Very low	91 Å²	91	142 Å²	142	75%	0.752	80%	0.8	S	S	*	*				44.9	147.3	117.2	0	0	0	0	0	120.8
1054	P	45.5	Very low	32.7	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	79%	0.794	S	S	*	*				-160.3	168.9	55.7	43.9	-21.4	0	0	0	122.3
1055	T	31.3	Very low	31.9	Very low	109 Å²	109	136.4 Å²	136.4	67%	0.669	80%	0.798	S	S	*	*			trans	68.2	128.8	141.9	44.2	0	0	0	0	126.4
1056	Q	28.5	Very low	31.2	Very low	166 Å²	166	134.2 Å²	134.2	78%	0.776	80%	0.795	S	S	*	*			trans	69.8	135.2	141.5	-62.2	173	13.5	0	0	118.4
1057	H	26.8	Very low	31.3	Very low	158 Å²	158	137 Å²	137	73%	0.731	80%	0.801	S	S	*	*				-154.5	175.9	59.9	-131.2	-102.6	0	0	0	116.2
1058	R	27.9	Very low	30.9	Very low	219 Å²	219	131.4 Å²	131.4	83%	0.826	79%	0.791	S	S	*	*			trans	-58.1	156.4	-170	-54.4	168.2	179.4	175.9	-3	117.8
1059	S	27.7	Very low	31	Very low	129 Å²	129	125.7 Å²	125.7	90%	0.902	79%	0.788	S	S	*	*				-157.9	138.4	125.7	-98.3	0	0	0	0	113.6
1060	S	28.1	Very low	31	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	79%	0.791	S	S	*	*			trans	-102.6	171	162.3	57.4	0	0	0	0	107.9
1061	S	29	Very low	31.2	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	79%	0.787	S	S	*	*			cis	-159.8	173.9	12.8	55.7	0	0	0	0	106.2
1062	S	28.4	Very low	31.4	Very low	107 Å²	107	120.9 Å²	120.9	75%	0.748	78%	0.784	S	S	*	*			cis	-171.9	160.3	31.7	53.4	0	0	0	0	109.2
1063	S	28.7	Very low	31.7	Very low	132 Å²	132	122.2 Å²	122.2	92%	0.923	79%	0.789	S	S	*	*			trans	-163.4	147.3	161.4	-94.2	0	0	0	0	109.9
1064	S	29.7	Very low	32.4	Very low	108 Å²	108	123.2 Å²	123.2	76%	0.755	79%	0.787	S	S	*	*			trans	-103.4	159.2	-168.9	53	0	0	0	0	114.7
1065	S	31.2	Very low	31.7	Very low	115 Å²	115	123.6 Å²	123.6	80%	0.804	79%	0.788	S	S	*	*			trans	20.3	134.1	150.2	59.2	0	0	0	0	120
1066	G	29	Very low	31.5	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	79%	0.786	S	S	*	*			cis	160.3	-160.9	10.2	0	0	0	0	0	111
1067	V	32.8	Very low	31.5	Very low	161 Å²	161	124.2 Å²	124.2	98%	0.976	78%	0.781	S	S	*	*			trans	61	147	-172.4	-49	0	0	0	0	115.5
1068	G	28.9	Very low	31.5	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	79%	0.786	S	S	*	*			cis	155.3	82	-8.7	0	0	0	0	0	113.3
1069	S	33.1	Very low	31.5	Very low	120 Å²	120	123.1 Å²	123.1	84%	0.839	79%	0.787	S	S	*	*			trans	-78.5	151.4	177.1	-40.1	0	0	0	0	113
1070	P	50.3	Low	32.4	Very low	130 Å²	130	122.3 Å²	122.3	84%	0.844	78%	0.779	S	S	*	*			trans	-96.8	160.5	139	34.2	-28.6	0	0	0	110.7
1071	A	33.5	Very low	32.4	Very low	95 Å²	95	122.2 Å²	122.2	79%	0.785	78%	0.778	S	S	*	*			trans	-121.3	156.3	-171.4	0	0	0	0	0	113.2
1072	V	30.7	Very low	32.3	Very low	140 Å²	140	124.7 Å²	124.7	85%	0.848	78%	0.783	S	S	*	*			trans	-142.6	137.6	150.9	178.9	0	0	0	0	108.8
1073	T	33.4	Very low	32.2	Very low	123 Å²	123	125.3 Å²	125.3	76%	0.755	79%	0.787	S	S	*	*			trans	-121.5	152	164.2	51.8	0	0	0	0	108.5
1074	P	46.1	Very low	32.3	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	78%	0.784	S	S	*	*				-135.8	163.1	88.5	38.3	-23.4	0	0	0	112.9
1075	T	30.8	Very low	32.3	Very low	118 Å²	118	124.3 Å²	124.3	72%	0.724	79%	0.786	S	S	*	*				59.6	133.1	53.3	29.6	0	0	0	0	114
1076	E	28.1	Very low	32.3	Very low	134 Å²	134	125.1 Å²	125.1	63%	0.626	79%	0.792	S	S	*	*			cis	-149.3	147.9	7.4	-88.2	-153.8	144.6	0	0	114.3
1077	K	27.8	Very low	32.3	Very low	154 Å²	154	126 Å²	126	67%	0.67	80%	0.801	S	S	*	*			trans	65.3	148.1	133.4	-70	178.1	-170.5	146.9	0	126
1078	L	25.8	Very low	32.1	Very low	160 Å²	160	124.1 Å²	124.1	84%	0.838	79%	0.794	S	S	*	*			trans	98	114.3	138.2	-84.2	157.3	0	0	0	122.4
1079	F	29.6	Very low	32.1	Very low	194 Å²	194	128.3 Å²	128.3	85%	0.851	80%	0.8	S	S	*	*			trans	-61.1	169	159.8	-80.8	-86	0	0	0	113.2
1080	P	46.3	Very low	31.9	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	80%	0.8	S	S	*	*			cis	-131.1	-168.4	32.6	33.1	-8.1	0	0	0	114
1081	S	26.7	Very low	30.8	Very low	112 Å²	112	130 Å²	130	78%	0.783	80%	0.798	S	S	*	*			cis	-155	-179.4	27.6	-47.2	0	0	0	0	115.1
1082	N	27.9	Very low	30.5	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	80%	0.802	S	S	*	*			trans	-71	136.3	-178.2	-66.8	-12.4	0	0	0	116.7
1083	S	26.9	Very low	30.6	Very low	121 Å²	121	131.2 Å²	131.2	85%	0.846	80%	0.8	S	S	*	*				170.6	148.9	119.8	45.2	0	0	0	0	109.1
1084	S	28.8	Very low	30.4	Very low	123 Å²	123	129.1 Å²	129.1	86%	0.86	80%	0.803	S	S	*	*			cis	-146.2	162.6	-9.2	46	0	0	0	0	108.8
1085	A	30.8	Very low	29.5	Very low	95 Å²	95	131.8 Å²	131.8	79%	0.785	81%	0.812	S	S	*	*			trans	-106.5	172.6	-169.7	0	0	0	0	0	115
1086	S	31.3	Very low	29.6	Very low	133 Å²	133	130.7 Å²	130.7	93%	0.93	82%	0.815	S	S	*	*			trans	102.1	148.1	166.9	78.7	0	0	0	0	117.7
1087	G	27.7	Very low	29.7	Very low	81 Å²	81	127.7 Å²	127.7	84%	0.835	82%	0.82	S	S	*	*			trans	152.8	91.9	-174.3	0	0	0	0	0	110.9
1088	S	29.9	Very low	29.8	Very low	120 Å²	120	126.8 Å²	126.8	84%	0.839	82%	0.822	S	S	*	*			trans	-132.7	154.9	-178.9	56.2	0	0	0	0	111.5
1089	N	28.5	Very low	30	Very low	158 Å²	158	126.6 Å²	126.6	85%	0.845	81%	0.814	S	S	*	*			trans	-63.7	169.2	-173.7	-70.5	-7.7	0	0	0	115.8
1090	V	28.6	Very low	30.1	Very low	138 Å²	138	124 Å²	124	84%	0.836	82%	0.815	S	S	*	*			trans	104.4	129.4	151.2	-168.6	0	0	0	0	117.3
1091	N	28.3	Very low	29.3	Very low	148 Å²	148	122.7 Å²	122.7	79%	0.791	82%	0.821	S	S	*	*			trans	-53.5	152.2	171.6	-52.6	-17.6	0	0	0	114.2
1092	V	26.9	Very low	29.8	Very low	144 Å²	144	121.1 Å²	121.1	87%	0.873	82%	0.823	S	S	*	*			trans	-144.7	136.6	134.4	171.9	0	0	0	0	109.1
1093	S	32.1	Very low	30	Very low	116 Å²	116	126.3 Å²	126.3	81%	0.811	85%	0.845	S	S	*	*			trans	-83.8	137.7	168.1	52.7	0	0	0	0	111.4
1094	G	29.2	Very low	30.1	Very low	80 Å²	80	126.6 Å²	126.6	83%	0.825	85%	0.845	S	S	*	*			trans	-157.5	100.2	179.5	0	0	0	0	0	114.7
1095	D	28.3	Very low	30.2	Very low	167 Å²	167	126.8 Å²	126.8	89%	0.893	85%	0.845	S	S	*	*			trans	-84.4	157	162.1	-180	27.6	0	0	0	110.4
1096	A	31.1	Very low	30.2	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	85%	0.848	S	S	*	*			trans	-158.2	129.8	176.9	0	0	0	0	0	111.9
1097	G	31	Very low	30.1	Very low	71 Å²	71	128.3 Å²	128.3	73%	0.732	84%	0.843	S	S	*	*			cis	161.4	-152.2	-3.1	0	0	0	0	0	111.9
1098	D	29.3	Very low	30.2	Very low	134 Å²	134	131.3 Å²	131.3	72%	0.717	84%	0.844	S	S	*	*			trans	85.9	141.2	163.1	-147.6	9.2	0	0	0	119.9
1099	K	30.4	Very low	30.3	Very low	157 Å²	157	132 Å²	132	68%	0.683	84%	0.844	S	S	*	*			trans	57.7	98.7	159.5	-81.1	147.1	-158.9	152.3	0	124.6
1100	T	31.6	Very low	30.4	Very low	139 Å²	139	130.1 Å²	130.1	85%	0.853	84%	0.844	S	S	*	*				52	120.8	115.8	59.9	0	0	0	0	121.7
1101	G	29.4	Very low	30.5	Very low	84 Å²	84	129.5 Å²	129.5	87%	0.866	84%	0.844	S	S	*	*			trans	157.4	126.9	157.5	0	0	0	0	0	109.8
1102	G	37.2	Very low	30.7	Very low	80 Å²	80	128 Å²	128	83%	0.825	85%	0.849	S	S	*	*			trans	-142.8	149.3	-173	0	0	0	0	0	114.5
1103	M	32	Very low	31.1	Very low	269 Å²	269	126.5 Å²	126.5	100%	1.325	85%	0.847	S	S	*	*			trans	-154.2	0	154.5	-113.6	-176.2	172.5	0	0	109.5

Retrieved 1,103 of 1,103 residues in 309.3 ms (Link to these results)

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