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Tetraspanin

May be involved in cell proliferation and cell motility.

AlphaFold DB , UniProt , Accession A0A2K5W605, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene TSPAN7, Length 265 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.6	Very low	54	Low	207 Å²	207	113.6 Å²	113.6	100%	1.02	57%	0.574	S	S	*	*				0	-43.7	0	-83.6	170.2	-170.1	0	0	114.1	S3	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.39Å
2	A	43.4	Very low	55.2	Low	72 Å²	72	106.6 Å²	106.6	60%	0.595	54%	0.539	S	S	*	.	H	α-helix	trans	-62.5	-30.4	180	0	0	0	0	0	115.2	R5 M6	A2-R5 WeakPolarHBondContact O-CB 3.2Å; A2-R5 PolarHBondContact O-N 3Å; A2-M6 PolarHBondContact O-N 3.35Å
3	S	41.3	Very low	56.2	Low	84 Å²	84	105 Å²	105	59%	0.587	54%	0.538	S	S	*	.	H	α-helix	trans	-66.3	-46.2	-178.5	-157.4	0	0	0	0	113.4	M1 R5 M6 E7	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.39Å; S3-R5 PolarHBondContact O-N 3.21Å; S3-M6 PolarHBondContact O-N 3.35Å; S3-E7 PolarHBondContact O-N 3.35Å
4	R	48.2	Very low	57.3	Low	171 Å²	171	102.4 Å²	102.4	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-30.9	175	-77.8	-169.5	-173.1	179.7	1.1	112.4	M6 T8 E263	R4-M6 VanDerWaalsContact C-N 3.35Å; R4-T8 WeakPolarHBondContact O-CB 3.42Å; R4-T8 WeakPolarHBondContact O-CG2 3.4Å; R4-T8 PolarHBondContact O-N 3.09Å; R4-T8 PolarHBondContact O-OG1 3.26Å; R4-E263 IonicContact NH1-OE1 2.71Å
5	R	46.7	Very low	58.2	Low	147 Å²	147	97.7 Å²	97.7	56%	0.555	51%	0.508	S	S	*	.	H	α-helix	trans	-70.7	-26.6	178.4	-156.6	179.6	-163	-173.7	4.1	113.4	A2 S3 T8 K9 M264	A2-R5 WeakPolarHBondContact O-CB 3.2Å; A2-R5 PolarHBondContact O-N 3Å; S3-R5 PolarHBondContact O-N 3.21Å; R5-T8 WeakPolarHBondContact CA-OG1 3.48Å; R5-T8 PolarHBondContact O-OG1 3.37Å; R5-K9 WeakPolarHBondContact O-CG 3.23Å; R5-M264 PolarHBondContact NH2-SD 3.06Å
6	M	48	Very low	58.7	Low	134 Å²	134	95.6 Å²	95.6	66%	0.66	49%	0.493	S	S	*	.	H	α-helix	trans	-83.5	-31.6	176.3	-68.7	-166.2	-65.8	0	0	112.4	A2 S3 R4 P10	A2-M6 PolarHBondContact O-N 3.35Å; S3-M6 PolarHBondContact O-N 3.35Å; R4-M6 VanDerWaalsContact C-N 3.35Å; M6-P10 WeakPolarHBondContact O-CD 3.29Å
7	E	52.8	Low	59.1	Low	137 Å²	137	93.8 Å²	93.8	64%	0.64	49%	0.488	S	S	*	.	H	α-helix	trans	-73.2	-30.7	174.8	-103.2	-179.6	103.3	0	0	113.8	S3 P10	S3-E7 PolarHBondContact O-N 3.35Å; E7-P10 VanDerWaalsContact O-CD 3.26Å; E7-P10 WeakPolarHBondContact O-CD 3.46Å; E7-P10 VanDerWaalsContact O-CG 3.23Å; E7-P10 WeakPolarHBondContact O-CG 3.45Å
8	T	61.6	Low	59.6	Low	24 Å²	24	93.1 Å²	93.1	15%	0.147	49%	0.485	C	S	.	.	H	α-helix	trans	-80.1	-28.7	-175.7	44	0	0	0	0	113	R4 R5 V11 I12 F256	R4-T8 WeakPolarHBondContact O-CB 3.42Å; R4-T8 WeakPolarHBondContact O-CG2 3.4Å; R4-T8 PolarHBondContact O-N 3.09Å; R4-T8 PolarHBondContact O-OG1 3.26Å; R5-T8 WeakPolarHBondContact CA-OG1 3.48Å; R5-T8 PolarHBondContact O-OG1 3.37Å; T8-V11 PolarHBondContact O-N 3.23Å; T8-I12 VanDerWaalsContact O-CG1 3.29Å; T8-I12 WeakPolarHBondContact O-CG1 2.87Å; T8-I12 PolarHBondContact O-N 3.31Å; T8-F256 VanDerWaalsContact CB-CE1 3.47Å; T8-F256 HydrophobicContact CG2-CE1 3.61Å; T8-F256 HydrophobicContact CG2-CZ 3.52Å
9	K	62.7	Low	60	Low	134 Å²	134	88.8 Å²	88.8	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-58.4	-50.6	174.9	-75.8	-179.7	179.5	-172.8	0	114	R5 V11 I12 T13	R5-K9 WeakPolarHBondContact O-CG 3.23Å; K9-V11 VanDerWaalsContact C-N 3.28Å; K9-V11 PolarHBondContact O-N 3.25Å; K9-I12 PolarHBondContact O-N 3.19Å; K9-T13 WeakPolarHBondContact O-CB 3.44Å; K9-T13 PolarHBondContact O-N 3.31Å; K9-T13 PolarHBondContact O-OG1 3.3Å
10	P	71.8	Confident	60.2	Low	77 Å²	77	86 Å²	86	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-64.8	-32.4	177.7	24.4	-33.2	0	0	0	112	M6 E7 C14	M6-P10 WeakPolarHBondContact O-CD 3.29Å; E7-P10 VanDerWaalsContact O-CD 3.26Å; E7-P10 WeakPolarHBondContact O-CD 3.46Å; E7-P10 VanDerWaalsContact O-CG 3.23Å; E7-P10 WeakPolarHBondContact O-CG 3.45Å; P10-C14 WeakPolarHBondContact O-CB 3.3Å; P10-C14 PolarHBondContact O-N 3.19Å
11	V	69.6	Low	60.4	Low	63 Å²	63	86.2 Å²	86.2	38%	0.382	45%	0.448	S	S	.	.	H	α-helix	trans	-68	-44.2	175.5	178.6	0	0	0	0	111.8	T8 K9 C14 L15 F256	T8-V11 PolarHBondContact O-N 3.23Å; K9-V11 VanDerWaalsContact C-N 3.28Å; K9-V11 PolarHBondContact O-N 3.25Å; V11-C14 PolarHBondContact O-N 3.44Å; V11-L15 HydrophobicContact CG1-CD1 4.1Å; V11-L15 WeakPolarHBondContact O-CB 3.07Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.16Å; V11-F256 HydrophobicContact CB-CE1 4.3Å; V11-F256 HydrophobicContact CB-CZ 4.01Å; V11-F256 HydrophobicContact CG1-CE1 4.29Å; V11-F256 HydrophobicContact CG1-CE2 4.16Å; V11-F256 HydrophobicContact CG1-CZ 3.83Å
12	I	69.1	Low	61.4	Low	29 Å²	29	78.1 Å²	78.1	15%	0.149	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-45.5	174.8	-69	164.8	0	0	0	110.5	T8 K9 C14 L15 K16 L253 F256	T8-I12 VanDerWaalsContact O-CG1 3.29Å; T8-I12 WeakPolarHBondContact O-CG1 2.87Å; T8-I12 PolarHBondContact O-N 3.31Å; K9-I12 PolarHBondContact O-N 3.19Å; I12-C14 VanDerWaalsContact C-N 3.33Å; I12-L15 PolarHBondContact O-N 3.03Å; I12-K16 HydrophobicContact CG2-CD 4.16Å; I12-K16 WeakPolarHBondContact O-CB 3.29Å; I12-K16 VanDerWaalsContact O-CG 3.32Å; I12-K16 WeakPolarHBondContact O-CG 3.16Å; I12-K16 PolarHBondContact O-N 3Å; I12-L253 HydrophobicContact CG2-CD1 4.08Å; I12-F256 HydrophobicContact CD1-CD1 3.78Å; I12-F256 HydrophobicContact CD1-CE1 3.99Å; I12-F256 HydrophobicContact CG1-CD1 3.4Å; I12-F256 HydrophobicContact CG1-CE1 3.65Å
13	T	67.4	Low	62.3	Low	86 Å²	86	76 Å²	76	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-62.6	-42.8	177	-58.1	0	0	0	0	110.3	K9 K16 T17	K9-T13 WeakPolarHBondContact O-CB 3.44Å; K9-T13 PolarHBondContact O-N 3.31Å; K9-T13 PolarHBondContact O-OG1 3.3Å; T13-K16 PolarHBondContact O-N 3.23Å; T13-T17 VanDerWaalsContact O-CB 3.28Å; T13-T17 WeakPolarHBondContact O-CB 3.42Å; T13-T17 PolarHBondContact O-N 3.28Å; T13-T17 PolarHBondContact O-OG1 3.48Å
14	C	72.7	Confident	63.2	Low	68 Å²	68	73.7 Å²	73.7	46%	0.459	37%	0.367	S	S	.	.	H	α-helix	trans	-61.4	-49.1	176.2	-174.2	0	0	0	0	111.9	P10 V11 I12 K16 T17 L18	P10-C14 WeakPolarHBondContact O-CB 3.3Å; P10-C14 PolarHBondContact O-N 3.19Å; V11-C14 PolarHBondContact O-N 3.44Å; I12-C14 VanDerWaalsContact C-N 3.33Å; C14-K16 PolarHBondContact O-N 2.7Å; C14-T17 PolarHBondContact O-N 3.34Å; C14-L18 WeakPolarHBondContact O-CB 3.44Å; C14-L18 VanDerWaalsContact O-CG 3.3Å; C14-L18 WeakPolarHBondContact O-CG 3.01Å; C14-L18 PolarHBondContact O-N 2.98Å
15	L	69.6	Low	63.9	Low	32 Å²	32	70.8 Å²	70.8	17%	0.168	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-40.8	177.9	-75.5	169.3	0	0	0	112.5	V11 I12 L18 L19 L249 L253	V11-L15 HydrophobicContact CG1-CD1 4.1Å; V11-L15 WeakPolarHBondContact O-CB 3.07Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.16Å; I12-L15 PolarHBondContact O-N 3.03Å; L15-L18 PolarHBondContact O-N 3.38Å; L15-L19 WeakPolarHBondContact O-CB 3.32Å; L15-L19 PolarHBondContact O-N 3.37Å; L15-L249 HydrophobicContact CD2-CD2 3.95Å; L15-L253 HydrophobicContact CB-CD1 4.1Å
16	K	66.9	Low	64.3	Low	64 Å²	64	69.1 Å²	69.1	28%	0.278	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-47.3	173.1	-76.4	-178.1	176.5	-170.1	0	111.2	I12 T13 C14 L18 L19 I20 L253	I12-K16 HydrophobicContact CG2-CD 4.16Å; I12-K16 WeakPolarHBondContact O-CB 3.29Å; I12-K16 VanDerWaalsContact O-CG 3.32Å; I12-K16 WeakPolarHBondContact O-CG 3.16Å; I12-K16 PolarHBondContact O-N 3Å; T13-K16 PolarHBondContact O-N 3.23Å; C14-K16 PolarHBondContact O-N 2.7Å; K16-L18 VanDerWaalsContact C-N 3.32Å; K16-L18 PolarHBondContact O-N 2.94Å; K16-L19 PolarHBondContact O-N 3.44Å; K16-I20 WeakPolarHBondContact O-CB 3.16Å; K16-I20 WeakPolarHBondContact O-CD1 3.18Å; K16-I20 WeakPolarHBondContact O-CG1 3.43Å; K16-I20 PolarHBondContact O-N 3Å; K16-L253 HydrophobicContact CG-CD1 4.09Å; K16-L253 HydrophobicContact CG-CD2 3.74Å
17	T	65	Low	64.3	Low	65 Å²	65	68.5 Å²	68.5	40%	0.399	36%	0.355	S	S	.	.	H	α-helix	trans	-62.3	-39.6	178.3	-60.3	0	0	0	0	111.3	T13 C14 I20 I21	T13-T17 VanDerWaalsContact O-CB 3.28Å; T13-T17 WeakPolarHBondContact O-CB 3.42Å; T13-T17 PolarHBondContact O-N 3.28Å; T13-T17 PolarHBondContact O-OG1 3.48Å; C14-T17 PolarHBondContact O-N 3.34Å; T17-I20 PolarHBondContact O-N 3.29Å; T17-I21 HydrophobicContact CG2-CD1 3.75Å; T17-I21 HydrophobicContact CG2-CG1 4.32Å; T17-I21 WeakPolarHBondContact O-CB 3.44Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; T17-I21 PolarHBondContact O-N 3.38Å
18	L	69.5	Low	64.2	Low	82 Å²	82	64.1 Å²	64.1	43%	0.429	33%	0.334	S	S	.	.	H	α-helix	trans	-65.6	-42	174.9	-74.9	171.7	0	0	0	112.4	C14 L15 K16 I20 I21 Y22	C14-L18 WeakPolarHBondContact O-CB 3.44Å; C14-L18 VanDerWaalsContact O-CG 3.3Å; C14-L18 WeakPolarHBondContact O-CG 3.01Å; C14-L18 PolarHBondContact O-N 2.98Å; L15-L18 PolarHBondContact O-N 3.38Å; K16-L18 VanDerWaalsContact C-N 3.32Å; K16-L18 PolarHBondContact O-N 2.94Å; L18-I20 VanDerWaalsContact C-N 3.33Å; L18-I21 PolarHBondContact O-N 2.95Å; L18-Y22 WeakPolarHBondContact O-CB 3.33Å; L18-Y22 PolarHBondContact O-N 3.38Å
19	L	66.9	Low	63.3	Low	12 Å²	12	73.1 Å²	73.1	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-38.9	176.6	-160.3	153.3	0	0	0	110.9	L15 K16 S23 L249 A250	L15-L19 WeakPolarHBondContact O-CB 3.32Å; L15-L19 PolarHBondContact O-N 3.37Å; K16-L19 PolarHBondContact O-N 3.44Å; L19-S23 PolarHBondContact O-N 3.45Å; L19-S23 PolarHBondContact O-OG 3.31Å; L19-L249 HydrophobicContact CB-CD1 4.47Å; L19-L249 HydrophobicContact CD1-CB 3.94Å; L19-L249 HydrophobicContact CG-CB 4.45Å; L19-A250 HydrophobicContact CD1-CB 4.41Å
20	I	63.1	Low	62.1	Low	32 Å²	32	69 Å²	69	16%	0.164	36%	0.362	C	S	.	.	H	α-helix	trans	-63.9	-51.7	172.5	-67.4	164.3	0	0	0	110.1	K16 T17 L18 Y22 S23 F24 T96	K16-I20 WeakPolarHBondContact O-CB 3.16Å; K16-I20 WeakPolarHBondContact O-CD1 3.18Å; K16-I20 WeakPolarHBondContact O-CG1 3.43Å; K16-I20 PolarHBondContact O-N 3Å; T17-I20 PolarHBondContact O-N 3.29Å; L18-I20 VanDerWaalsContact C-N 3.33Å; I20-Y22 VanDerWaalsContact C-N 3.28Å; I20-Y22 PolarHBondContact O-N 3.26Å; I20-S23 PolarHBondContact O-N 3.43Å; I20-S23 VanDerWaalsContact O-N 3.13Å; I20-F24 HydrophobicContact CG2-CD2 3.59Å; I20-F24 HydrophobicContact CG2-CE2 3.56Å; I20-F24 WeakPolarHBondContact O-CB 3.4Å; I20-F24 VanDerWaalsContact O-CD2 3.23Å; I20-F24 WeakPolarHBondContact O-CD2 3.37Å; I20-F24 PolarHBondContact O-N 2.92Å; I20-T96 HydrophobicContact CD1-CG2 4.36Å; I20-T96 HydrophobicContact CG1-CG2 4.39Å
21	I	65.1	Low	60.6	Low	90 Å²	90	69.4 Å²	69.4	46%	0.462	37%	0.372	S	S	.	.	H	α-helix	trans	-57.2	-43.3	177.8	-71.3	166.3	0	0	0	110.8	T17 L18 F24 V25	T17-I21 HydrophobicContact CG2-CD1 3.75Å; T17-I21 HydrophobicContact CG2-CG1 4.32Å; T17-I21 WeakPolarHBondContact O-CB 3.44Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; T17-I21 PolarHBondContact O-N 3.38Å; L18-I21 PolarHBondContact O-N 2.95Å; I21-F24 WeakPolarHBondContact O-CB 3.26Å; I21-F24 PolarHBondContact O-N 3.05Å; I21-V25 HydrophobicContact CG2-CG2 4.38Å; I21-V25 WeakPolarHBondContact O-CG2 3.48Å; I21-V25 PolarHBondContact O-N 3.39Å
22	Y	67.6	Low	59	Low	38 Å²	38	68.7 Å²	68.7	15%	0.149	38%	0.377	C	S	.	.	H	α-helix	trans	-56.8	-53.5	174.1	167	-89.7	0	0	0	111	L18 I20 F24 V25 F26 S242 Q243 I245	L18-Y22 WeakPolarHBondContact O-CB 3.33Å; L18-Y22 PolarHBondContact O-N 3.38Å; I20-Y22 VanDerWaalsContact C-N 3.28Å; I20-Y22 PolarHBondContact O-N 3.26Å; Y22-F24 PolarHBondContact O-N 3.37Å; Y22-V25 PolarHBondContact O-N 3.17Å; Y22-F26 HydrophobicContact CD2-CD2 4.07Å; Y22-F26 AromaticContact CD2-CE2 3.82Å; Y22-F26 HydrophobicContact CD2-CE2 3.82Å; Y22-F26 HydrophobicContact CE1-CD2 4.29Å; Y22-F26 AromaticContact CE2-CD2 3.7Å; Y22-F26 HydrophobicContact CE2-CD2 3.7Å; Y22-F26 AromaticContact CE2-CE2 3.31Å; Y22-F26 HydrophobicContact CE2-CE2 3.31Å; Y22-F26 HydrophobicContact CE2-CZ 4.28Å; Y22-F26 AromaticContact CZ-CD2 3.76Å; Y22-F26 AromaticContact CZ-CE2 3.76Å; Y22-F26 WeakPolarHBondContact O-CD2 3.33Å; Y22-F26 PolarHBondContact O-N 3.39Å; Y22-S242 WeakPolarHBondContact CE2-O 3.21Å; Y22-S242 VanDerWaalsContact CZ-O 3.26Å; Y22-S242 WeakPolarHBondContact OH-CA 3.4Å; Y22-S242 WeakPolarHBondContact OH-CB 3.3Å; Y22-S242 PolarHBondContact OH-O 2.82Å; Y22-S242 PolarHBondContact OH-OG 3.15Å; Y22-S242 VanDerWaalsContact OH-OG 3.11Å; Y22-Q243 PolarHBondContact OH-N 2.88Å; Y22-I245 HydrophobicContact CD2-CG2 4.21Å; Y22-I245 HydrophobicContact CE2-CB 4.31Å; Y22-I245 HydrophobicContact CE2-CG2 4.35Å
23	S	63.7	Low	57.5	Low	28 Å²	28	76.8 Å²	76.8	20%	0.196	41%	0.412	C	S	.	.	H	α-helix	trans	-59.7	-34	176.4	-65.3	0	0	0	0	112.5	L19 I20 W27	L19-S23 PolarHBondContact O-N 3.45Å; L19-S23 PolarHBondContact O-OG 3.31Å; I20-S23 PolarHBondContact O-N 3.43Å; I20-S23 VanDerWaalsContact O-N 3.13Å; S23-W27 WeakPolarHBondContact O-CB 3.45Å; S23-W27 PolarHBondContact O-N 3.36Å; S23-W27 VanDerWaalsContact O-N 3.12Å
24	F	59.3	Low	56.7	Low	35 Å²	35	77.1 Å²	77.1	15%	0.154	42%	0.417	C	S	.	.	H	α-helix	trans	-67.4	-42.6	175.3	-97.4	-104.3	0	0	0	113.3	I20 I21 Y22 F26 W27 K28 G32 D38	I20-F24 HydrophobicContact CG2-CD2 3.59Å; I20-F24 HydrophobicContact CG2-CE2 3.56Å; I20-F24 WeakPolarHBondContact O-CB 3.4Å; I20-F24 VanDerWaalsContact O-CD2 3.23Å; I20-F24 WeakPolarHBondContact O-CD2 3.37Å; I20-F24 PolarHBondContact O-N 2.92Å; I21-F24 WeakPolarHBondContact O-CB 3.26Å; I21-F24 PolarHBondContact O-N 3.05Å; Y22-F24 PolarHBondContact O-N 3.37Å; F24-F26 VanDerWaalsContact C-N 3.3Å; F24-F26 PolarHBondContact O-N 2.93Å; F24-W27 PolarHBondContact O-N 2.97Å; F24-K28 HydrophobicContact CD1-CD 3.55Å; F24-K28 HydrophobicContact CD1-CG 4.37Å; F24-K28 HydrophobicContact CE1-CD 3.56Å; F24-K28 WeakPolarHBondContact O-CB 3.19Å; F24-K28 PolarHBondContact O-N 3.4Å; F24-G32 VanDerWaalsContact CE1-O 3.25Å; F24-G32 WeakPolarHBondContact CE1-O 3.03Å; F24-D38 HydrophobicContact CE2-CB 3.9Å; F24-D38 WeakPolarHBondContact CE2-OD1 3.13Å; F24-D38 HydrophobicContact CZ-CB 4.37Å; F24-D38 WeakPolarHBondContact CZ-OD1 3.23Å
25	V	62.3	Low	55.2	Low	109 Å²	109	76 Å²	76	66%	0.661	42%	0.417	S	S	*	.	H	α-helix	trans	-63.6	-37.2	179.1	169.1	0	0	0	0	111.1	I21 Y22	I21-V25 HydrophobicContact CG2-CG2 4.38Å; I21-V25 WeakPolarHBondContact O-CG2 3.48Å; I21-V25 PolarHBondContact O-N 3.39Å; Y22-V25 PolarHBondContact O-N 3.17Å
26	F	54.9	Low	54.2	Low	112 Å²	112	85.9 Å²	85.9	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-77.7	-27.4	177.1	-78.4	-82	0	0	0	113.8	Y22 F24 S242	Y22-F26 HydrophobicContact CD2-CD2 4.07Å; Y22-F26 AromaticContact CD2-CE2 3.82Å; Y22-F26 HydrophobicContact CD2-CE2 3.82Å; Y22-F26 HydrophobicContact CE1-CD2 4.29Å; Y22-F26 AromaticContact CE2-CD2 3.7Å; Y22-F26 HydrophobicContact CE2-CD2 3.7Å; Y22-F26 AromaticContact CE2-CE2 3.31Å; Y22-F26 HydrophobicContact CE2-CE2 3.31Å; Y22-F26 HydrophobicContact CE2-CZ 4.28Å; Y22-F26 AromaticContact CZ-CD2 3.76Å; Y22-F26 AromaticContact CZ-CE2 3.76Å; Y22-F26 WeakPolarHBondContact O-CD2 3.33Å; Y22-F26 PolarHBondContact O-N 3.39Å; F24-F26 VanDerWaalsContact C-N 3.3Å; F24-F26 PolarHBondContact O-N 2.93Å; F26-S242 WeakPolarHBondContact CE1-OG 3.24Å; F26-S242 VanDerWaalsContact CE2-CB 3.48Å; F26-S242 WeakPolarHBondContact CZ-OG 3.22Å
27	W	49.8	Very low	53.1	Low	122 Å²	122	88.3 Å²	88.3	46%	0.462	46%	0.464	S	S	.	.	H	α-helix	trans	-111	-7.5	-174.7	-100.9	-36.7	0	0	0	117.1	S23 F24 A42	S23-W27 WeakPolarHBondContact O-CB 3.45Å; S23-W27 PolarHBondContact O-N 3.36Å; S23-W27 VanDerWaalsContact O-N 3.12Å; F24-W27 PolarHBondContact O-N 2.97Å; W27-A42 HydrophobicContact CE3-CB 4.36Å; W27-A42 HydrophobicContact CH2-CB 3.56Å; W27-A42 HydrophobicContact CZ2-CB 3.74Å; W27-A42 HydrophobicContact CZ3-CB 3.89Å
28	K	49.4	Very low	52.2	Low	44 Å²	44	87.5 Å²	87.5	19%	0.191	46%	0.458	C	S	.	.			trans	-118	101.8	178.9	-83	-171.9	-179.7	-171.4	0	113.7	F24 A30 A31 G32	F24-K28 HydrophobicContact CD1-CD 3.55Å; F24-K28 HydrophobicContact CD1-CG 4.37Å; F24-K28 HydrophobicContact CE1-CD 3.56Å; F24-K28 WeakPolarHBondContact O-CB 3.19Å; F24-K28 PolarHBondContact O-N 3.4Å; K28-A30 VanDerWaalsContact CD-C 3.4Å; K28-A30 WeakPolarHBondContact CD-O 3.38Å; K28-A30 WeakPolarHBondContact CE-O 3.28Å; K28-A30 WeakPolarHBondContact CG-O 3.32Å; K28-A30 PolarHBondContact NZ-O 2.77Å; K28-A30 VanDerWaalsContact NZ-O 3.16Å; K28-A31 PolarHBondContact NZ-O 3.34Å; K28-G32 PolarHBondContact NZ-O 2.94Å; K28-G32 VanDerWaalsContact NZ-O 3.07Å
29	K	43.5	Very low	51.3	Low	213 Å²	213	84.9 Å²	84.9	93%	0.926	45%	0.445	S	S	*	.	S	Bend		-86.1	91.9	104.6	-87.2	-149.8	178.9	-175.2	0	109.1
30	A	37.8	Very low	50.5	Low	47 Å²	47	86.1 Å²	86.1	39%	0.388	46%	0.456	S	S	.	.	S	Bend	trans	166.5	79.1	151.3	0	0	0	0	0	112.1	K28 M41	K28-A30 VanDerWaalsContact CD-C 3.4Å; K28-A30 WeakPolarHBondContact CD-O 3.38Å; K28-A30 WeakPolarHBondContact CE-O 3.28Å; K28-A30 WeakPolarHBondContact CG-O 3.32Å; K28-A30 PolarHBondContact NZ-O 2.77Å; K28-A30 VanDerWaalsContact NZ-O 3.16Å; A30-M41 HydrophobicContact CB-CE 3.54Å
31	A	38.6	Very low	50.1	Low	86 Å²	86	87.1 Å²	87.1	71%	0.711	46%	0.461	S	S	*	.			trans	50.6	116.7	148.2	0	0	0	0	0	121.9	K28	K28-A31 PolarHBondContact NZ-O 3.34Å
32	G	37.3	Very low	49.5	Very low	48 Å²	48	82.9 Å²	82.9	50%	0.495	44%	0.439	S	S	.	.			trans	101.4	142	133.7	0	0	0	0	0	118.2	F24 K28	F24-G32 VanDerWaalsContact CE1-O 3.25Å; F24-G32 WeakPolarHBondContact CE1-O 3.03Å; K28-G32 PolarHBondContact NZ-O 2.94Å; K28-G32 VanDerWaalsContact NZ-O 3.07Å
33	F	37.3	Very low	48.9	Very low	200 Å²	200	83.6 Å²	83.6	88%	0.877	45%	0.446	S	S	*	.			trans	-53.7	161.5	-162.8	-123.3	-113.4	0	0	0	119	G35	F33-G35 PolarHBondContact O-N 3.19Å
34	C	49.7	Very low	48.8	Very low	93 Å²	93	86.4 Å²	86.4	63%	0.628	46%	0.458	S	S	*	.	S	Bend	trans	-28.7	114.9	178.3	-163.5	0	0	0	0	116.5
35	G	42.8	Very low	48.8	Very low	45 Å²	45	87.6 Å²	87.6	46%	0.464	47%	0.468	S	S	.	.	S	Bend	trans	145.1	107.9	164	0	0	0	0	0	113.3	F33 Q37	F33-G35 PolarHBondContact O-N 3.19Å; G35-Q37 PolarHBondContact O-N 3.34Å
36	R	48.1	Very low	48.6	Very low	239 Å²	239	82.4 Å²	82.4	90%	0.902	44%	0.436	S	S	*	.	S	Bend	trans	65.4	-10.8	165.9	-167.1	173.4	-88	173.7	-7.2	117
37	Q	42.4	Very low	49.2	Very low	114 Å²	114	80.8 Å²	80.8	53%	0.533	44%	0.436	S	S	.	.			trans	-98.4	-21.5	-169.2	-136.1	152.7	-1.2	0	0	114.9	G35 V39 A40 M41	G35-Q37 PolarHBondContact O-N 3.34Å; Q37-V39 VanDerWaalsContact C-N 3.35Å; Q37-A40 WeakPolarHBondContact O-CB 3.26Å; Q37-A40 PolarHBondContact O-N 3.44Å; Q37-M41 PolarHBondContact O-N 2.95Å
38	D	47.2	Very low	49.9	Very low	49 Å²	49	79.6 Å²	79.6	26%	0.262	44%	0.437	S	S	.	.	H	α-helix	trans	-70.8	-35.5	-176.1	-17.7	-29.7	0	0	0	111	F24	F24-D38 HydrophobicContact CE2-CB 3.9Å; F24-D38 WeakPolarHBondContact CE2-OD1 3.13Å; F24-D38 HydrophobicContact CZ-CB 4.37Å; F24-D38 WeakPolarHBondContact CZ-OD1 3.23Å
39	V	50.5	Low	50.5	Low	27 Å²	27	80.4 Å²	80.4	16%	0.164	44%	0.443	C	S	.	.	H	α-helix	trans	-68.3	-38.4	173.9	-152.2	0	0	0	0	111.9	Q37 M41 A42 L43 C93	Q37-V39 VanDerWaalsContact C-N 3.35Å; V39-M41 VanDerWaalsContact C-N 3.26Å; V39-M41 PolarHBondContact O-N 3.02Å; V39-A42 PolarHBondContact O-N 3.27Å; V39-L43 HydrophobicContact CG1-CD1 4.03Å; V39-L43 WeakPolarHBondContact O-CB 3.18Å; V39-L43 PolarHBondContact O-N 3.5Å; V39-C93 HydrophobicContact CB-CB 3.89Å; V39-C93 HydrophobicContact CG1-CB 3.17Å; V39-C93 HydrophobicContact CG2-CB 3.5Å; V39-C93 WeakPolarHBondContact CG2-SG 3.31Å
40	A	51.1	Low	51.4	Low	37 Å²	37	72.1 Å²	72.1	31%	0.306	41%	0.409	S	S	.	.	H	α-helix	trans	-64.4	-35.7	-177.3	0	0	0	0	0	110.2	Q37 L43 I44	Q37-A40 WeakPolarHBondContact O-CB 3.26Å; Q37-A40 PolarHBondContact O-N 3.44Å; A40-L43 PolarHBondContact O-N 2.94Å; A40-I44 VanDerWaalsContact O-CB 3.3Å; A40-I44 WeakPolarHBondContact O-CB 3.43Å; A40-I44 VanDerWaalsContact O-CD1 3.23Å; A40-I44 WeakPolarHBondContact O-CD1 3.47Å; A40-I44 WeakPolarHBondContact O-CG1 3.27Å; A40-I44 PolarHBondContact O-N 3.34Å
41	M	53.3	Low	52.7	Low	53 Å²	53	72.5 Å²	72.5	26%	0.261	41%	0.412	S	S	.	.	H	α-helix	trans	-74.6	-36.6	179	-60.5	-62	-86.2	0	0	113.2	A30 Q37 V39 I44 T45	A30-M41 HydrophobicContact CB-CE 3.54Å; Q37-M41 PolarHBondContact O-N 2.95Å; V39-M41 VanDerWaalsContact C-N 3.26Å; V39-M41 PolarHBondContact O-N 3.02Å; M41-I44 PolarHBondContact O-N 3.39Å; M41-I44 HydrophobicContact SD-CD1 4.03Å; M41-T45 WeakPolarHBondContact O-CB 3.11Å; M41-T45 PolarHBondContact O-N 2.98Å; M41-T45 PolarHBondContact O-OG1 3.38Å
42	A	52.8	Low	53.8	Low	1 Å²	1	72.2 Å²	72.2	1%	0.008	40%	0.401	C	S	.	.	H	α-helix	trans	-66	-39.8	171.1	0	0	0	0	0	111.5	W27 V39 G46	W27-A42 HydrophobicContact CE3-CB 4.36Å; W27-A42 HydrophobicContact CH2-CB 3.56Å; W27-A42 HydrophobicContact CZ2-CB 3.74Å; W27-A42 HydrophobicContact CZ3-CB 3.89Å; V39-A42 PolarHBondContact O-N 3.27Å; A42-G46 PolarHBondContact O-N 3.27Å
43	L	55.8	Low	54.8	Low	54 Å²	54	70 Å²	70	28%	0.283	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-44.3	171.5	-87.2	158.2	0	0	0	111.8	V39 A40 V47 V86 L90	V39-L43 HydrophobicContact CG1-CD1 4.03Å; V39-L43 WeakPolarHBondContact O-CB 3.18Å; V39-L43 PolarHBondContact O-N 3.5Å; A40-L43 PolarHBondContact O-N 2.94Å; L43-V47 WeakPolarHBondContact O-CA 3.43Å; L43-V47 WeakPolarHBondContact O-CB 3.33Å; L43-V47 WeakPolarHBondContact O-CG2 3.34Å; L43-V47 PolarHBondContact O-N 3.3Å; L43-V86 HydrophobicContact CD2-CG1 4.12Å; L43-L90 HydrophobicContact CD1-CD2 3.92Å; L43-L90 HydrophobicContact CD2-CD2 3.89Å; L43-L90 HydrophobicContact CD2-CG 4.13Å; L43-L90 HydrophobicContact CG-CD2 4.21Å
44	I	61	Low	56	Low	87 Å²	87	63.2 Å²	63.2	45%	0.446	35%	0.354	S	S	.	.	H	α-helix	trans	-65.6	-46.7	178.9	-70.9	158.4	0	0	0	110	A40 M41 V47 I48	A40-I44 VanDerWaalsContact O-CB 3.3Å; A40-I44 WeakPolarHBondContact O-CB 3.43Å; A40-I44 VanDerWaalsContact O-CD1 3.23Å; A40-I44 WeakPolarHBondContact O-CD1 3.47Å; A40-I44 WeakPolarHBondContact O-CG1 3.27Å; A40-I44 PolarHBondContact O-N 3.34Å; M41-I44 PolarHBondContact O-N 3.39Å; M41-I44 HydrophobicContact SD-CD1 4.03Å; I44-V47 PolarHBondContact O-N 3.03Å; I44-I48 HydrophobicContact CG2-CD1 3.62Å; I44-I48 HydrophobicContact CG2-CG1 4.34Å; I44-I48 WeakPolarHBondContact O-CB 3.37Å; I44-I48 WeakPolarHBondContact O-CD1 3.5Å; I44-I48 WeakPolarHBondContact O-CG1 3.46Å; I44-I48 PolarHBondContact O-N 3.45Å
45	T	59.1	Low	56.6	Low	59 Å²	59	67.6 Å²	67.6	36%	0.362	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-43.7	178.6	-49	0	0	0	0	111.1	M41 I48 L49	M41-T45 WeakPolarHBondContact O-CB 3.11Å; M41-T45 PolarHBondContact O-N 2.98Å; M41-T45 PolarHBondContact O-OG1 3.38Å; T45-I48 PolarHBondContact O-N 2.89Å; T45-L49 HydrophobicContact CG2-CD1 4.35Å; T45-L49 WeakPolarHBondContact O-CB 3.31Å; T45-L49 WeakPolarHBondContact O-CG 3.19Å; T45-L49 PolarHBondContact O-N 3.49Å
46	G	59.2	Low	57.1	Low	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-38.5	175.7	0	0	0	0	0	112.9	A42 L49 L50	A42-G46 PolarHBondContact O-N 3.27Å; G46-L49 PolarHBondContact O-N 3.43Å; G46-L50 WeakPolarHBondContact O-CB 3.2Å; G46-L50 VanDerWaalsContact O-CG 3.23Å; G46-L50 WeakPolarHBondContact O-CG 3.48Å; G46-L50 PolarHBondContact O-N 3.04Å
47	V	66.7	Low	57.3	Low	79 Å²	79	59.3 Å²	59.3	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-69.4	-34.9	174.6	168.2	0	0	0	0	111	L43 I44 A51	L43-V47 WeakPolarHBondContact O-CA 3.43Å; L43-V47 WeakPolarHBondContact O-CB 3.33Å; L43-V47 WeakPolarHBondContact O-CG2 3.34Å; L43-V47 PolarHBondContact O-N 3.3Å; I44-V47 PolarHBondContact O-N 3.03Å; V47-A51 WeakPolarHBondContact O-CA 3.05Å; V47-A51 WeakPolarHBondContact O-CB 3.4Å; V47-A51 PolarHBondContact O-N 2.9Å
48	I	64.7	Low	57.7	Low	97 Å²	97	59 Å²	59	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-67.4	-46.5	172.1	-70.5	165	0	0	0	110	I44 T45 L50 A51 V52	I44-I48 HydrophobicContact CG2-CD1 3.62Å; I44-I48 HydrophobicContact CG2-CG1 4.34Å; I44-I48 WeakPolarHBondContact O-CB 3.37Å; I44-I48 WeakPolarHBondContact O-CD1 3.5Å; I44-I48 WeakPolarHBondContact O-CG1 3.46Å; I44-I48 PolarHBondContact O-N 3.45Å; T45-I48 PolarHBondContact O-N 2.89Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.32Å; I48-A51 CarbonylContact O-C 3.29Å; I48-A51 PolarHBondContact O-N 3.46Å; I48-V52 HydrophobicContact CG2-CG2 4.38Å; I48-V52 WeakPolarHBondContact O-CB 3.09Å; I48-V52 VanDerWaalsContact O-CG2 3.26Å; I48-V52 WeakPolarHBondContact O-CG2 3.22Å; I48-V52 PolarHBondContact O-N 3.33Å
49	L	60.9	Low	58.1	Low	60 Å²	60	58.1 Å²	58.1	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-38.4	176.5	-74.3	172.1	0	0	0	112.1	T45 G46 G53 I85	T45-L49 HydrophobicContact CG2-CD1 4.35Å; T45-L49 WeakPolarHBondContact O-CB 3.31Å; T45-L49 WeakPolarHBondContact O-CG 3.19Å; T45-L49 PolarHBondContact O-N 3.49Å; G46-L49 PolarHBondContact O-N 3.43Å; L49-G53 PolarHBondContact O-N 3.41Å; L49-I85 HydrophobicContact CD1-CD1 3.59Å
50	L	62.7	Low	57.8	Low	39 Å²	39	59.1 Å²	59.1	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-43	170.2	-80	-179.2	0	0	0	111.3	G46 I48 V52 G53 V54 T83 V86	G46-L50 WeakPolarHBondContact O-CB 3.2Å; G46-L50 VanDerWaalsContact O-CG 3.23Å; G46-L50 WeakPolarHBondContact O-CG 3.48Å; G46-L50 PolarHBondContact O-N 3.04Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.32Å; L50-V52 VanDerWaalsContact C-N 3.31Å; L50-V52 PolarHBondContact O-N 3.42Å; L50-G53 PolarHBondContact O-N 2.87Å; L50-V54 WeakPolarHBondContact O-CA 3.23Å; L50-V54 WeakPolarHBondContact O-CB 3.17Å; L50-V54 WeakPolarHBondContact O-CG2 3.4Å; L50-V54 PolarHBondContact O-N 3.31Å; L50-T83 VanDerWaalsContact CD2-N 3.27Å; L50-T83 VanDerWaalsContact CD2-OG1 3.27Å; L50-T83 WeakPolarHBondContact CD2-OG1 3.39Å; L50-V86 HydrophobicContact CD1-CB 4.14Å; L50-V86 HydrophobicContact CD1-CG2 3.54Å; L50-V86 HydrophobicContact CG-CG2 4.16Å
51	A	64.9	Low	57.3	Low	55 Å²	55	58.8 Å²	58.8	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-65.5	-36.9	177.6	0	0	0	0	0	110.8	V47 I48 W55	V47-A51 WeakPolarHBondContact O-CA 3.05Å; V47-A51 WeakPolarHBondContact O-CB 3.4Å; V47-A51 PolarHBondContact O-N 2.9Å; I48-A51 CarbonylContact O-C 3.29Å; I48-A51 PolarHBondContact O-N 3.46Å; A51-W55 WeakPolarHBondContact O-CA 3.32Å; A51-W55 WeakPolarHBondContact O-CB 3.23Å; A51-W55 PolarHBondContact O-N 3.01Å
52	V	62.4	Low	57	Low	80 Å²	80	61 Å²	61	49%	0.485	34%	0.339	S	S	.	.	H	α-helix	trans	-70.9	-41.5	173.7	171	0	0	0	0	111.2	I48 L50 G56	I48-V52 HydrophobicContact CG2-CG2 4.38Å; I48-V52 WeakPolarHBondContact O-CB 3.09Å; I48-V52 VanDerWaalsContact O-CG2 3.26Å; I48-V52 WeakPolarHBondContact O-CG2 3.22Å; I48-V52 PolarHBondContact O-N 3.33Å; L50-V52 VanDerWaalsContact C-N 3.31Å; L50-V52 PolarHBondContact O-N 3.42Å; V52-G56 PolarHBondContact O-N 3.36Å
53	G	58.4	Low	56.5	Low	2 Å²	2	65.8 Å²	65.8	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-69.6	-41.6	176.8	0	0	0	0	0	112.5	L49 L50 G56 K57 I79	L49-G53 PolarHBondContact O-N 3.41Å; L50-G53 PolarHBondContact O-N 2.87Å; G53-G56 CarbonylContact O-C 3.55Å; G53-G56 PolarHBondContact O-N 2.94Å; G53-K57 VanDerWaalsContact O-CB 3.3Å; G53-K57 WeakPolarHBondContact O-CB 3.31Å; G53-K57 PolarHBondContact O-N 3.5Å; G53-I79 WeakPolarHBondContact O-CD1 3.38Å; G53-I79 VanDerWaalsContact O-CG1 3.24Å; G53-I79 WeakPolarHBondContact O-CG1 3.3Å
54	V	61.8	Low	55.7	Low	58 Å²	58	66.4 Å²	66.4	35%	0.352	36%	0.361	S	S	.	.	H	α-helix	trans	-71.5	-39.3	174.7	172.5	0	0	0	0	110	L50 G56 K57 L58	L50-V54 WeakPolarHBondContact O-CA 3.23Å; L50-V54 WeakPolarHBondContact O-CB 3.17Å; L50-V54 WeakPolarHBondContact O-CG2 3.4Å; L50-V54 PolarHBondContact O-N 3.31Å; V54-G56 VanDerWaalsContact C-N 3.34Å; V54-K57 CarbonylContact O-C 3.55Å; V54-K57 PolarHBondContact O-N 2.91Å; V54-L58 HydrophobicContact CG1-CD1 3.52Å; V54-L58 HydrophobicContact CG1-CG 3.8Å; V54-L58 WeakPolarHBondContact O-CA 3.09Å; V54-L58 WeakPolarHBondContact O-CB 3.46Å; V54-L58 WeakPolarHBondContact O-CG 3.09Å; V54-L58 PolarHBondContact O-N 3.32Å
55	W	62.5	Low	54.6	Low	185 Å²	185	67.2 Å²	67.2	70%	0.701	37%	0.374	S	S	*	.	H	α-helix	trans	-60	-47.7	169.1	-179.2	-94	0	0	0	109.8	A51 K57 L58 T59	A51-W55 WeakPolarHBondContact O-CA 3.32Å; A51-W55 WeakPolarHBondContact O-CB 3.23Å; A51-W55 PolarHBondContact O-N 3.01Å; W55-K57 VanDerWaalsContact C-N 3.27Å; W55-K57 PolarHBondContact O-N 3.38Å; W55-L58 PolarHBondContact O-N 2.96Å; W55-T59 WeakPolarHBondContact O-CB 3.45Å; W55-T59 PolarHBondContact O-N 2.91Å; W55-T59 PolarHBondContact O-OG1 3.39Å
56	G	53.7	Low	53.6	Low	20 Å²	20	71.5 Å²	71.5	21%	0.206	39%	0.394	C	S	.	.	H	α-helix	trans	-53.9	-43.2	172.3	0	0	0	0	0	111.9	V52 G53 V54 L60	V52-G56 PolarHBondContact O-N 3.36Å; G53-G56 CarbonylContact O-C 3.55Å; G53-G56 PolarHBondContact O-N 2.94Å; V54-G56 VanDerWaalsContact C-N 3.34Å; G56-L60 WeakPolarHBondContact O-CB 3.4Å; G56-L60 WeakPolarHBondContact O-CD1 3.46Å; G56-L60 PolarHBondContact O-N 3.4Å
57	K	51.3	Low	52.7	Low	90 Å²	90	76.5 Å²	76.5	39%	0.391	42%	0.419	S	S	.	.	H	α-helix	trans	-84.3	-18.9	180	-172.9	-100.5	178.9	-173.9	0	115.6	G53 V54 W55 L60 G61 I79	G53-K57 VanDerWaalsContact O-CB 3.3Å; G53-K57 WeakPolarHBondContact O-CB 3.31Å; G53-K57 PolarHBondContact O-N 3.5Å; V54-K57 CarbonylContact O-C 3.55Å; V54-K57 PolarHBondContact O-N 2.91Å; W55-K57 VanDerWaalsContact C-N 3.27Å; W55-K57 PolarHBondContact O-N 3.38Å; K57-L60 CarbonylContact O-C 3.42Å; K57-G61 WeakPolarHBondContact O-CA 3.03Å; K57-G61 PolarHBondContact O-N 3.28Å; K57-I79 HydrophobicContact CB-CD1 3.3Å; K57-I79 HydrophobicContact CB-CG1 4.44Å; K57-I79 HydrophobicContact CD-CD1 4.41Å; K57-I79 HydrophobicContact CG-CD1 3.64Å
58	L	52.3	Low	51.4	Low	108 Å²	108	77.3 Å²	77.3	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-86.5	-35.4	173.8	-74.6	176	0	0	0	109.6	V54 W55 G61	V54-L58 HydrophobicContact CG1-CD1 3.52Å; V54-L58 HydrophobicContact CG1-CG 3.8Å; V54-L58 WeakPolarHBondContact O-CA 3.09Å; V54-L58 WeakPolarHBondContact O-CB 3.46Å; V54-L58 WeakPolarHBondContact O-CG 3.09Å; V54-L58 PolarHBondContact O-N 3.32Å; W55-L58 PolarHBondContact O-N 2.96Å; L58-G61 PolarHBondContact O-N 3.43Å
59	T	54.5	Low	50.3	Low	30 Å²	30	81.1 Å²	81.1	18%	0.184	45%	0.45	C	S	.	.	H	α-helix	trans	-61.3	-53.3	164.8	-53	0	0	0	0	108.2	W55 G61 T62 Y63 E152	W55-T59 WeakPolarHBondContact O-CB 3.45Å; W55-T59 PolarHBondContact O-N 2.91Å; W55-T59 PolarHBondContact O-OG1 3.39Å; T59-G61 VanDerWaalsContact C-N 3.32Å; T59-G61 PolarHBondContact O-N 3.44Å; T59-T62 PolarHBondContact O-OG1 2.81Å; T59-Y63 WeakPolarHBondContact O-CD2 3.15Å; T59-E152 VanDerWaalsContact C-OE2 3.29Å; T59-E152 VanDerWaalsContact CG2-CD 3.46Å; T59-E152 WeakPolarHBondContact CG2-OE1 3.34Å; T59-E152 VanDerWaalsContact O-OE1 3.06Å
60	L	44.3	Very low	49.3	Very low	48 Å²	48	84.9 Å²	84.9	25%	0.251	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-70.6	-16.4	171.7	-92.3	80.5	0	0	0	115.5	G56 K57 T62 Y63 I64 P75	G56-L60 WeakPolarHBondContact O-CB 3.4Å; G56-L60 WeakPolarHBondContact O-CD1 3.46Å; G56-L60 PolarHBondContact O-N 3.4Å; K57-L60 CarbonylContact O-C 3.42Å; L60-T62 PolarHBondContact O-N 2.84Å; L60-Y63 CarbonylContact O-C 3.57Å; L60-Y63 WeakPolarHBondContact O-CA 3.48Å; L60-Y63 WeakPolarHBondContact O-CB 3.41Å; L60-Y63 PolarHBondContact O-N 3.32Å; L60-I64 WeakPolarHBondContact O-CG1 3.3Å; L60-I64 PolarHBondContact O-N 2.78Å; L60-P75 HydrophobicContact CD2-CB 4.29Å; L60-P75 HydrophobicContact CD2-CG 3.46Å; L60-P75 VanDerWaalsContact CD2-CG 3.46Å
61	G	41.7	Very low	48.4	Very low	30 Å²	30	87.1 Å²	87.1	31%	0.309	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-75.9	-28.8	-163.2	0	0	0	0	0	113.3	K57 L58 T59 Y63	K57-G61 WeakPolarHBondContact O-CA 3.03Å; K57-G61 PolarHBondContact O-N 3.28Å; L58-G61 PolarHBondContact O-N 3.43Å; T59-G61 VanDerWaalsContact C-N 3.32Å; T59-G61 PolarHBondContact O-N 3.44Å; G61-Y63 PolarHBondContact O-N 2.93Å
62	T	45.4	Very low	47.8	Very low	98 Å²	98	89.1 Å²	89.1	60%	0.601	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-72.8	-10.5	166.9	34.8	0	0	0	0	113	T59 L60	T59-T62 PolarHBondContact O-OG1 2.81Å; L60-T62 PolarHBondContact O-N 2.84Å
63	Y	42.8	Very low	47.7	Very low	102 Å²	102	90 Å²	90	40%	0.4	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-19.6	-176.8	-65.3	-88.4	0	0	0	114.7	T59 L60 G61 S65 L66 I67 E152	T59-Y63 WeakPolarHBondContact O-CD2 3.15Å; L60-Y63 CarbonylContact O-C 3.57Å; L60-Y63 WeakPolarHBondContact O-CA 3.48Å; L60-Y63 WeakPolarHBondContact O-CB 3.41Å; L60-Y63 PolarHBondContact O-N 3.32Å; G61-Y63 PolarHBondContact O-N 2.93Å; Y63-S65 VanDerWaalsContact C-N 3.29Å; Y63-S65 PolarHBondContact O-N 2.87Å; Y63-L66 PolarHBondContact O-N 2.85Å; Y63-L66 VanDerWaalsContact O-N 3.16Å; Y63-I67 PolarHBondContact O-N 3.47Å; Y63-E152 HydrophobicContact CD2-CG 4.29Å; Y63-E152 HydrophobicContact CE2-CG 3.77Å; Y63-E152 VanDerWaalsContact CE2-OE1 3.27Å; Y63-E152 WeakPolarHBondContact CE2-OE1 3.35Å
64	I	39.6	Very low	47.6	Very low	68 Å²	68	92.7 Å²	92.7	35%	0.349	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-22.3	176.6	-66.8	-169	0	0	0	112.8	L60 L66 Y76	L60-I64 WeakPolarHBondContact O-CG1 3.3Å; L60-I64 PolarHBondContact O-N 2.78Å; I64-L66 PolarHBondContact O-N 3.45Å; I64-Y76 HydrophobicContact CD1-CE2 3.74Å; I64-Y76 WeakPolarHBondContact CD1-OH 3.46Å
65	S	38.6	Very low	47.5	Very low	104 Å²	104	91 Å²	91	73%	0.727	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.2	170.4	35.7	0	0	0	0	114.3	Y63	Y63-S65 VanDerWaalsContact C-N 3.29Å; Y63-S65 PolarHBondContact O-N 2.87Å
66	L	37.1	Very low	47.6	Very low	148 Å²	148	87.3 Å²	87.3	78%	0.775	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-10.7	179.6	-85	158.5	0	0	0	114	Y63 I64	Y63-L66 PolarHBondContact O-N 2.85Å; Y63-L66 VanDerWaalsContact O-N 3.16Å; I64-L66 PolarHBondContact O-N 3.45Å
67	I	39.9	Very low	48.2	Very low	105 Å²	105	90.8 Å²	90.8	54%	0.538	51%	0.514	S	S	.	.			trans	-122.4	63	-177.1	-50.3	169.7	0	0	0	108.8	Y63 E69	Y63-I67 PolarHBondContact O-N 3.47Å; I67-E69 PolarHBondContact O-N 3.03Å; I67-E69 VanDerWaalsContact O-N 3.1Å
68	A	39.6	Very low	48.7	Very low	97 Å²	97	90.4 Å²	90.4	80%	0.802	52%	0.516	S	S	*	.			trans	-70.9	89.1	149.6	0	0	0	0	0	106.2
69	E	40.8	Very low	49.4	Very low	176 Å²	176	86.8 Å²	86.8	82%	0.822	50%	0.497	S	S	*	.	S	Bend	trans	176.4	-21	137.4	-97.5	174.9	-169.1	0	0	115.8	I67	I67-E69 PolarHBondContact O-N 3.03Å; I67-E69 VanDerWaalsContact O-N 3.1Å
70	N	41.8	Very low	50.2	Low	139 Å²	139	87 Å²	87	74%	0.743	51%	0.505	S	S	*	.			trans	-139.5	91.4	179.9	-76.3	-57.6	0	0	0	113.4
71	S	43.3	Very low	51.3	Low	86 Å²	86	88.2 Å²	88.2	60%	0.601	51%	0.514	S	S	*	.			trans	-69.8	118.2	-176.8	49.6	0	0	0	0	114	N73	S71-N73 PolarHBondContact O-N 3.22Å
72	T	52.3	Low	52.4	Low	98 Å²	98	86.8 Å²	86.8	60%	0.601	50%	0.5	S	S	*	.			trans	-78.8	104.2	156.8	-21.9	0	0	0	0	108	A74 P75	T72-A74 PolarHBondContact O-N 3.47Å; T72-P75 WeakPolarHBondContact O-CD 3.38Å
73	N	59	Low	53.8	Low	99 Å²	99	85 Å²	85	53%	0.529	49%	0.489	S	S	.	.			trans	-72.6	-10.6	-176.2	-66.9	-40.3	0	0	0	114.3	S71 Y76 V77	S71-N73 PolarHBondContact O-N 3.22Å; N73-Y76 PolarHBondContact O-N 2.76Å; N73-V77 WeakPolarHBondContact O-CG2 3.23Å; N73-V77 PolarHBondContact O-N 3.45Å
74	A	57	Low	55.1	Low	58 Å²	58	83.2 Å²	83.2	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-53.8	-51.6	-175.8	0	0	0	0	0	114.5	T72 Y76 V77 L78	T72-A74 PolarHBondContact O-N 3.47Å; A74-Y76 VanDerWaalsContact C-N 3.33Å; A74-Y76 PolarHBondContact O-N 3.43Å; A74-V77 WeakPolarHBondContact O-CB 3.43Å; A74-V77 PolarHBondContact O-N 2.86Å; A74-L78 WeakPolarHBondContact O-CD1 3.23Å; A74-L78 PolarHBondContact O-N 2.73Å
75	P	59.4	Low	56.6	Low	21 Å²	21	82.2 Å²	82.2	14%	0.136	48%	0.484	C	S	.	.	H	α-helix	trans	-63.6	-33.9	178.5	16.7	-27.7	0	0	0	113.6	L60 T72 L78 I79	L60-P75 HydrophobicContact CD2-CB 4.29Å; L60-P75 HydrophobicContact CD2-CG 3.46Å; L60-P75 VanDerWaalsContact CD2-CG 3.46Å; T72-P75 WeakPolarHBondContact O-CD 3.38Å; P75-L78 PolarHBondContact O-N 3.02Å; P75-I79 VanDerWaalsContact O-CG1 3.31Å; P75-I79 WeakPolarHBondContact O-CG1 3.42Å; P75-I79 PolarHBondContact O-N 3.29Å
76	Y	65	Low	58	Low	109 Å²	109	78.2 Å²	78.2	43%	0.427	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-39.4	174.3	-72	-75.4	0	0	0	112.3	I64 N73 A74 I79 G80	I64-Y76 HydrophobicContact CD1-CE2 3.74Å; I64-Y76 WeakPolarHBondContact CD1-OH 3.46Å; N73-Y76 PolarHBondContact O-N 2.76Å; A74-Y76 VanDerWaalsContact C-N 3.33Å; A74-Y76 PolarHBondContact O-N 3.43Å; Y76-I79 PolarHBondContact O-N 3.45Å; Y76-G80 PolarHBondContact O-N 3.3Å
77	V	66.8	Low	59.6	Low	92 Å²	92	74 Å²	74	56%	0.558	44%	0.435	S	S	*	.	H	α-helix	trans	-64	-42.6	174.4	174.6	0	0	0	0	110.7	N73 A74 G80 T81	N73-V77 WeakPolarHBondContact O-CG2 3.23Å; N73-V77 PolarHBondContact O-N 3.45Å; A74-V77 WeakPolarHBondContact O-CB 3.43Å; A74-V77 PolarHBondContact O-N 2.86Å; V77-G80 PolarHBondContact O-N 3.01Å; V77-T81 WeakPolarHBondContact O-CB 2.83Å; V77-T81 PolarHBondContact O-N 3.33Å; V77-T81 PolarHBondContact O-OG1 3.47Å
78	L	60.9	Low	61	Low	82 Å²	82	72.2 Å²	72.2	43%	0.429	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-45.7	175.2	-90.3	132.9	0	0	0	112.5	A74 P75 G82	A74-L78 WeakPolarHBondContact O-CD1 3.23Å; A74-L78 PolarHBondContact O-N 2.73Å; P75-L78 PolarHBondContact O-N 3.02Å; L78-G82 PolarHBondContact O-N 3.43Å
79	I	67.4	Low	62.2	Low	33 Å²	33	67.9 Å²	67.9	17%	0.169	39%	0.388	C	S	.	.	H	α-helix	trans	-64.6	-47.1	176.4	-66	163	0	0	0	111.5	G53 K57 P75 Y76 T81 G82 T83	G53-I79 WeakPolarHBondContact O-CD1 3.38Å; G53-I79 VanDerWaalsContact O-CG1 3.24Å; G53-I79 WeakPolarHBondContact O-CG1 3.3Å; K57-I79 HydrophobicContact CB-CD1 3.3Å; K57-I79 HydrophobicContact CB-CG1 4.44Å; K57-I79 HydrophobicContact CD-CD1 4.41Å; K57-I79 HydrophobicContact CG-CD1 3.64Å; P75-I79 VanDerWaalsContact O-CG1 3.31Å; P75-I79 WeakPolarHBondContact O-CG1 3.42Å; P75-I79 PolarHBondContact O-N 3.29Å; Y76-I79 PolarHBondContact O-N 3.45Å; I79-T81 VanDerWaalsContact C-N 3.3Å; I79-T81 PolarHBondContact O-N 3.03Å; I79-G82 PolarHBondContact O-N 3.35Å; I79-T83 WeakPolarHBondContact O-CB 3.25Å; I79-T83 PolarHBondContact O-N 3.48Å; I79-T83 PolarHBondContact O-OG1 2.87Å
80	G	70.7	Confident	63.4	Low	34 Å²	34	62.7 Å²	62.7	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-45	179.8	0	0	0	0	0	111.2	Y76 V77 T83 T84	Y76-G80 PolarHBondContact O-N 3.3Å; V77-G80 PolarHBondContact O-N 3.01Å; G80-T83 PolarHBondContact O-N 3.02Å; G80-T84 WeakPolarHBondContact O-CB 3.17Å; G80-T84 PolarHBondContact O-N 3.31Å; G80-T84 PolarHBondContact O-OG1 2.68Å
81	T	68.6	Low	64.5	Low	73 Å²	73	60.8 Å²	60.8	45%	0.448	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-47	176.9	-49.9	0	0	0	0	111.2	V77 I79 T83 T84 I85	V77-T81 WeakPolarHBondContact O-CB 2.83Å; V77-T81 PolarHBondContact O-N 3.33Å; V77-T81 PolarHBondContact O-OG1 3.47Å; I79-T81 VanDerWaalsContact C-N 3.3Å; I79-T81 PolarHBondContact O-N 3.03Å; T81-T83 PolarHBondContact O-N 3.25Å; T81-T84 PolarHBondContact O-N 3.44Å; T81-I85 HydrophobicContact CG2-CD1 3.97Å; T81-I85 VanDerWaalsContact O-CG1 3.27Å; T81-I85 WeakPolarHBondContact O-CG1 3.37Å; T81-I85 PolarHBondContact O-N 2.97Å
82	G	64.6	Low	65.4	Low	1 Å²	1	57.6 Å²	57.6	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-42.3	177	0	0	0	0	0	113.5	L78 I79 I85 V86	L78-G82 PolarHBondContact O-N 3.43Å; I79-G82 PolarHBondContact O-N 3.35Å; G82-I85 PolarHBondContact O-N 3.08Å; G82-V86 PolarHBondContact O-N 3.36Å; G82-V86 VanDerWaalsContact O-N 3.08Å
83	T	73.5	Confident	65.8	Low	61 Å²	61	54.4 Å²	54.4	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-46.5	177.4	-51.9	0	0	0	0	110.6	L50 I79 G80 T81 I85 V86 V87	L50-T83 VanDerWaalsContact CD2-N 3.27Å; L50-T83 VanDerWaalsContact CD2-OG1 3.27Å; L50-T83 WeakPolarHBondContact CD2-OG1 3.39Å; I79-T83 WeakPolarHBondContact O-CB 3.25Å; I79-T83 PolarHBondContact O-N 3.48Å; I79-T83 PolarHBondContact O-OG1 2.87Å; G80-T83 PolarHBondContact O-N 3.02Å; T81-T83 PolarHBondContact O-N 3.25Å; T83-I85 VanDerWaalsContact C-N 3.33Å; T83-I85 PolarHBondContact O-N 2.93Å; T83-V86 PolarHBondContact O-N 2.9Å; T83-V87 HydrophobicContact CG2-CG2 4.48Å; T83-V87 VanDerWaalsContact O-CG2 3.32Å; T83-V87 WeakPolarHBondContact O-CG2 3.42Å; T83-V87 PolarHBondContact O-N 3.23Å
84	T	70.8	Confident	65.8	Low	64 Å²	64	55.7 Å²	55.7	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-43	179.7	-58.9	0	0	0	0	111.1	G80 T81 V87 F88	G80-T84 WeakPolarHBondContact O-CB 3.17Å; G80-T84 PolarHBondContact O-N 3.31Å; G80-T84 PolarHBondContact O-OG1 2.68Å; T81-T84 PolarHBondContact O-N 3.44Å; T84-V87 PolarHBondContact O-N 2.88Å; T84-F88 HydrophobicContact CG2-CD2 3.64Å; T84-F88 HydrophobicContact CG2-CE1 4.28Å; T84-F88 HydrophobicContact CG2-CE2 3.09Å; T84-F88 HydrophobicContact CG2-CG 4.44Å; T84-F88 HydrophobicContact CG2-CZ 3.46Å; T84-F88 VanDerWaalsContact CG2-CZ 3.46Å; T84-F88 WeakPolarHBondContact O-CB 3.49Å; T84-F88 WeakPolarHBondContact O-CD2 3.2Å; T84-F88 WeakPolarHBondContact O-CG 2.98Å; T84-F88 PolarHBondContact O-N 3.43Å
85	I	70.8	Confident	66	Low	47 Å²	47	53.2 Å²	53.2	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-43.5	176.4	-68.5	164.8	0	0	0	111.8	L49 T81 G82 T83 F88 G89	L49-I85 HydrophobicContact CD1-CD1 3.59Å; T81-I85 HydrophobicContact CG2-CD1 3.97Å; T81-I85 VanDerWaalsContact O-CG1 3.27Å; T81-I85 WeakPolarHBondContact O-CG1 3.37Å; T81-I85 PolarHBondContact O-N 2.97Å; G82-I85 PolarHBondContact O-N 3.08Å; T83-I85 VanDerWaalsContact C-N 3.33Å; T83-I85 PolarHBondContact O-N 2.93Å; I85-F88 PolarHBondContact O-N 2.99Å; I85-G89 PolarHBondContact O-N 3.4Å
86	V	67.8	Low	65.9	Low	20 Å²	20	54.8 Å²	54.8	12%	0.121	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-47.2	177	169.3	0	0	0	0	111.5	L43 L50 G82 T83 F88 G89 L90	L43-V86 HydrophobicContact CD2-CG1 4.12Å; L50-V86 HydrophobicContact CD1-CB 4.14Å; L50-V86 HydrophobicContact CD1-CG2 3.54Å; L50-V86 HydrophobicContact CG-CG2 4.16Å; G82-V86 PolarHBondContact O-N 3.36Å; G82-V86 VanDerWaalsContact O-N 3.08Å; T83-V86 PolarHBondContact O-N 2.9Å; V86-F88 VanDerWaalsContact C-N 3.32Å; V86-F88 PolarHBondContact O-N 3.49Å; V86-G89 PolarHBondContact O-N 3.36Å; V86-L90 HydrophobicContact CG1-CD1 4.22Å; V86-L90 WeakPolarHBondContact O-CG 2.87Å; V86-L90 PolarHBondContact O-N 3.48Å
87	V	70.9	Confident	65.5	Low	60 Å²	60	54.8 Å²	54.8	36%	0.364	32%	0.317	S	S	.	.	H	α-helix	trans	-59.5	-45.9	179.1	171.4	0	0	0	0	110.1	T83 T84 L90 F91	T83-V87 HydrophobicContact CG2-CG2 4.48Å; T83-V87 VanDerWaalsContact O-CG2 3.32Å; T83-V87 WeakPolarHBondContact O-CG2 3.42Å; T83-V87 PolarHBondContact O-N 3.23Å; T84-V87 PolarHBondContact O-N 2.88Å; V87-L90 PolarHBondContact O-N 3.49Å; V87-F91 HydrophobicContact CG1-CD2 3.66Å; V87-F91 HydrophobicContact CG1-CE2 3.53Å; V87-F91 WeakPolarHBondContact O-CD2 3.3Å; V87-F91 PolarHBondContact O-N 2.72Å
88	F	69.6	Low	65.3	Low	66 Å²	66	60 Å²	60	29%	0.289	33%	0.327	S	S	.	.	H	α-helix	trans	-67.1	-37.2	177.9	-65.8	-21.1	0	0	0	113.6	T84 I85 V86 L90 F91 G92 F110 V114	T84-F88 HydrophobicContact CG2-CD2 3.64Å; T84-F88 HydrophobicContact CG2-CE1 4.28Å; T84-F88 HydrophobicContact CG2-CE2 3.09Å; T84-F88 HydrophobicContact CG2-CG 4.44Å; T84-F88 HydrophobicContact CG2-CZ 3.46Å; T84-F88 VanDerWaalsContact CG2-CZ 3.46Å; T84-F88 WeakPolarHBondContact O-CB 3.49Å; T84-F88 WeakPolarHBondContact O-CD2 3.2Å; T84-F88 WeakPolarHBondContact O-CG 2.98Å; T84-F88 PolarHBondContact O-N 3.43Å; I85-F88 PolarHBondContact O-N 2.99Å; V86-F88 VanDerWaalsContact C-N 3.32Å; V86-F88 PolarHBondContact O-N 3.49Å; F88-L90 VanDerWaalsContact C-N 3.32Å; F88-L90 PolarHBondContact O-N 2.7Å; F88-F91 PolarHBondContact O-N 3.35Å; F88-G92 PolarHBondContact O-N 3.17Å; F88-F110 HydrophobicContact CD1-CD1 4.42Å; F88-F110 AromaticContact CE1-CD1 3.47Å; F88-F110 HydrophobicContact CE1-CD1 3.47Å; F88-F110 VanDerWaalsContact CE1-CD1 3.47Å; F88-F110 AromaticContact CE1-CE1 3.65Å; F88-F110 HydrophobicContact CE1-CE1 3.65Å; F88-F110 HydrophobicContact CE1-CG 4.03Å; F88-F110 HydrophobicContact CE1-CZ 4.33Å; F88-F110 AromaticContact CZ-CD1 3.71Å; F88-F110 HydrophobicContact CZ-CD1 3.71Å; F88-F110 HydrophobicContact CZ-CE1 4.13Å; F88-F110 HydrophobicContact CZ-CG 4.46Å; F88-V114 HydrophobicContact CE2-CG2 4.18Å
89	G	64.7	Low	65.4	Low	6 Å²	6	57.1 Å²	57.1	6%	0.062	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-42.9	173.3	0	0	0	0	0	112.3	I85 V86 C93	I85-G89 PolarHBondContact O-N 3.4Å; V86-G89 PolarHBondContact O-N 3.36Å; G89-C93 PolarHBondContact O-N 3.38Å
90	L	66	Low	65.5	Low	67 Å²	67	57.4 Å²	57.4	35%	0.351	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-46.7	175.4	-70.2	170.4	0	0	0	111.7	L43 V86 V87 F88 G92 C93 F94	L43-L90 HydrophobicContact CD1-CD2 3.92Å; L43-L90 HydrophobicContact CD2-CD2 3.89Å; L43-L90 HydrophobicContact CD2-CG 4.13Å; L43-L90 HydrophobicContact CG-CD2 4.21Å; V86-L90 HydrophobicContact CG1-CD1 4.22Å; V86-L90 WeakPolarHBondContact O-CG 2.87Å; V86-L90 PolarHBondContact O-N 3.48Å; V87-L90 PolarHBondContact O-N 3.49Å; F88-L90 VanDerWaalsContact C-N 3.32Å; F88-L90 PolarHBondContact O-N 2.7Å; L90-G92 PolarHBondContact O-N 3.17Å; L90-C93 PolarHBondContact O-N 2.77Å; L90-F94 WeakPolarHBondContact O-CD2 3.24Å; L90-F94 PolarHBondContact O-N 2.75Å; L90-F94 VanDerWaalsContact O-N 3.15Å
91	F	65.6	Low	65.6	Low	100 Å²	100	56.9 Å²	56.9	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-63.4	-40.8	178.8	-83.9	-68.3	0	0	0	113.2	V87 F88 C93 F94 A95	V87-F91 HydrophobicContact CG1-CD2 3.66Å; V87-F91 HydrophobicContact CG1-CE2 3.53Å; V87-F91 WeakPolarHBondContact O-CD2 3.3Å; V87-F91 PolarHBondContact O-N 2.72Å; F88-F91 PolarHBondContact O-N 3.35Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.77Å; F91-F94 PolarHBondContact O-N 3.42Å; F91-A95 VanDerWaalsContact O-CB 3.26Å; F91-A95 WeakPolarHBondContact O-CB 3.32Å; F91-A95 PolarHBondContact O-N 2.86Å
92	G	62.3	Low	66	Low	18 Å²	18	61.9 Å²	61.9	19%	0.186	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-37.9	178.1	0	0	0	0	0	113.2	F88 L90 T96	F88-G92 PolarHBondContact O-N 3.17Å; L90-G92 PolarHBondContact O-N 3.17Å; G92-T96 PolarHBondContact O-N 3.33Å; G92-T96 PolarHBondContact O-OG1 2.86Å
93	C	59.9	Low	66.3	Low	32 Å²	32	63.4 Å²	63.4	22%	0.216	33%	0.33	C	S	.	.	H	α-helix	trans	-66.3	-49.6	173.3	170.2	0	0	0	0	112.6	V39 G89 L90 F91 A95 T96 C97	V39-C93 HydrophobicContact CB-CB 3.89Å; V39-C93 HydrophobicContact CG1-CB 3.17Å; V39-C93 HydrophobicContact CG2-CB 3.5Å; V39-C93 WeakPolarHBondContact CG2-SG 3.31Å; G89-C93 PolarHBondContact O-N 3.38Å; L90-C93 PolarHBondContact O-N 2.77Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.77Å; C93-A95 VanDerWaalsContact C-N 3.26Å; C93-A95 PolarHBondContact O-N 3.13Å; C93-T96 PolarHBondContact O-N 3.4Å; C93-C97 WeakPolarHBondContact O-CB 3.37Å; C93-C97 PolarHBondContact O-N 2.75Å; C93-C97 PolarHBondContact O-SG 3.46Å
94	F	60	Low	66.4	Low	126 Å²	126	60.9 Å²	60.9	55%	0.553	31%	0.314	S	S	*	.	H	α-helix	trans	-59.5	-43.6	178.6	-72.8	-61.5	0	0	0	110.1	L90 F91 T96 C97 R98 M103	L90-F94 WeakPolarHBondContact O-CD2 3.24Å; L90-F94 PolarHBondContact O-N 2.75Å; L90-F94 VanDerWaalsContact O-N 3.15Å; F91-F94 PolarHBondContact O-N 3.42Å; F94-T96 PolarHBondContact O-N 3.41Å; F94-C97 PolarHBondContact O-N 3.38Å; F94-R98 WeakPolarHBondContact O-CB 3.47Å; F94-R98 PolarHBondContact O-N 2.79Å; F94-M103 HydrophobicContact CB-CE 3.77Å; F94-M103 WeakPolarHBondContact O-CE 3.45Å
95	A	60.4	Low	66.8	Low	6 Å²	6	63.8 Å²	63.8	5%	0.05	32%	0.321	C	S	.	.	H	α-helix	trans	-54.1	-48	179.5	0	0	0	0	0	112.7	F91 C93 G99 M103	F91-A95 VanDerWaalsContact O-CB 3.26Å; F91-A95 WeakPolarHBondContact O-CB 3.32Å; F91-A95 PolarHBondContact O-N 2.86Å; C93-A95 VanDerWaalsContact C-N 3.26Å; C93-A95 PolarHBondContact O-N 3.13Å; A95-G99 PolarHBondContact O-N 2.83Å; A95-M103 HydrophobicContact CB-CB 4.07Å; A95-M103 HydrophobicContact CB-CE 4.35Å
96	T	56.9	Low	67.3	Low	54 Å²	54	63.7 Å²	63.7	33%	0.331	32%	0.321	S	S	.	.	H	α-helix	trans	-74.5	-39.7	-176.7	-51.7	0	0	0	0	111.9	I20 G92 C93 F94	I20-T96 HydrophobicContact CD1-CG2 4.36Å; I20-T96 HydrophobicContact CG1-CG2 4.39Å; G92-T96 PolarHBondContact O-N 3.33Å; G92-T96 PolarHBondContact O-OG1 2.86Å; C93-T96 PolarHBondContact O-N 3.4Å; F94-T96 PolarHBondContact O-N 3.41Å
97	C	57.3	Low	67.8	Low	108 Å²	108	65.3 Å²	65.3	73%	0.73	33%	0.326	S	S	*	.	H	α-helix	trans	-71.3	-40.7	-179.1	-68.2	0	0	0	0	113.2	C93 F94	C93-C97 WeakPolarHBondContact O-CB 3.37Å; C93-C97 PolarHBondContact O-N 2.75Å; C93-C97 PolarHBondContact O-SG 3.46Å; F94-C97 PolarHBondContact O-N 3.38Å
98	R	63.4	Low	68.4	Low	203 Å²	203	62.9 Å²	62.9	77%	0.766	31%	0.312	S	S	*	.	H	α-helix	trans	-82.7	-16.2	-175.5	-138.1	-176.9	-175.1	138.6	2.6	113.2	F94 S100 M103	F94-R98 WeakPolarHBondContact O-CB 3.47Å; F94-R98 PolarHBondContact O-N 2.79Å; R98-S100 PolarHBondContact O-N 3.4Å; R98-M103 HydrophobicContact CB-CE 3.73Å; R98-M103 HydrophobicContact CB-SD 4.2Å
99	G	61.4	Low	69.2	Low	20 Å²	20	63.6 Å²	63.6	21%	0.206	32%	0.317	C	S	.	.			trans	58.5	16.4	175.6	0	0	0	0	0	114.8	A95	A95-G99 PolarHBondContact O-N 2.83Å
100	S	70.6	Confident	70	Confident	40 Å²	40	66 Å²	66	28%	0.28	33%	0.326	S	S	.	.			trans	-76.5	131	-178.6	170.5	0	0	0	0	110.3	R98 W102 M103 L104	R98-S100 PolarHBondContact O-N 3.4Å; S100-W102 PolarHBondContact O-N 2.98Å; S100-W102 PolarHBondContact OG-N 3.45Å; S100-M103 PolarHBondContact O-N 3.16Å; S100-M103 VanDerWaalsContact O-N 3.16Å; S100-L104 PolarHBondContact O-N 2.89Å
101	P	72.8	Confident	70.9	Confident	23 Å²	23	64.2 Å²	64.2	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-26	179.7	23.5	-31.2	0	0	0	112.9	K105 S254 I257 T258	P101-K105 WeakPolarHBondContact O-CG 3.42Å; P101-K105 PolarHBondContact O-N 2.95Å; P101-S254 PolarHBondContact O-OG 3.27Å; P101-I257 HydrophobicContact CB-CB 4.44Å; P101-I257 HydrophobicContact CB-CG2 4.06Å; P101-I257 HydrophobicContact CG-CG2 4.06Å; P101-T258 VanDerWaalsContact CB-OG1 3.3Å; P101-T258 WeakPolarHBondContact CB-OG1 3.31Å
102	W	76.4	Confident	72	Confident	178 Å²	178	61.7 Å²	61.7	67%	0.674	31%	0.311	S	S	*	.	H	α-helix	trans	-68.7	-41.4	176.5	-173.8	82	0	0	0	112.2	S100 L104 K105 L106	S100-W102 PolarHBondContact O-N 2.98Å; S100-W102 PolarHBondContact OG-N 3.45Å; W102-L104 PolarHBondContact O-N 3.48Å; W102-K105 PolarHBondContact O-N 2.78Å; W102-L106 HydrophobicContact CH2-CD2 4.43Å; W102-L106 HydrophobicContact CZ3-CD2 4.39Å; W102-L106 PolarHBondContact O-N 3.22Å
103	M	72	Confident	73.2	Confident	33 Å²	33	65.5 Å²	65.5	16%	0.163	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-32.6	178	-83	155.1	62.1	0	0	112.9	F94 A95 R98 S100 L106 Y107	F94-M103 HydrophobicContact CB-CE 3.77Å; F94-M103 WeakPolarHBondContact O-CE 3.45Å; A95-M103 HydrophobicContact CB-CB 4.07Å; A95-M103 HydrophobicContact CB-CE 4.35Å; R98-M103 HydrophobicContact CB-CE 3.73Å; R98-M103 HydrophobicContact CB-SD 4.2Å; S100-M103 PolarHBondContact O-N 3.16Å; S100-M103 VanDerWaalsContact O-N 3.16Å; M103-L106 PolarHBondContact O-N 3.34Å; M103-Y107 WeakPolarHBondContact O-CB 3.42Å; M103-Y107 PolarHBondContact O-N 2.97Å
104	L	74.6	Confident	74.4	Confident	7 Å²	7	66.1 Å²	66.1	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-67.2	-37.5	173	-72.6	166.8	0	0	0	112.4	S100 W102 Y107 A108 L253 I257	S100-L104 PolarHBondContact O-N 2.89Å; W102-L104 PolarHBondContact O-N 3.48Å; L104-Y107 PolarHBondContact O-N 3.35Å; L104-A108 PolarHBondContact O-N 3.09Å; L104-L253 HydrophobicContact CD1-CB 4.25Å; L104-L253 HydrophobicContact CD1-CD2 3.8Å; L104-L253 HydrophobicContact CD1-CG 3.7Å; L104-L253 HydrophobicContact CD2-CD2 3.88Å; L104-I257 HydrophobicContact CD1-CD1 3.62Å
105	K	79.8	Confident	75.8	Confident	125 Å²	125	62 Å²	62	54%	0.543	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-42.3	172.9	-72	178.9	-178.6	-177.6	0	111.5	P101 W102 A108 M109 S254	P101-K105 WeakPolarHBondContact O-CG 3.42Å; P101-K105 PolarHBondContact O-N 2.95Å; W102-K105 PolarHBondContact O-N 2.78Å; K105-A108 PolarHBondContact O-N 2.63Å; K105-M109 WeakPolarHBondContact O-CB 3.05Å; K105-M109 PolarHBondContact O-N 3.07Å; K105-S254 WeakPolarHBondContact CG-OG 3.3Å
106	L	80.9	Confident	77.4	Confident	45 Å²	45	66.2 Å²	66.2	24%	0.236	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-44.2	177.1	-171.4	68.3	0	0	0	111.2	W102 M103 A108 M109 F110	W102-L106 HydrophobicContact CH2-CD2 4.43Å; W102-L106 HydrophobicContact CZ3-CD2 4.39Å; W102-L106 PolarHBondContact O-N 3.22Å; M103-L106 PolarHBondContact O-N 3.34Å; L106-A108 PolarHBondContact O-N 3.16Å; L106-M109 HydrophobicContact CD1-CE 3.69Å; L106-M109 WeakPolarHBondContact O-CB 3.35Å; L106-M109 PolarHBondContact O-N 3.43Å; L106-F110 HydrophobicContact CD1-CD2 4.23Å; L106-F110 HydrophobicContact CD1-CE2 3.68Å; L106-F110 HydrophobicContact CD1-CZ 4.49Å; L106-F110 HydrophobicContact CD2-CE2 4.08Å; L106-F110 HydrophobicContact CG-CD2 3.91Å; L106-F110 HydrophobicContact CG-CE2 3.58Å; L106-F110 WeakPolarHBondContact O-CD2 3.27Å; L106-F110 PolarHBondContact O-N 3.05Å
107	Y	77.6	Confident	78.7	Confident	55 Å²	55	66.4 Å²	66.4	22%	0.216	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-45	175.1	179.4	-109.3	0	0	0	112.7	M103 L104 M109 F110 L111 A250	M103-Y107 WeakPolarHBondContact O-CB 3.42Å; M103-Y107 PolarHBondContact O-N 2.97Å; L104-Y107 PolarHBondContact O-N 3.35Å; Y107-M109 PolarHBondContact O-N 3.47Å; Y107-F110 PolarHBondContact O-N 3.44Å; Y107-L111 HydrophobicContact CD1-CD1 4.06Å; Y107-L111 HydrophobicContact CE1-CD1 3.48Å; Y107-L111 VanDerWaalsContact CE1-CD1 3.48Å; Y107-L111 HydrophobicContact CE1-CG 4.26Å; Y107-L111 HydrophobicContact CE2-CD1 4.39Å; Y107-L111 HydrophobicContact CE2-CG 4.36Å; Y107-L111 PolarHBondContact O-N 3.3Å; Y107-A250 HydrophobicContact CD1-CB 3.9Å; Y107-A250 HydrophobicContact CE1-CB 4.38Å
108	A	83.9	Confident	80.1	Confident	9 Å²	9	64.3 Å²	64.3	7%	0.074	32%	0.319	C	S	.	.	H	α-helix	trans	-63.5	-39.1	175.9	0	0	0	0	0	112.7	L104 K105 L106 L111 S112 A250	L104-A108 PolarHBondContact O-N 3.09Å; K105-A108 PolarHBondContact O-N 2.63Å; L106-A108 PolarHBondContact O-N 3.16Å; A108-L111 PolarHBondContact O-N 3.33Å; A108-S112 PolarHBondContact O-N 3.1Å; A108-A250 HydrophobicContact CB-CB 4.07Å
109	M	86.9	Confident	81.5	Confident	81 Å²	81	58.4 Å²	58.4	40%	0.399	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-45.4	175.6	-177.2	-77.5	-63.7	0	0	111.3	K105 L106 Y107 S112 L113	K105-M109 WeakPolarHBondContact O-CB 3.05Å; K105-M109 PolarHBondContact O-N 3.07Å; L106-M109 HydrophobicContact CD1-CE 3.69Å; L106-M109 WeakPolarHBondContact O-CB 3.35Å; L106-M109 PolarHBondContact O-N 3.43Å; Y107-M109 PolarHBondContact O-N 3.47Å; M109-S112 WeakPolarHBondContact O-CB 3.27Å; M109-S112 PolarHBondContact O-N 2.9Å; M109-L113 HydrophobicContact CE-CD1 4.49Å; M109-L113 PolarHBondContact O-N 3.36Å; M109-L113 HydrophobicContact SD-CD1 3.43Å; M109-L113 WeakPolarHBondContact SD-CD1 2.91Å; M109-L113 HydrophobicContact SD-CG 3.91Å
110	F	81.8	Confident	82.9	Confident	56 Å²	56	62 Å²	62	25%	0.246	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-45	176.7	-80.6	-66.4	0	0	0	112.9	F88 L106 Y107 S112 L113 V114	F88-F110 HydrophobicContact CD1-CD1 4.42Å; F88-F110 AromaticContact CE1-CD1 3.47Å; F88-F110 HydrophobicContact CE1-CD1 3.47Å; F88-F110 VanDerWaalsContact CE1-CD1 3.47Å; F88-F110 AromaticContact CE1-CE1 3.65Å; F88-F110 HydrophobicContact CE1-CE1 3.65Å; F88-F110 HydrophobicContact CE1-CG 4.03Å; F88-F110 HydrophobicContact CE1-CZ 4.33Å; F88-F110 AromaticContact CZ-CD1 3.71Å; F88-F110 HydrophobicContact CZ-CD1 3.71Å; F88-F110 HydrophobicContact CZ-CE1 4.13Å; F88-F110 HydrophobicContact CZ-CG 4.46Å; L106-F110 HydrophobicContact CD1-CD2 4.23Å; L106-F110 HydrophobicContact CD1-CE2 3.68Å; L106-F110 HydrophobicContact CD1-CZ 4.49Å; L106-F110 HydrophobicContact CD2-CE2 4.08Å; L106-F110 HydrophobicContact CG-CD2 3.91Å; L106-F110 HydrophobicContact CG-CE2 3.58Å; L106-F110 WeakPolarHBondContact O-CD2 3.27Å; L106-F110 PolarHBondContact O-N 3.05Å; Y107-F110 PolarHBondContact O-N 3.44Å; F110-S112 PolarHBondContact O-N 2.7Å; F110-L113 HydrophobicContact CD1-CD1 4.47Å; F110-L113 PolarHBondContact O-N 2.9Å; F110-L113 VanDerWaalsContact O-N 3.09Å; F110-V114 WeakPolarHBondContact O-CG2 3.26Å; F110-V114 PolarHBondContact O-N 2.68Å
111	L	83.7	Confident	83.6	Confident	29 Å²	29	63 Å²	63	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-36.8	174.5	-74	179.9	0	0	0	111.7	Y107 A108 V114 F115 M247	Y107-L111 HydrophobicContact CD1-CD1 4.06Å; Y107-L111 HydrophobicContact CE1-CD1 3.48Å; Y107-L111 VanDerWaalsContact CE1-CD1 3.48Å; Y107-L111 HydrophobicContact CE1-CG 4.26Å; Y107-L111 HydrophobicContact CE2-CD1 4.39Å; Y107-L111 HydrophobicContact CE2-CG 4.36Å; Y107-L111 PolarHBondContact O-N 3.3Å; A108-L111 PolarHBondContact O-N 3.33Å; L111-V114 PolarHBondContact O-N 2.91Å; L111-F115 WeakPolarHBondContact O-CB 3.36Å; L111-F115 PolarHBondContact O-N 2.84Å; L111-M247 HydrophobicContact CB-CG 3.51Å; L111-M247 HydrophobicContact CB-SD 4.16Å; L111-M247 HydrophobicContact CD1-CG 4.1Å; L111-M247 HydrophobicContact CG-CG 4.49Å
112	S	88.6	Confident	84.3	Confident	48 Å²	48	64.1 Å²	64.1	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-39.6	175.2	-173.3	0	0	0	0	112.6	A108 M109 F110 F115 L116 M247	A108-S112 PolarHBondContact O-N 3.1Å; M109-S112 WeakPolarHBondContact O-CB 3.27Å; M109-S112 PolarHBondContact O-N 2.9Å; F110-S112 PolarHBondContact O-N 2.7Å; S112-F115 PolarHBondContact O-N 3.43Å; S112-L116 WeakPolarHBondContact O-CG 3.49Å; S112-L116 PolarHBondContact O-N 2.99Å; S112-L116 VanDerWaalsContact O-N 3.1Å; S112-M247 WeakPolarHBondContact CA-SD 3.34Å; S112-M247 PolarHBondContact N-SD 2.89Å; S112-M247 VanDerWaalsContact N-SD 3.42Å
113	L	88.6	Confident	85	Confident	97 Å²	97	60.9 Å²	60.9	51%	0.508	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-42	176.3	-71.7	177.4	0	0	0	111.5	M109 F110 L116 A117	M109-L113 HydrophobicContact CE-CD1 4.49Å; M109-L113 PolarHBondContact O-N 3.36Å; M109-L113 HydrophobicContact SD-CD1 3.43Å; M109-L113 WeakPolarHBondContact SD-CD1 2.91Å; M109-L113 HydrophobicContact SD-CG 3.91Å; F110-L113 HydrophobicContact CD1-CD1 4.47Å; F110-L113 PolarHBondContact O-N 2.9Å; F110-L113 VanDerWaalsContact O-N 3.09Å; L113-L116 PolarHBondContact O-N 3.37Å; L113-A117 PolarHBondContact O-N 3.35Å
114	V	85.8	Confident	85.7	Confident	46 Å²	46	61.5 Å²	61.5	28%	0.279	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.5	175.9	0	0	0	0	110.7	F88 F110 L111 L116 A117 E118	F88-V114 HydrophobicContact CE2-CG2 4.18Å; F110-V114 WeakPolarHBondContact O-CG2 3.26Å; F110-V114 PolarHBondContact O-N 2.68Å; L111-V114 PolarHBondContact O-N 2.91Å; V114-L116 VanDerWaalsContact C-N 3.33Å; V114-L116 PolarHBondContact O-N 3Å; V114-A117 WeakPolarHBondContact O-CB 3.34Å; V114-A117 PolarHBondContact O-N 3.42Å; V114-A117 VanDerWaalsContact O-N 3.13Å; V114-E118 HydrophobicContact CG1-CG 4.4Å; V114-E118 PolarHBondContact O-N 3.27Å
115	F	89.3	Confident	86.2	Confident	39 Å²	39	62.7 Å²	62.7	17%	0.171	36%	0.363	C	S	.	.	H	α-helix	trans	-57.7	-44.3	176.1	177.2	-99.3	0	0	0	112.5	L111 S112 E118 L119 A240 L244 M247	L111-F115 WeakPolarHBondContact O-CB 3.36Å; L111-F115 PolarHBondContact O-N 2.84Å; S112-F115 PolarHBondContact O-N 3.43Å; F115-E118 PolarHBondContact O-N 3.43Å; F115-L119 HydrophobicContact CD1-CD1 4.01Å; F115-L119 HydrophobicContact CE1-CD1 3.43Å; F115-L119 VanDerWaalsContact CE1-CD1 3.43Å; F115-L119 HydrophobicContact CE1-CG 4.18Å; F115-L119 HydrophobicContact CZ-CD1 3.78Å; F115-L119 HydrophobicContact CZ-CD2 4.49Å; F115-L119 HydrophobicContact CZ-CG 4.22Å; F115-L119 WeakPolarHBondContact O-CG 3.42Å; F115-L119 PolarHBondContact O-N 3.44Å; F115-A240 HydrophobicContact CD2-CB 4.26Å; F115-A240 HydrophobicContact CE2-CB 3.93Å; F115-L244 HydrophobicContact CD2-CG 4.49Å; F115-L244 HydrophobicContact CE2-CD1 4.22Å; F115-L244 HydrophobicContact CE2-CD2 4.13Å; F115-L244 HydrophobicContact CE2-CG 4.01Å; F115-L244 HydrophobicContact CZ-CD1 4.44Å; F115-L244 HydrophobicContact CZ-CD2 4.14Å; F115-L244 HydrophobicContact CZ-CG 4.42Å; F115-M247 HydrophobicContact CB-CE 4.13Å; F115-M247 HydrophobicContact CG-CE 4.25Å
116	L	92.1	Very high	86.5	Confident	94 Å²	94	62.7 Å²	62.7	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-41.5	175.7	-68.5	174.8	0	0	0	111.8	S112 L113 V114 L119 V120	S112-L116 WeakPolarHBondContact O-CG 3.49Å; S112-L116 PolarHBondContact O-N 2.99Å; S112-L116 VanDerWaalsContact O-N 3.1Å; L113-L116 PolarHBondContact O-N 3.37Å; V114-L116 VanDerWaalsContact C-N 3.33Å; V114-L116 PolarHBondContact O-N 3Å; L116-L119 PolarHBondContact O-N 2.97Å; L116-V120 WeakPolarHBondContact O-CG2 3.33Å; L116-V120 PolarHBondContact O-N 3.29Å
117	A	85.9	Confident	87	Confident	58 Å²	58	64.8 Å²	64.8	48%	0.479	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-41.1	176.4	0	0	0	0	0	111.9	L113 V114 V120 A121	L113-A117 PolarHBondContact O-N 3.35Å; V114-A117 WeakPolarHBondContact O-CB 3.34Å; V114-A117 PolarHBondContact O-N 3.42Å; V114-A117 VanDerWaalsContact O-N 3.13Å; A117-V120 PolarHBondContact O-N 2.63Å; A117-A121 VanDerWaalsContact O-CB 3.25Å; A117-A121 WeakPolarHBondContact O-CB 3.43Å; A117-A121 PolarHBondContact O-N 2.81Å
118	E	86.9	Confident	87.5	Confident	65 Å²	65	67.9 Å²	67.9	30%	0.304	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-39.8	175.6	-77.7	-177.8	-176.1	0	0	112.4	V114 F115 A121 G122 I239 Q243	V114-E118 HydrophobicContact CG1-CG 4.4Å; V114-E118 PolarHBondContact O-N 3.27Å; F115-E118 PolarHBondContact O-N 3.43Å; E118-A121 PolarHBondContact O-N 3.39Å; E118-G122 PolarHBondContact O-N 2.92Å; E118-I239 WeakPolarHBondContact OE1-CG2 3.09Å; E118-I239 WeakPolarHBondContact OE2-CG2 3.43Å; E118-Q243 PolarHBondContact OE1-NE2 2.64Å; E118-Q243 PolarHBondContact OE2-NE2 3.31Å; E118-Q243 VanDerWaalsContact OE2-NE2 3.07Å; E118-Q243 PolarHBondContact OE2-OE1 2.94Å
119	L	91.3	Very high	87.6	Confident	79 Å²	79	71.5 Å²	71.5	41%	0.414	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-47.5	173.8	-74.9	180	0	0	0	111.4	F115 L116 A121 G122 I123	F115-L119 HydrophobicContact CD1-CD1 4.01Å; F115-L119 HydrophobicContact CE1-CD1 3.43Å; F115-L119 VanDerWaalsContact CE1-CD1 3.43Å; F115-L119 HydrophobicContact CE1-CG 4.18Å; F115-L119 HydrophobicContact CZ-CD1 3.78Å; F115-L119 HydrophobicContact CZ-CD2 4.49Å; F115-L119 HydrophobicContact CZ-CG 4.22Å; F115-L119 WeakPolarHBondContact O-CG 3.42Å; F115-L119 PolarHBondContact O-N 3.44Å; L116-L119 PolarHBondContact O-N 2.97Å; L119-A121 PolarHBondContact O-N 2.76Å; L119-G122 PolarHBondContact O-N 2.88Å; L119-I123 WeakPolarHBondContact O-CB 3.43Å; L119-I123 WeakPolarHBondContact O-CD1 3.36Å; L119-I123 WeakPolarHBondContact O-CG1 3.2Å; L119-I123 PolarHBondContact O-N 3.18Å
120	V	92.3	Very high	87.6	Confident	94 Å²	94	72.7 Å²	72.7	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-44.3	177.8	173.4	0	0	0	0	110.8	L116 A117 S124	L116-V120 WeakPolarHBondContact O-CG2 3.33Å; L116-V120 PolarHBondContact O-N 3.29Å; A117-V120 PolarHBondContact O-N 2.63Å; V120-S124 VanDerWaalsContact O-CB 3.24Å; V120-S124 WeakPolarHBondContact O-CB 3.4Å; V120-S124 PolarHBondContact O-N 2.79Å; V120-S124 PolarHBondContact O-OG 2.94Å
121	A	83.7	Confident	87.9	Confident	63 Å²	63	75.5 Å²	75.5	52%	0.521	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-42.1	178.1	0	0	0	0	0	112.1	A117 E118 L119 S124 G125	A117-A121 VanDerWaalsContact O-CB 3.25Å; A117-A121 WeakPolarHBondContact O-CB 3.43Å; A117-A121 PolarHBondContact O-N 2.81Å; E118-A121 PolarHBondContact O-N 3.39Å; L119-A121 PolarHBondContact O-N 2.76Å; A121-S124 PolarHBondContact O-N 2.7Å; A121-G125 PolarHBondContact O-N 2.8Å
122	G	87.8	Confident	87.7	Confident	46 Å²	46	77.8 Å²	77.8	47%	0.474	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-45.9	177.6	0	0	0	0	0	112.4	E118 L119 G125 F126	E118-G122 PolarHBondContact O-N 2.92Å; L119-G122 PolarHBondContact O-N 2.88Å; G122-G125 PolarHBondContact O-N 3.48Å; G122-F126 WeakPolarHBondContact O-CB 2.92Å; G122-F126 PolarHBondContact O-N 2.93Å
123	I	91	Very high	87.5	Confident	109 Å²	109	76.3 Å²	76.3	56%	0.559	42%	0.422	S	S	*	.	H	α-helix	trans	-62.5	-48.3	175.5	-66.1	164.7	0	0	0	110	L119 G125 F126 V127	L119-I123 WeakPolarHBondContact O-CB 3.43Å; L119-I123 WeakPolarHBondContact O-CD1 3.36Å; L119-I123 WeakPolarHBondContact O-CG1 3.2Å; L119-I123 PolarHBondContact O-N 3.18Å; I123-G125 PolarHBondContact O-N 3.49Å; I123-F126 PolarHBondContact O-N 3.26Å; I123-V127 HydrophobicContact CG2-CG2 4.25Å; I123-V127 WeakPolarHBondContact O-CB 3.36Å; I123-V127 VanDerWaalsContact O-CG2 3.32Å; I123-V127 WeakPolarHBondContact O-CG2 3.37Å; I123-V127 PolarHBondContact O-N 3.43Å
124	S	87.3	Confident	87.4	Confident	46 Å²	46	74.7 Å²	74.7	32%	0.322	41%	0.414	S	S	.	.	H	α-helix	trans	-61.7	-44.4	179.7	-57.8	0	0	0	0	111.5	V120 A121 F126 V127 F128	V120-S124 VanDerWaalsContact O-CB 3.24Å; V120-S124 WeakPolarHBondContact O-CB 3.4Å; V120-S124 PolarHBondContact O-N 2.79Å; V120-S124 PolarHBondContact O-OG 2.94Å; A121-S124 PolarHBondContact O-N 2.7Å; S124-F126 VanDerWaalsContact C-N 3.3Å; S124-F126 PolarHBondContact O-N 3.34Å; S124-V127 PolarHBondContact O-N 3.23Å; S124-F128 WeakPolarHBondContact O-CB 3.38Å; S124-F128 VanDerWaalsContact O-CD2 3.24Å; S124-F128 WeakPolarHBondContact O-CD2 3.25Å; S124-F128 PolarHBondContact O-N 2.76Å
125	G	85.8	Confident	87.2	Confident	33 Å²	33	76.3 Å²	76.3	34%	0.34	42%	0.424	S	S	.	.	H	α-helix	trans	-62.8	-35.4	177.9	0	0	0	0	0	112.9	A121 G122 I123 R129	A121-G125 PolarHBondContact O-N 2.8Å; G122-G125 PolarHBondContact O-N 3.48Å; I123-G125 PolarHBondContact O-N 3.49Å; G125-R129 WeakPolarHBondContact O-CB 3.47Å; G125-R129 PolarHBondContact O-N 3.47Å
126	F	86.7	Confident	86.9	Confident	125 Å²	125	77.4 Å²	77.4	55%	0.548	43%	0.429	S	S	.	.	H	α-helix	trans	-72	-46.6	175.1	-174.9	-97.9	0	0	0	112.3	G122 I123 S124 R129 M229	G122-F126 WeakPolarHBondContact O-CB 2.92Å; G122-F126 PolarHBondContact O-N 2.93Å; I123-F126 PolarHBondContact O-N 3.26Å; S124-F126 VanDerWaalsContact C-N 3.3Å; S124-F126 PolarHBondContact O-N 3.34Å; F126-R129 WeakPolarHBondContact O-CD 3.42Å; F126-R129 WeakPolarHBondContact O-CG 3.27Å; F126-M229 HydrophobicContact CD2-SD 4.47Å; F126-M229 HydrophobicContact CE2-SD 4.18Å
127	V	91.1	Very high	86.7	Confident	89 Å²	89	75.2 Å²	75.2	54%	0.539	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-47	-178.8	171.2	0	0	0	0	111.2	I123 S124 R129	I123-V127 HydrophobicContact CG2-CG2 4.25Å; I123-V127 WeakPolarHBondContact O-CB 3.36Å; I123-V127 VanDerWaalsContact O-CG2 3.32Å; I123-V127 WeakPolarHBondContact O-CG2 3.37Å; I123-V127 PolarHBondContact O-N 3.43Å; S124-V127 PolarHBondContact O-N 3.23Å; V127-R129 VanDerWaalsContact C-N 3.3Å; V127-R129 PolarHBondContact O-N 2.94Å
128	F	87.6	Confident	86.7	Confident	119 Å²	119	81.2 Å²	81.2	52%	0.522	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	18	-176.8	-60.9	-67.2	0	0	0	113.5	S124 H130 E131 I132	S124-F128 WeakPolarHBondContact O-CB 3.38Å; S124-F128 VanDerWaalsContact O-CD2 3.24Å; S124-F128 WeakPolarHBondContact O-CD2 3.25Å; S124-F128 PolarHBondContact O-N 2.76Å; F128-H130 PolarHBondContact O-N 2.86Å; F128-E131 HydrophobicContact CB-CB 4.42Å; F128-E131 HydrophobicContact CD1-CG 4.4Å; F128-E131 PolarHBondContact O-N 3.11Å; F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.05Å; F128-I132 PolarHBondContact O-N 3.12Å
129	R	85.2	Confident	86.4	Confident	85 Å²	85	81.6 Å²	81.6	32%	0.321	43%	0.434	S	S	.	.	H	α-helix	trans	-57	-35.1	-177.2	71.1	-174.4	-174.1	-174.1	-2.8	113.7	G125 F126 V127 K133	G125-R129 WeakPolarHBondContact O-CB 3.47Å; G125-R129 PolarHBondContact O-N 3.47Å; F126-R129 WeakPolarHBondContact O-CD 3.42Å; F126-R129 WeakPolarHBondContact O-CG 3.27Å; V127-R129 VanDerWaalsContact C-N 3.3Å; V127-R129 PolarHBondContact O-N 2.94Å; R129-K133 WeakPolarHBondContact O-CG 3.42Å; R129-K133 PolarHBondContact O-N 3.18Å
130	H	88	Confident	86.1	Confident	106 Å²	106	78.4 Å²	78.4	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-73.6	-46.1	179.7	-66.5	-74.3	0	0	0	110.7	F128 I132 K133 D134	F128-H130 PolarHBondContact O-N 2.86Å; H130-I132 VanDerWaalsContact C-N 3.29Å; H130-I132 PolarHBondContact O-N 3.3Å; H130-K133 WeakPolarHBondContact O-CB 3.46Å; H130-K133 PolarHBondContact O-N 2.88Å; H130-K133 VanDerWaalsContact O-N 3.08Å; H130-D134 PolarHBondContact O-N 3.19Å
131	E	87.5	Confident	85.9	Confident	115 Å²	115	76.1 Å²	76.1	54%	0.537	40%	0.403	S	S	.	.	H	α-helix	trans	-58.7	-38.3	174.2	-66.4	-63.3	146.5	0	0	112.5	F128 K133 D134 T135	F128-E131 HydrophobicContact CB-CB 4.42Å; F128-E131 HydrophobicContact CD1-CG 4.4Å; F128-E131 PolarHBondContact O-N 3.11Å; E131-K133 VanDerWaalsContact C-N 3.35Å; E131-D134 PolarHBondContact O-N 3.27Å; E131-T135 VanDerWaalsContact O-CB 3.22Å; E131-T135 WeakPolarHBondContact O-CB 2.89Å; E131-T135 PolarHBondContact O-N 2.8Å; E131-T135 PolarHBondContact O-OG1 3.38Å
132	I	80.1	Confident	86	Confident	78 Å²	78	77 Å²	77	40%	0.4	40%	0.399	S	S	.	.	H	α-helix	trans	-62.8	-42.6	175.9	-68.3	164.9	0	0	0	110.7	F128 H130 F136 M225	F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.05Å; F128-I132 PolarHBondContact O-N 3.12Å; H130-I132 VanDerWaalsContact C-N 3.29Å; H130-I132 PolarHBondContact O-N 3.3Å; I132-F136 WeakPolarHBondContact O-CB 3.21Å; I132-F136 PolarHBondContact O-N 3.1Å; I132-M225 HydrophobicContact CG2-CE 4.42Å
133	K	84.9	Confident	85.9	Confident	17 Å²	17	75.2 Å²	75.2	7%	0.074	38%	0.38	C	S	.	.	H	α-helix	trans	-63.4	-48.8	176.2	-68.3	177.6	179.5	175.9	0	110.8	R129 H130 E131 T135 F136 L137 Y218 T222 M225 E226	R129-K133 WeakPolarHBondContact O-CG 3.42Å; R129-K133 PolarHBondContact O-N 3.18Å; H130-K133 WeakPolarHBondContact O-CB 3.46Å; H130-K133 PolarHBondContact O-N 2.88Å; H130-K133 VanDerWaalsContact O-N 3.08Å; E131-K133 VanDerWaalsContact C-N 3.35Å; K133-T135 VanDerWaalsContact C-N 3.33Å; K133-T135 PolarHBondContact O-N 2.83Å; K133-F136 WeakPolarHBondContact O-CB 3.5Å; K133-F136 PolarHBondContact O-N 3.29Å; K133-L137 PolarHBondContact O-N 3.06Å; K133-Y218 HydrophobicContact CB-CE2 4.3Å; K133-Y218 WeakPolarHBondContact O-CE2 3.49Å; K133-T222 HydrophobicContact CB-CG2 4.21Å; K133-T222 HydrophobicContact CD-CG2 3.84Å; K133-T222 HydrophobicContact CG-CG2 3.83Å; K133-M225 HydrophobicContact CG-SD 4.37Å; K133-E226 VanDerWaalsContact NZ-CG 3.26Å; K133-E226 IonicContact NZ-OE1 3.34Å; K133-E226 PolarHBondContact NZ-OE1 3.25Å
134	D	86.5	Confident	85.8	Confident	63 Å²	63	70.1 Å²	70.1	34%	0.337	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-39.5	-179.5	-70.2	-25.1	0	0	0	112.1	H130 E131 L137 R138	H130-D134 PolarHBondContact O-N 3.19Å; E131-D134 PolarHBondContact O-N 3.27Å; D134-L137 WeakPolarHBondContact O-CB 3.48Å; D134-L137 PolarHBondContact O-N 3.22Å; D134-R138 WeakPolarHBondContact O-CG 3.36Å; D134-R138 PolarHBondContact O-N 3.13Å
135	T	81.4	Confident	85.9	Confident	79 Å²	79	70.7 Å²	70.7	49%	0.485	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.7	-59.2	0	0	0	0	111	E131 K133 R138 T139	E131-T135 VanDerWaalsContact O-CB 3.22Å; E131-T135 WeakPolarHBondContact O-CB 2.89Å; E131-T135 PolarHBondContact O-N 2.8Å; E131-T135 PolarHBondContact O-OG1 3.38Å; K133-T135 VanDerWaalsContact C-N 3.33Å; K133-T135 PolarHBondContact O-N 2.83Å; T135-R138 PolarHBondContact O-N 3.01Å; T135-T139 VanDerWaalsContact O-CB 3.27Å; T135-T139 WeakPolarHBondContact O-CB 3.43Å; T135-T139 PolarHBondContact O-N 3.38Å; T135-T139 PolarHBondContact O-OG1 2.83Å
136	F	82.9	Confident	86	Confident	63 Å²	63	73.1 Å²	73.1	28%	0.276	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-45.4	175.8	-177.6	-106.9	0	0	0	111.4	I132 K133 R138 T139 Y140 Y218 V221	I132-F136 WeakPolarHBondContact O-CB 3.21Å; I132-F136 PolarHBondContact O-N 3.1Å; K133-F136 WeakPolarHBondContact O-CB 3.5Å; K133-F136 PolarHBondContact O-N 3.29Å; F136-R138 PolarHBondContact O-N 3.36Å; F136-T139 PolarHBondContact O-N 3.19Å; F136-Y140 HydrophobicContact CZ-CD2 4.42Å; F136-Y140 HydrophobicContact CZ-CG 4.43Å; F136-Y140 WeakPolarHBondContact O-CB 3.41Å; F136-Y140 PolarHBondContact O-N 3.24Å; F136-Y218 AromaticContact CD1-CD2 3.97Å; F136-Y218 HydrophobicContact CD1-CD2 3.97Å; F136-V221 HydrophobicContact CD1-CG1 4.36Å; F136-V221 HydrophobicContact CE1-CB 4.06Å; F136-V221 HydrophobicContact CE1-CG1 4.22Å; F136-V221 HydrophobicContact CE1-CG2 3.99Å; F136-V221 HydrophobicContact CZ-CG2 4.09Å
137	L	86.9	Confident	86.1	Confident	47 Å²	47	67.7 Å²	67.7	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-54.5	-52.6	176.3	-178.1	64.9	0	0	0	111.2	K133 D134 T141 V169 Y218	K133-L137 PolarHBondContact O-N 3.06Å; D134-L137 WeakPolarHBondContact O-CB 3.48Å; D134-L137 PolarHBondContact O-N 3.22Å; L137-T141 VanDerWaalsContact O-CB 3.22Å; L137-T141 WeakPolarHBondContact O-CB 3.45Å; L137-T141 PolarHBondContact O-N 2.84Å; L137-T141 PolarHBondContact O-OG1 3.38Å; L137-V169 HydrophobicContact CD1-CG1 3.41Å; L137-V169 VanDerWaalsContact CD1-CG1 3.41Å; L137-Y218 HydrophobicContact CB-CD2 3.76Å; L137-Y218 HydrophobicContact CB-CE2 3.61Å; L137-Y218 HydrophobicContact CD1-CD1 4.03Å; L137-Y218 HydrophobicContact CD1-CD2 3.73Å; L137-Y218 HydrophobicContact CD1-CE1 4.32Å; L137-Y218 HydrophobicContact CD1-CE2 4.1Å; L137-Y218 HydrophobicContact CD1-CG 3.7Å; L137-Y218 HydrophobicContact CG-CD2 4.31Å; L137-Y218 HydrophobicContact CG-CE2 4.29Å
138	R	85.3	Confident	85.9	Confident	185 Å²	185	67.2 Å²	67.2	70%	0.698	33%	0.327	S	S	*	.	H	α-helix	trans	-63.7	-49.1	-178.8	-69	175.4	-171.8	179.2	6.2	111.8	D134 T135 F136 Y140 T141 D142	D134-R138 WeakPolarHBondContact O-CG 3.36Å; D134-R138 PolarHBondContact O-N 3.13Å; T135-R138 PolarHBondContact O-N 3.01Å; F136-R138 PolarHBondContact O-N 3.36Å; R138-Y140 PolarHBondContact O-N 3.38Å; R138-T141 PolarHBondContact O-N 2.98Å; R138-D142 WeakPolarHBondContact O-CB 3.46Å; R138-D142 PolarHBondContact O-N 2.99Å
139	T	80.9	Confident	85.8	Confident	72 Å²	72	62.7 Å²	62.7	44%	0.442	31%	0.314	S	S	.	.	H	α-helix	trans	-64.4	-42	-176.1	-54.6	0	0	0	0	111.8	T135 F136 A143 R153	T135-T139 VanDerWaalsContact O-CB 3.27Å; T135-T139 WeakPolarHBondContact O-CB 3.43Å; T135-T139 PolarHBondContact O-N 3.38Å; T135-T139 PolarHBondContact O-OG1 2.83Å; F136-T139 PolarHBondContact O-N 3.19Å; T139-A143 WeakPolarHBondContact O-CB 3.35Å; T139-A143 PolarHBondContact O-N 3.02Å; T139-R153 PolarHBondContact O-NH2 2.9Å
140	Y	85	Confident	85.7	Confident	13 Å²	13	65.7 Å²	65.7	5%	0.051	34%	0.336	C	S	.	.	H	α-helix	trans	-73.7	-38.5	179.6	-171	-101.2	0	0	0	111.9	F136 R138 A143 M144 V157 V160 Q161 G168 V169 C217	F136-Y140 HydrophobicContact CZ-CD2 4.42Å; F136-Y140 HydrophobicContact CZ-CG 4.43Å; F136-Y140 WeakPolarHBondContact O-CB 3.41Å; F136-Y140 PolarHBondContact O-N 3.24Å; R138-Y140 PolarHBondContact O-N 3.38Å; Y140-A143 WeakPolarHBondContact O-CB 3.3Å; Y140-A143 PolarHBondContact O-N 2.8Å; Y140-A143 VanDerWaalsContact O-N 3.17Å; Y140-M144 PolarHBondContact O-N 3.02Å; Y140-V157 HydrophobicContact CE2-CG1 4.43Å; Y140-V157 HydrophobicContact CE2-CG2 4.34Å; Y140-V160 HydrophobicContact CE2-CB 4.22Å; Y140-V160 HydrophobicContact CE2-CG1 3.86Å; Y140-Q161 WeakPolarHBondContact OH-CG 3.46Å; Y140-G168 WeakPolarHBondContact CE1-O 3.45Å; Y140-V169 HydrophobicContact CD1-CB 4.41Å; Y140-V169 HydrophobicContact CD1-CG1 4.44Å; Y140-V169 HydrophobicContact CD1-CG2 3.97Å; Y140-V169 HydrophobicContact CE1-CG2 4.28Å; Y140-C217 HydrophobicContact CE1-CB 3.84Å; Y140-C217 PolarHBondContact OH-SG 3.07Å
141	T	88.6	Confident	85.2	Confident	46 Å²	46	62.6 Å²	62.6	28%	0.282	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-48.9	172.7	-58.9	0	0	0	0	110.7	L137 R138 A143 M144 Q145	L137-T141 VanDerWaalsContact O-CB 3.22Å; L137-T141 WeakPolarHBondContact O-CB 3.45Å; L137-T141 PolarHBondContact O-N 2.84Å; L137-T141 PolarHBondContact O-OG1 3.38Å; R138-T141 PolarHBondContact O-N 2.98Å; T141-A143 PolarHBondContact O-N 3.41Å; T141-M144 PolarHBondContact O-N 3.23Å; T141-Q145 HydrophobicContact CG2-CG 4.37Å; T141-Q145 VanDerWaalsContact O-CG 3.32Å; T141-Q145 WeakPolarHBondContact O-CG 3.21Å; T141-Q145 PolarHBondContact O-N 3.28Å
142	D	86.3	Confident	84.3	Confident	80 Å²	80	58.8 Å²	58.8	43%	0.428	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-31.3	177.1	-173.4	57.7	0	0	0	111.8	R138 N146 R153	R138-D142 WeakPolarHBondContact O-CB 3.46Å; R138-D142 PolarHBondContact O-N 2.99Å; D142-N146 WeakPolarHBondContact O-CB 3.44Å; D142-N146 PolarHBondContact O-N 2.75Å; D142-N146 VanDerWaalsContact O-N 3.1Å; D142-N146 PolarHBondContact O-ND2 3.22Å; D142-N146 PolarHBondContact OD1-ND2 3.42Å; D142-R153 VanDerWaalsContact CG-NH2 3.32Å; D142-R153 PolarHBondContact O-NH1 3.44Å; D142-R153 IonicContact OD2-CZ 2.99Å; D142-R153 IonicContact OD2-NH1 2.65Å; D142-R153 PolarHBondContact OD2-NH1 3.5Å; D142-R153 IonicContact OD2-NH2 3.14Å; D142-R153 PolarHBondContact OD2-NH2 2.93Å
143	A	84.8	Confident	83.9	Confident	9 Å²	9	58.8 Å²	58.8	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-70.3	-37.5	175.2	0	0	0	0	0	113.3	T139 Y140 T141 Y147 R153 V157	T139-A143 WeakPolarHBondContact O-CB 3.35Å; T139-A143 PolarHBondContact O-N 3.02Å; Y140-A143 WeakPolarHBondContact O-CB 3.3Å; Y140-A143 PolarHBondContact O-N 2.8Å; Y140-A143 VanDerWaalsContact O-N 3.17Å; T141-A143 PolarHBondContact O-N 3.41Å; A143-Y147 PolarHBondContact O-N 2.8Å; A143-R153 HydrophobicContact CB-CG 3.85Å; A143-R153 VanDerWaalsContact CB-NE 3.3Å; A143-V157 HydrophobicContact CB-CG2 3.75Å
144	M	89.3	Confident	83.7	Confident	2 Å²	2	58 Å²	58	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-71.6	-36.3	175.2	-170.7	-163.6	75.3	0	0	112	Y140 T141 Y147 V169 N174 W175 S178	Y140-M144 PolarHBondContact O-N 3.02Å; T141-M144 PolarHBondContact O-N 3.23Å; M144-Y147 VanDerWaalsContact O-CB 3.24Å; M144-Y147 WeakPolarHBondContact O-CB 3.45Å; M144-Y147 PolarHBondContact O-N 3.02Å; M144-V169 HydrophobicContact CE-CG2 4.15Å; M144-V169 HydrophobicContact SD-CG2 3.81Å; M144-N174 HydrophobicContact CE-CB 3.93Å; M144-N174 WeakPolarHBondContact CE-O 3.38Å; M144-N174 HydrophobicContact SD-CB 4.01Å; M144-W175 HydrophobicContact CG-CD2 4.11Å; M144-W175 HydrophobicContact CG-CE3 4.06Å; M144-W175 HydrophobicContact CG-CH2 3.64Å; M144-W175 HydrophobicContact CG-CZ2 3.67Å; M144-W175 HydrophobicContact CG-CZ3 3.85Å; M144-W175 HydrophobicContact SD-CD2 4.29Å; M144-W175 HydrophobicContact SD-CZ2 4.5Å; M144-S178 PolarHBondContact O-OG 3.19Å
145	Q	89.8	Confident	83.6	Confident	59 Å²	59	61 Å²	61	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-71.6	-33.6	179.2	-69.4	-61.2	-18.5	0	0	112.6	T141 Y147 T177 P179	T141-Q145 HydrophobicContact CG2-CG 4.37Å; T141-Q145 VanDerWaalsContact O-CG 3.32Å; T141-Q145 WeakPolarHBondContact O-CG 3.21Å; T141-Q145 PolarHBondContact O-N 3.28Å; Q145-Y147 VanDerWaalsContact C-N 3.32Å; Q145-T177 PolarHBondContact NE2-OG1 3.32Å; Q145-T177 PolarHBondContact OE1-O 2.85Å; Q145-P179 WeakPolarHBondContact O-CD 3.33Å
146	N	87.6	Confident	83.4	Confident	83 Å²	83	59.9 Å²	59.9	44%	0.444	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	12.6	176.1	-63.2	-60.8	0	0	0	113.2	D142 R153	D142-N146 WeakPolarHBondContact O-CB 3.44Å; D142-N146 PolarHBondContact O-N 2.75Å; D142-N146 VanDerWaalsContact O-N 3.1Å; D142-N146 PolarHBondContact O-ND2 3.22Å; D142-N146 PolarHBondContact OD1-ND2 3.42Å; N146-R153 PolarHBondContact ND2-NH1 3.47Å
147	Y	88.1	Confident	83.5	Confident	12 Å²	12	57 Å²	57	5%	0.047	29%	0.29	C	S	.	.			trans	-66	133.8	-179	-174.6	-83.1	0	0	0	110.9	A143 M144 Q145 S154 V157 D158 W175 Y180 P187	A143-Y147 PolarHBondContact O-N 2.8Å; M144-Y147 VanDerWaalsContact O-CB 3.24Å; M144-Y147 WeakPolarHBondContact O-CB 3.45Å; M144-Y147 PolarHBondContact O-N 3.02Å; Q145-Y147 VanDerWaalsContact C-N 3.32Å; Y147-S154 VanDerWaalsContact CD2-CB 3.49Å; Y147-S154 WeakPolarHBondContact CD2-OG 3.27Å; Y147-S154 VanDerWaalsContact CE2-CA 3.48Å; Y147-S154 WeakPolarHBondContact CE2-O 3.27Å; Y147-V157 HydrophobicContact CD2-CB 4.01Å; Y147-V157 HydrophobicContact CD2-CG1 4.05Å; Y147-V157 HydrophobicContact CD2-CG2 4.41Å; Y147-V157 HydrophobicContact CE2-CB 4.13Å; Y147-V157 HydrophobicContact CE2-CG1 4.16Å; Y147-D158 VanDerWaalsContact CE2-OD1 3.23Å; Y147-D158 WeakPolarHBondContact CE2-OD1 3.47Å; Y147-D158 PolarHBondContact OH-OD1 2.97Å; Y147-D158 PolarHBondContact OH-OD2 3.48Å; Y147-W175 HydrophobicContact CD1-CH2 4.01Å; Y147-W175 AromaticContact CD1-CZ3 3.95Å; Y147-W175 HydrophobicContact CD1-CZ3 3.95Å; Y147-W175 AromaticContact CD2-CH2 3.76Å; Y147-W175 HydrophobicContact CD2-CH2 3.76Å; Y147-W175 HydrophobicContact CD2-CZ3 4.46Å; Y147-W175 HydrophobicContact CE1-CH2 4.47Å; Y147-W175 HydrophobicContact CE2-CH2 4.22Å; Y147-W175 AromaticContact CG-CH2 3.64Å; Y147-W175 HydrophobicContact CG-CH2 3.64Å; Y147-W175 AromaticContact CG-CZ3 3.88Å; Y147-W175 HydrophobicContact CG-CZ3 3.88Å; Y147-Y180 AromaticContact CD1-CD1 3.88Å; Y147-Y180 HydrophobicContact CD1-CD1 3.88Å; Y147-Y180 AromaticContact CD1-CD2 3.61Å; Y147-Y180 HydrophobicContact CD1-CD2 3.61Å; Y147-Y180 HydrophobicContact CD1-CE1 4.2Å; Y147-Y180 AromaticContact CD1-CE2 3.94Å; Y147-Y180 HydrophobicContact CD1-CE2 3.94Å; Y147-Y180 AromaticContact CD1-CG 3.57Å; Y147-Y180 HydrophobicContact CD1-CG 3.57Å; Y147-Y180 AromaticContact CE1-CD1 3.96Å; Y147-Y180 HydrophobicContact CE1-CD1 3.96Å; Y147-Y180 AromaticContact CE1-CD2 3.85Å; Y147-Y180 HydrophobicContact CE1-CD2 3.85Å; Y147-Y180 AromaticContact CE1-CE1 3.8Å; Y147-Y180 HydrophobicContact CE1-CE1 3.8Å; Y147-Y180 AromaticContact CE1-CE2 3.66Å; Y147-Y180 HydrophobicContact CE1-CE2 3.66Å; Y147-Y180 AromaticContact CE1-CG 3.99Å; Y147-Y180 HydrophobicContact CE1-CG 3.99Å; Y147-Y180 AromaticContact CE1-CZ 3.64Å; Y147-P187 HydrophobicContact CE1-CB 4.12Å
148	N	87.7	Confident	83.6	Confident	79 Å²	79	55.9 Å²	55.9	42%	0.422	28%	0.284	S	S	.	.			trans	-134.9	0.6	178.4	66.8	29.9	0	0	0	113.8	N150 D151 S154	N148-N150 PolarHBondContact O-N 3.44Å; N148-N150 PolarHBondContact OD1-N 3.31Å; N148-D151 WeakPolarHBondContact OD1-CB 3.48Å; N148-D151 PolarHBondContact OD1-N 2.97Å; N148-D151 PolarHBondContact OD1-OD1 3.23Å; N148-D151 VanDerWaalsContact OD1-OD1 3.1Å; N148-S154 PolarHBondContact N-OG 3.49Å
149	G	85.6	Confident	83.5	Confident	24 Å²	24	53.1 Å²	53.1	25%	0.247	28%	0.279	C	S	.	.	S	Bend	trans	78.2	-15.1	178.4	0	0	0	0	0	115.8	S154	G149-S154 PolarHBondContact N-OG 3.44Å
150	N	82.4	Confident	83.7	Confident	147 Å²	147	51.5 Å²	51.5	79%	0.786	27%	0.269	S	S	*	.	S	Bend	trans	-112.4	-25.7	-172.5	-68.6	-27.1	0	0	0	113.2	N148	N148-N150 PolarHBondContact O-N 3.44Å; N148-N150 PolarHBondContact OD1-N 3.31Å
151	D	78	Confident	83.9	Confident	42 Å²	42	50.9 Å²	50.9	23%	0.225	27%	0.267	C	S	.	.	S	Bend	trans	-84	166.1	-177.5	79.2	-25.3	0	0	0	113	N148 R153 S154 R155	N148-D151 WeakPolarHBondContact OD1-CB 3.48Å; N148-D151 PolarHBondContact OD1-N 2.97Å; N148-D151 PolarHBondContact OD1-OD1 3.23Å; N148-D151 VanDerWaalsContact OD1-OD1 3.1Å; D151-R153 PolarHBondContact O-N 2.72Å; D151-R153 VanDerWaalsContact OD2-CB 3.27Å; D151-R153 WeakPolarHBondContact OD2-CB 3.48Å; D151-S154 PolarHBondContact O-N 2.78Å; D151-S154 WeakPolarHBondContact OD1-CA 3.04Å; D151-S154 WeakPolarHBondContact OD1-CB 3.48Å; D151-S154 PolarHBondContact OD1-N 2.8Å; D151-S154 PolarHBondContact OD1-OG 3.47Å; D151-R155 PolarHBondContact O-N 3.39Å; D151-R155 VanDerWaalsContact O-N 3.1Å
152	E	68.5	Low	83.8	Confident	35 Å²	35	54.8 Å²	54.8	16%	0.164	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-30	-178.4	-45.6	-150.9	133.2	0	0	112.2	T59 Y63 R155 A156	T59-E152 VanDerWaalsContact C-OE2 3.29Å; T59-E152 VanDerWaalsContact CG2-CD 3.46Å; T59-E152 WeakPolarHBondContact CG2-OE1 3.34Å; T59-E152 VanDerWaalsContact O-OE1 3.06Å; Y63-E152 HydrophobicContact CD2-CG 4.29Å; Y63-E152 HydrophobicContact CE2-CG 3.77Å; Y63-E152 VanDerWaalsContact CE2-OE1 3.27Å; Y63-E152 WeakPolarHBondContact CE2-OE1 3.35Å; E152-R155 PolarHBondContact O-N 3.18Å; E152-R155 IonicContact OE1-NH2 3.74Å; E152-R155 PolarHBondContact OE1-NH2 2.5Å; E152-A156 PolarHBondContact O-N 2.82Å
153	R	70.9	Confident	83.6	Confident	78 Å²	78	54.4 Å²	54.4	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-42.4	176	-161.7	174.8	-167.3	-174	-4	110.9	T139 D142 A143 N146 D151 A156 V157	T139-R153 PolarHBondContact O-NH2 2.9Å; D142-R153 VanDerWaalsContact CG-NH2 3.32Å; D142-R153 PolarHBondContact O-NH1 3.44Å; D142-R153 IonicContact OD2-CZ 2.99Å; D142-R153 IonicContact OD2-NH1 2.65Å; D142-R153 PolarHBondContact OD2-NH1 3.5Å; D142-R153 IonicContact OD2-NH2 3.14Å; D142-R153 PolarHBondContact OD2-NH2 2.93Å; A143-R153 HydrophobicContact CB-CG 3.85Å; A143-R153 VanDerWaalsContact CB-NE 3.3Å; N146-R153 PolarHBondContact ND2-NH1 3.47Å; D151-R153 PolarHBondContact O-N 2.72Å; D151-R153 VanDerWaalsContact OD2-CB 3.27Å; D151-R153 WeakPolarHBondContact OD2-CB 3.48Å; R153-A156 WeakPolarHBondContact O-CB 3.24Å; R153-A156 PolarHBondContact O-N 3.25Å; R153-V157 WeakPolarHBondContact O-CG2 3.47Å; R153-V157 PolarHBondContact O-N 3.29Å
154	S	81.8	Confident	83.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-45.4	172.8	-62.4	0	0	0	0	111.6	Y147 N148 G149 D151 A156 V157 D158	Y147-S154 VanDerWaalsContact CD2-CB 3.49Å; Y147-S154 WeakPolarHBondContact CD2-OG 3.27Å; Y147-S154 VanDerWaalsContact CE2-CA 3.48Å; Y147-S154 WeakPolarHBondContact CE2-O 3.27Å; N148-S154 PolarHBondContact N-OG 3.49Å; G149-S154 PolarHBondContact N-OG 3.44Å; D151-S154 PolarHBondContact O-N 2.78Å; D151-S154 WeakPolarHBondContact OD1-CA 3.04Å; D151-S154 WeakPolarHBondContact OD1-CB 3.48Å; D151-S154 PolarHBondContact OD1-N 2.8Å; D151-S154 PolarHBondContact OD1-OG 3.47Å; S154-A156 VanDerWaalsContact C-N 3.27Å; S154-A156 PolarHBondContact O-N 3.1Å; S154-V157 WeakPolarHBondContact O-CB 3.39Å; S154-V157 PolarHBondContact O-N 3.26Å; S154-V157 VanDerWaalsContact O-N 3.09Å; S154-D158 VanDerWaalsContact O-CG 3.26Å; S154-D158 PolarHBondContact O-N 2.94Å
155	R	83	Confident	83.7	Confident	125 Å²	125	60.6 Å²	60.6	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-36	175.6	-69.2	-170.2	-72	171.9	0.3	112.9	D151 E152 D158 H159	D151-R155 PolarHBondContact O-N 3.39Å; D151-R155 VanDerWaalsContact O-N 3.1Å; E152-R155 PolarHBondContact O-N 3.18Å; E152-R155 IonicContact OE1-NH2 3.74Å; E152-R155 PolarHBondContact OE1-NH2 2.5Å; R155-D158 PolarHBondContact O-N 3.1Å; R155-H159 WeakPolarHBondContact O-CB 3.34Å; R155-H159 PolarHBondContact O-N 2.88Å
156	A	77.9	Confident	83.9	Confident	56 Å²	56	57.8 Å²	57.8	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-66.9	-41.9	174.5	0	0	0	0	0	111.9	E152 R153 S154 H159 V160	E152-A156 PolarHBondContact O-N 2.82Å; R153-A156 WeakPolarHBondContact O-CB 3.24Å; R153-A156 PolarHBondContact O-N 3.25Å; S154-A156 VanDerWaalsContact C-N 3.27Å; S154-A156 PolarHBondContact O-N 3.1Å; A156-H159 PolarHBondContact O-N 3.34Å; A156-V160 WeakPolarHBondContact O-CG2 3.36Å; A156-V160 PolarHBondContact O-N 2.95Å
157	V	85.7	Confident	84.2	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-47.6	172.9	172.7	0	0	0	0	110.4	Y140 A143 Y147 R153 S154 H159 V160 Q161 W175	Y140-V157 HydrophobicContact CE2-CG1 4.43Å; Y140-V157 HydrophobicContact CE2-CG2 4.34Å; A143-V157 HydrophobicContact CB-CG2 3.75Å; Y147-V157 HydrophobicContact CD2-CB 4.01Å; Y147-V157 HydrophobicContact CD2-CG1 4.05Å; Y147-V157 HydrophobicContact CD2-CG2 4.41Å; Y147-V157 HydrophobicContact CE2-CB 4.13Å; Y147-V157 HydrophobicContact CE2-CG1 4.16Å; R153-V157 WeakPolarHBondContact O-CG2 3.47Å; R153-V157 PolarHBondContact O-N 3.29Å; S154-V157 WeakPolarHBondContact O-CB 3.39Å; S154-V157 PolarHBondContact O-N 3.26Å; S154-V157 VanDerWaalsContact O-N 3.09Å; V157-H159 VanDerWaalsContact C-N 3.3Å; V157-H159 PolarHBondContact O-N 3.15Å; V157-V160 PolarHBondContact O-N 3.34Å; V157-Q161 HydrophobicContact CG1-CG 4.41Å; V157-Q161 WeakPolarHBondContact O-CG 3.24Å; V157-Q161 PolarHBondContact O-N 2.93Å; V157-W175 HydrophobicContact CG1-CH2 4.28Å; V157-W175 HydrophobicContact CG1-CZ2 4.07Å
158	D	87.6	Confident	84.4	Confident	24 Å²	24	53.3 Å²	53.3	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-42.1	178.6	-65.2	-14.2	0	0	0	111.9	Y147 S154 R155 Q161 R162 S189	Y147-D158 VanDerWaalsContact CE2-OD1 3.23Å; Y147-D158 WeakPolarHBondContact CE2-OD1 3.47Å; Y147-D158 PolarHBondContact OH-OD1 2.97Å; Y147-D158 PolarHBondContact OH-OD2 3.48Å; S154-D158 VanDerWaalsContact O-CG 3.26Å; S154-D158 PolarHBondContact O-N 2.94Å; R155-D158 PolarHBondContact O-N 3.1Å; D158-Q161 PolarHBondContact O-N 3.32Å; D158-R162 WeakPolarHBondContact O-CB 3.27Å; D158-R162 WeakPolarHBondContact O-CG 3.28Å; D158-R162 PolarHBondContact O-N 3.28Å; D158-S189 PolarHBondContact OD1-OG 3.46Å; D158-S189 VanDerWaalsContact OD1-OG 3.09Å
159	H	83.9	Confident	84.6	Confident	127 Å²	127	49.8 Å²	49.8	59%	0.588	26%	0.262	S	S	*	.	H	α-helix	trans	-65.4	-43	178.9	-175.3	68.5	0	0	0	111.8	R155 A156 V157 S163	R155-H159 WeakPolarHBondContact O-CB 3.34Å; R155-H159 PolarHBondContact O-N 2.88Å; A156-H159 PolarHBondContact O-N 3.34Å; V157-H159 VanDerWaalsContact C-N 3.3Å; V157-H159 PolarHBondContact O-N 3.15Å; H159-S163 PolarHBondContact CE1-OG 2.83Å; H159-S163 PolarHBondContact NE2-OG 2.94Å; H159-S163 WeakPolarHBondContact O-CB 3.48Å; H159-S163 PolarHBondContact O-N 2.9Å; H159-S163 PolarHBondContact O-OG 3.43Å
160	V	84.5	Confident	85	Confident	39 Å²	39	53.5 Å²	53.5	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-48.8	175.6	168.9	0	0	0	0	110.2	Y140 A156 V157 R162 S163 L164 C217	Y140-V160 HydrophobicContact CE2-CB 4.22Å; Y140-V160 HydrophobicContact CE2-CG1 3.86Å; A156-V160 WeakPolarHBondContact O-CG2 3.36Å; A156-V160 PolarHBondContact O-N 2.95Å; V157-V160 PolarHBondContact O-N 3.34Å; V160-R162 PolarHBondContact O-N 3.49Å; V160-S163 PolarHBondContact O-N 3.46Å; V160-L164 HydrophobicContact CG1-CD1 3.96Å; V160-L164 VanDerWaalsContact O-CB 3.28Å; V160-L164 WeakPolarHBondContact O-CB 3.48Å; V160-L164 PolarHBondContact O-N 3.33Å; V160-C217 HydrophobicContact CG1-CB 4.31Å
161	Q	89	Confident	85.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-45.3	-178.5	-72.6	-179.7	-18.4	0	0	112.8	Y140 V157 D158 S165 C166 W175 S189 C190	Y140-Q161 WeakPolarHBondContact OH-CG 3.46Å; V157-Q161 HydrophobicContact CG1-CG 4.41Å; V157-Q161 WeakPolarHBondContact O-CG 3.24Å; V157-Q161 PolarHBondContact O-N 2.93Å; D158-Q161 PolarHBondContact O-N 3.32Å; Q161-S165 WeakPolarHBondContact O-CA 3.48Å; Q161-S165 PolarHBondContact O-N 2.77Å; Q161-C166 WeakPolarHBondContact CA-O 3.42Å; Q161-C166 WeakPolarHBondContact CB-O 3.34Å; Q161-C166 WeakPolarHBondContact CG-O 3.23Å; Q161-C166 PolarHBondContact O-N 2.72Å; Q161-C166 VanDerWaalsContact O-N 3.07Å; Q161-W175 VanDerWaalsContact NE2-CZ2 3.28Å; Q161-S189 PolarHBondContact OE1-OG 2.73Å; Q161-C190 PolarHBondContact NE2-SG 2.93Å; Q161-C190 VanDerWaalsContact NE2-SG 3.39Å; Q161-C190 PolarHBondContact OE1-SG 2.82Å; Q161-C190 VanDerWaalsContact OE1-SG 3.39Å
162	R	87.7	Confident	86.2	Confident	128 Å²	128	48.9 Å²	48.9	48%	0.483	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-48.3	176.4	-74.7	172.4	161.7	152.2	-6.8	112.3	D158 V160 L164 S165 E194	D158-R162 WeakPolarHBondContact O-CB 3.27Å; D158-R162 WeakPolarHBondContact O-CG 3.28Å; D158-R162 PolarHBondContact O-N 3.28Å; V160-R162 PolarHBondContact O-N 3.49Å; R162-L164 VanDerWaalsContact C-N 3.33Å; R162-L164 PolarHBondContact O-N 3.29Å; R162-S165 PolarHBondContact O-N 3.46Å; R162-E194 IonicContact CZ-OE1 2.77Å; R162-E194 IonicContact NE-OE1 2.83Å; R162-E194 PolarHBondContact NE-OE1 3.21Å; R162-E194 IonicContact NH2-OE1 3.48Å; R162-E194 PolarHBondContact NH2-OE1 2.65Å
163	S	81.8	Confident	87.3	Confident	71 Å²	71	49.8 Å²	49.8	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-67.8	-34.7	-174.2	-58.3	0	0	0	0	112.7	H159 V160	H159-S163 PolarHBondContact CE1-OG 2.83Å; H159-S163 PolarHBondContact NE2-OG 2.94Å; H159-S163 WeakPolarHBondContact O-CB 3.48Å; H159-S163 PolarHBondContact O-N 2.9Å; H159-S163 PolarHBondContact O-OG 3.43Å; V160-S163 PolarHBondContact O-N 3.46Å
164	L	84.9	Confident	88.4	Confident	70 Å²	70	48 Å²	48	37%	0.366	25%	0.25	S	C	.	.	H	α-helix	trans	-97.7	-5.4	179.7	-65.1	-176	0	0	0	113.1	V160 R162 C166 L220 V221	V160-L164 HydrophobicContact CG1-CD1 3.96Å; V160-L164 VanDerWaalsContact O-CB 3.28Å; V160-L164 WeakPolarHBondContact O-CB 3.48Å; V160-L164 PolarHBondContact O-N 3.33Å; R162-L164 VanDerWaalsContact C-N 3.33Å; R162-L164 PolarHBondContact O-N 3.29Å; L164-C166 VanDerWaalsContact C-N 3.32Å; L164-C166 HydrophobicContact CB-CB 4.43Å; L164-C166 VanDerWaalsContact CB-SG 3.59Å; L164-C166 PolarHBondContact O-N 3.36Å; L164-L220 HydrophobicContact CB-CD2 3.95Å; L164-L220 WeakPolarHBondContact O-CD2 2.94Å; L164-V221 HydrophobicContact CD1-CG2 3.61Å
165	S	90.9	Very high	88.9	Confident	72 Å²	72	48 Å²	48	50%	0.503	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	53.9	-174.3	-54	0	0	0	0	111.6	Q161 R162 N213	Q161-S165 WeakPolarHBondContact O-CA 3.48Å; Q161-S165 PolarHBondContact O-N 2.77Å; R162-S165 PolarHBondContact O-N 3.46Å; S165-N213 VanDerWaalsContact C-CG 3.42Å; S165-N213 WeakPolarHBondContact O-CB 3.42Å; S165-N213 VanDerWaalsContact O-CG 3.24Å; S165-N213 PolarHBondContact O-OD1 3.34Å
166	C	93.8	Very high	89.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.			trans	-131	161	-177.9	62.5	0	0	0	0	110.4	Q161 L164 K215 C217 L220	Q161-C166 WeakPolarHBondContact CA-O 3.42Å; Q161-C166 WeakPolarHBondContact CB-O 3.34Å; Q161-C166 WeakPolarHBondContact CG-O 3.23Å; Q161-C166 PolarHBondContact O-N 2.72Å; Q161-C166 VanDerWaalsContact O-N 3.07Å; L164-C166 VanDerWaalsContact C-N 3.32Å; L164-C166 HydrophobicContact CB-CB 4.43Å; L164-C166 VanDerWaalsContact CB-SG 3.59Å; L164-C166 PolarHBondContact O-N 3.36Å; C166-K215 CarbonylContact C-O 3.56Å; C166-K215 VanDerWaalsContact CA-O 3.3Å; C166-K215 WeakPolarHBondContact CA-O 3.29Å; C166-K215 WeakPolarHBondContact CB-O 3.44Å; C166-C217 HydrophobicContact CB-CB 3.94Å; C166-C217 WeakPolarHBondContact CB-SG 3.08Å; C166-C217 WeakPolarHBondContact SG-CA 3.36Å; C166-C217 WeakPolarHBondContact SG-CB 3.45Å; C166-C217 CovalentContact SG-SG 2.03Å; C166-C217 PolarHBondContact SG-SG 3.37Å; C166-L220 HydrophobicContact CB-CD2 4.39Å
167	C	94.4	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.			trans	-138.9	134.6	176.3	-170.2	0	0	0	0	112.4	N171 Y172 W175 C190 N213 K215	C167-N171 CarbonylContact O-C 3.27Å; C167-N171 VanDerWaalsContact O-C 3.27Å; C167-Y172 PolarHBondContact O-N 3.39Å; C167-W175 VanDerWaalsContact SG-CD1 3.51Å; C167-W175 PolarHBondContact SG-NE1 2.88Å; C167-C190 WeakPolarHBondContact CA-SG 3.35Å; C167-C190 HydrophobicContact CB-CB 3.63Å; C167-C190 WeakPolarHBondContact CB-SG 3.38Å; C167-C190 WeakPolarHBondContact SG-CB 3.36Å; C167-C190 CovalentContact SG-SG 2.03Å; C167-C190 PolarHBondContact SG-SG 2.86Å; C167-N213 HydrophobicContact CB-CB 4.3Å; C167-N213 WeakPolarHBondContact CB-O 3.44Å; C167-K215 PolarHBondContact N-O 3.28Å
168	G	93.1	Very high	90.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.25	C	C	.	.	S	Bend	trans	67.3	-173.6	-178	0	0	0	0	0	112.6	Y140 C217	Y140-G168 WeakPolarHBondContact CE1-O 3.45Å; G168-C217 WeakPolarHBondContact O-CB 3.33Å; G168-C217 PolarHBondContact O-N 3.07Å; G168-C217 PolarHBondContact O-SG 3.25Å
169	V	91.9	Very high	90.4	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	27%	0.268	C	S	.	.	S	Bend	trans	-75.6	-66	-177.2	-173.7	0	0	0	0	109.9	L137 Y140 M144 N174 G216 C217 Y218	L137-V169 HydrophobicContact CD1-CG1 3.41Å; L137-V169 VanDerWaalsContact CD1-CG1 3.41Å; Y140-V169 HydrophobicContact CD1-CB 4.41Å; Y140-V169 HydrophobicContact CD1-CG1 4.44Å; Y140-V169 HydrophobicContact CD1-CG2 3.97Å; Y140-V169 HydrophobicContact CE1-CG2 4.28Å; M144-V169 HydrophobicContact CE-CG2 4.15Å; M144-V169 HydrophobicContact SD-CG2 3.81Å; V169-N174 PolarHBondContact N-OD1 3.02Å; V169-G216 CarbonylContact O-C 3.56Å; V169-G216 VanDerWaalsContact O-C 3.29Å; V169-G216 VanDerWaalsContact O-CA 3.26Å; V169-G216 WeakPolarHBondContact O-CA 3.27Å; V169-C217 PolarHBondContact O-N 3.21Å; V169-Y218 WeakPolarHBondContact O-CB 3.43Å; V169-Y218 PolarHBondContact O-N 3.46Å
170	Q	92.6	Very high	90.7	Very high	102 Å²	102	44.3 Å²	44.3	48%	0.477	25%	0.246	S	C	.	.	S	Bend	trans	-105.2	-29.3	176.4	-66.4	176.6	-46.1	0	0	111.3	N174 G216 Y218	Q170-N174 PolarHBondContact N-OD1 3.47Å; Q170-G216 WeakPolarHBondContact O-CA 3.49Å; Q170-G216 PolarHBondContact O-N 2.92Å; Q170-G216 VanDerWaalsContact O-N 3.09Å; Q170-Y218 HydrophobicContact CG-CD1 4.45Å
171	N	93.2	Very high	91.1	Very high	61 Å²	61	43.8 Å²	43.8	33%	0.326	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-152.8	158.1	-179.9	-154.9	-48.3	0	0	0	110.8	C167 T173 N174	C167-N171 CarbonylContact O-C 3.27Å; C167-N171 VanDerWaalsContact O-C 3.27Å; N171-T173 PolarHBondContact O-N 3.27Å; N171-T173 VanDerWaalsContact O-N 3.17Å; N171-N174 PolarHBondContact N-OD1 3.01Å; N171-N174 VanDerWaalsContact O-CB 3.32Å; N171-N174 WeakPolarHBondContact O-CB 3.34Å; N171-N174 PolarHBondContact O-N 3.41Å; N171-N174 PolarHBondContact O-OD1 2.84Å; N171-N174 VanDerWaalsContact O-OD1 3.07Å
172	Y	92.2	Very high	91	Very high	31 Å²	31	50.3 Å²	50.3	12%	0.122	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-58.4	-29.2	175.6	74.6	-89.2	0	0	0	111.9	C167 N174 W175 I186 L205 A209 V212 Q214	C167-Y172 PolarHBondContact O-N 3.39Å; Y172-N174 PolarHBondContact O-N 2.99Å; Y172-N174 VanDerWaalsContact O-N 3.17Å; Y172-W175 WeakPolarHBondContact O-CB 3.41Å; Y172-W175 PolarHBondContact O-N 3Å; Y172-I186 HydrophobicContact CD2-CD1 3.72Å; Y172-L205 HydrophobicContact CD2-CD2 4.15Å; Y172-L205 HydrophobicContact CE2-CB 4.49Å; Y172-L205 HydrophobicContact CE2-CD2 3.91Å; Y172-L205 WeakPolarHBondContact CE2-O 3.32Å; Y172-A209 HydrophobicContact CE1-CB 4.25Å; Y172-A209 HydrophobicContact CE2-CB 4.27Å; Y172-A209 VanDerWaalsContact OH-CB 3.3Å; Y172-A209 WeakPolarHBondContact OH-CB 3.43Å; Y172-V212 HydrophobicContact CD1-CG2 4.3Å; Y172-V212 HydrophobicContact CD2-CG2 3.94Å; Y172-V212 HydrophobicContact CG-CG2 3.69Å; Y172-Q214 HydrophobicContact CD1-CG 4.39Å; Y172-Q214 HydrophobicContact CE1-CG 4.45Å
173	T	93.3	Very high	91.1	Very high	54 Å²	54	50 Å²	50	33%	0.331	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-63.3	-19.2	177.4	60.7	0	0	0	0	113.3	N171 W175 S176 L205	N171-T173 PolarHBondContact O-N 3.27Å; N171-T173 VanDerWaalsContact O-N 3.17Å; T173-W175 PolarHBondContact O-N 3.38Å; T173-W175 VanDerWaalsContact O-N 3.16Å; T173-S176 VanDerWaalsContact O-CB 3.3Å; T173-S176 WeakPolarHBondContact O-CB 3.32Å; T173-S176 PolarHBondContact O-N 3.37Å; T173-S176 PolarHBondContact O-OG 2.94Å; T173-L205 HydrophobicContact CG2-CD2 4.19Å
174	N	92.9	Very high	91.4	Very high	39 Å²	39	51.7 Å²	51.7	21%	0.209	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.8	175.7	-67.2	137	0	0	0	112.4	M144 V169 Q170 N171 Y172 S176 T177	M144-N174 HydrophobicContact CE-CB 3.93Å; M144-N174 WeakPolarHBondContact CE-O 3.38Å; M144-N174 HydrophobicContact SD-CB 4.01Å; V169-N174 PolarHBondContact N-OD1 3.02Å; Q170-N174 PolarHBondContact N-OD1 3.47Å; N171-N174 PolarHBondContact N-OD1 3.01Å; N171-N174 VanDerWaalsContact O-CB 3.32Å; N171-N174 WeakPolarHBondContact O-CB 3.34Å; N171-N174 PolarHBondContact O-N 3.41Å; N171-N174 PolarHBondContact O-OD1 2.84Å; N171-N174 VanDerWaalsContact O-OD1 3.07Å; Y172-N174 PolarHBondContact O-N 2.99Å; Y172-N174 VanDerWaalsContact O-N 3.17Å; N174-S176 PolarHBondContact O-N 2.98Å; N174-T177 PolarHBondContact O-N 2.93Å; N174-T177 VanDerWaalsContact O-N 3.16Å; N174-T177 PolarHBondContact O-OG1 3.09Å
175	W	93.4	Very high	91.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-59.9	-29.9	173.6	-78	106.5	0	0	0	113.1	M144 Y147 V157 Q161 C167 Y172 T173 T177 S178 Y180 F181 I186 P187 C190	M144-W175 HydrophobicContact CG-CD2 4.11Å; M144-W175 HydrophobicContact CG-CE3 4.06Å; M144-W175 HydrophobicContact CG-CH2 3.64Å; M144-W175 HydrophobicContact CG-CZ2 3.67Å; M144-W175 HydrophobicContact CG-CZ3 3.85Å; M144-W175 HydrophobicContact SD-CD2 4.29Å; M144-W175 HydrophobicContact SD-CZ2 4.5Å; Y147-W175 HydrophobicContact CD1-CH2 4.01Å; Y147-W175 AromaticContact CD1-CZ3 3.95Å; Y147-W175 HydrophobicContact CD1-CZ3 3.95Å; Y147-W175 AromaticContact CD2-CH2 3.76Å; Y147-W175 HydrophobicContact CD2-CH2 3.76Å; Y147-W175 HydrophobicContact CD2-CZ3 4.46Å; Y147-W175 HydrophobicContact CE1-CH2 4.47Å; Y147-W175 HydrophobicContact CE2-CH2 4.22Å; Y147-W175 AromaticContact CG-CH2 3.64Å; Y147-W175 HydrophobicContact CG-CH2 3.64Å; Y147-W175 AromaticContact CG-CZ3 3.88Å; Y147-W175 HydrophobicContact CG-CZ3 3.88Å; V157-W175 HydrophobicContact CG1-CH2 4.28Å; V157-W175 HydrophobicContact CG1-CZ2 4.07Å; Q161-W175 VanDerWaalsContact NE2-CZ2 3.28Å; C167-W175 VanDerWaalsContact SG-CD1 3.51Å; C167-W175 PolarHBondContact SG-NE1 2.88Å; Y172-W175 WeakPolarHBondContact O-CB 3.41Å; Y172-W175 PolarHBondContact O-N 3Å; T173-W175 PolarHBondContact O-N 3.38Å; T173-W175 VanDerWaalsContact O-N 3.16Å; W175-T177 PolarHBondContact O-N 3.48Å; W175-S178 WeakPolarHBondContact O-CB 3.15Å; W175-S178 PolarHBondContact O-N 3.45Å; W175-Y180 HydrophobicContact CZ3-CD1 4.3Å; W175-F181 HydrophobicContact CB-CD2 4.29Å; W175-F181 WeakPolarHBondContact O-CB 3.38Å; W175-I186 HydrophobicContact CB-CG1 3.94Å; W175-I186 HydrophobicContact CG-CG1 4.38Å; W175-I186 HydrophobicContact CG-CG2 4.24Å; W175-P187 VanDerWaalsContact CD2-CD 3.41Å; W175-P187 HydrophobicContact CD2-CG 4.02Å; W175-P187 VanDerWaalsContact CE2-CD 3.43Å; W175-P187 HydrophobicContact CE3-CG 4.23Å; W175-P187 HydrophobicContact CH2-CG 3.57Å; W175-P187 HydrophobicContact CZ2-CG 3.31Å; W175-P187 HydrophobicContact CZ3-CG 4.02Å; W175-C190 PolarHBondContact NE1-SG 3.46Å; W175-C190 VanDerWaalsContact NE1-SG 3.42Å
176	S	91.2	Very high	91.8	Very high	55 Å²	55	45 Å²	45	39%	0.385	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-59	-20.4	177.1	67.2	0	0	0	0	114.3	T173 N174	T173-S176 VanDerWaalsContact O-CB 3.3Å; T173-S176 WeakPolarHBondContact O-CB 3.32Å; T173-S176 PolarHBondContact O-N 3.37Å; T173-S176 PolarHBondContact O-OG 2.94Å; N174-S176 PolarHBondContact O-N 2.98Å
177	T	90.7	Very high	91.8	Very high	88 Å²	88	45 Å²	45	54%	0.54	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-91.4	-13.2	176.9	67.3	0	0	0	0	113.4	Q145 N174 W175	Q145-T177 PolarHBondContact NE2-OG1 3.32Å; Q145-T177 PolarHBondContact OE1-O 2.85Å; N174-T177 PolarHBondContact O-N 2.93Å; N174-T177 VanDerWaalsContact O-N 3.16Å; N174-T177 PolarHBondContact O-OG1 3.09Å; W175-T177 PolarHBondContact O-N 3.48Å
178	S	90.9	Very high	91.6	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.014	26%	0.264	C	S	.	.	S	Bend	trans	-80.7	139.4	-179.4	177.6	0	0	0	0	110.3	M144 W175 Y180 F181	M144-S178 PolarHBondContact O-OG 3.19Å; W175-S178 WeakPolarHBondContact O-CB 3.15Å; W175-S178 PolarHBondContact O-N 3.45Å; S178-Y180 PolarHBondContact O-N 3.39Å; S178-Y180 VanDerWaalsContact O-N 3.15Å; S178-Y180 PolarHBondContact OG-N 3.38Å; S178-F181 WeakPolarHBondContact O-CB 3.35Å; S178-F181 PolarHBondContact O-N 2.88Å; S178-F181 VanDerWaalsContact O-N 3.12Å
179	P	91.4	Very high	91.5	Very high	80 Å²	80	48.6 Å²	48.6	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-53.8	-33	174	-25.1	33.9	0	0	0	113.2	Q145 F181 L182	Q145-P179 WeakPolarHBondContact O-CD 3.33Å; P179-F181 VanDerWaalsContact C-N 3.25Å; P179-F181 PolarHBondContact O-N 2.67Å; P179-L182 PolarHBondContact O-N 3.09Å
180	Y	90.8	Very high	91.6	Very high	32 Å²	32	48.3 Å²	48.3	13%	0.125	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-33.9	-179.7	-176.6	-98	0	0	0	113.4	Y147 W175 S178 L182 D183 H184 G185 P187	Y147-Y180 AromaticContact CD1-CD1 3.88Å; Y147-Y180 HydrophobicContact CD1-CD1 3.88Å; Y147-Y180 AromaticContact CD1-CD2 3.61Å; Y147-Y180 HydrophobicContact CD1-CD2 3.61Å; Y147-Y180 HydrophobicContact CD1-CE1 4.2Å; Y147-Y180 AromaticContact CD1-CE2 3.94Å; Y147-Y180 HydrophobicContact CD1-CE2 3.94Å; Y147-Y180 AromaticContact CD1-CG 3.57Å; Y147-Y180 HydrophobicContact CD1-CG 3.57Å; Y147-Y180 AromaticContact CE1-CD1 3.96Å; Y147-Y180 HydrophobicContact CE1-CD1 3.96Å; Y147-Y180 AromaticContact CE1-CD2 3.85Å; Y147-Y180 HydrophobicContact CE1-CD2 3.85Å; Y147-Y180 AromaticContact CE1-CE1 3.8Å; Y147-Y180 HydrophobicContact CE1-CE1 3.8Å; Y147-Y180 AromaticContact CE1-CE2 3.66Å; Y147-Y180 HydrophobicContact CE1-CE2 3.66Å; Y147-Y180 AromaticContact CE1-CG 3.99Å; Y147-Y180 HydrophobicContact CE1-CG 3.99Å; Y147-Y180 AromaticContact CE1-CZ 3.64Å; W175-Y180 HydrophobicContact CZ3-CD1 4.3Å; S178-Y180 PolarHBondContact O-N 3.39Å; S178-Y180 VanDerWaalsContact O-N 3.15Å; S178-Y180 PolarHBondContact OG-N 3.38Å; Y180-L182 PolarHBondContact O-N 3.36Å; Y180-D183 PolarHBondContact O-N 3.45Å; Y180-H184 HydrophobicContact CD1-CB 4.15Å; Y180-H184 HydrophobicContact CD2-CB 4.43Å; Y180-H184 HydrophobicContact CE1-CB 3.54Å; Y180-H184 HydrophobicContact CE2-CB 3.87Å; Y180-H184 AromaticContact CE2-CG 3.77Å; Y180-H184 AromaticContact CE2-ND1 3.77Å; Y180-H184 AromaticContact CZ-CG 3.74Å; Y180-H184 PolarHBondContact O-N 2.97Å; Y180-H184 VanDerWaalsContact O-N 3.07Å; Y180-G185 WeakPolarHBondContact CD1-O 3.32Å; Y180-P187 HydrophobicContact CE1-CB 4.11Å
181	F	92.2	Very high	91.6	Very high	29 Å²	29	44.1 Å²	44.1	13%	0.127	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-28.1	-175.2	177.7	-91	0	0	0	113.1	W175 S178 P179 D183 G185 I186 H203 L205	W175-F181 HydrophobicContact CB-CD2 4.29Å; W175-F181 WeakPolarHBondContact O-CB 3.38Å; S178-F181 WeakPolarHBondContact O-CB 3.35Å; S178-F181 PolarHBondContact O-N 2.88Å; S178-F181 VanDerWaalsContact O-N 3.12Å; P179-F181 VanDerWaalsContact C-N 3.25Å; P179-F181 PolarHBondContact O-N 2.67Å; F181-D183 VanDerWaalsContact C-N 3.33Å; F181-D183 PolarHBondContact O-N 3.23Å; F181-G185 WeakPolarHBondContact CA-O 3.5Å; F181-G185 VanDerWaalsContact CD2-C 3.5Å; F181-G185 WeakPolarHBondContact O-CA 3.22Å; F181-G185 PolarHBondContact O-N 2.95Å; F181-I186 HydrophobicContact CD2-CG1 3.97Å; F181-I186 HydrophobicContact CE2-CG1 3.86Å; F181-H203 WeakPolarHBondContact CZ-O 3.38Å; F181-L205 HydrophobicContact CE2-CD2 4.46Å; F181-L205 HydrophobicContact CE2-CG 4.3Å; F181-L205 HydrophobicContact CZ-CD1 4.09Å; F181-L205 HydrophobicContact CZ-CG 3.98Å
182	L	88.1	Confident	91.5	Very high	136 Å²	136	46.6 Å²	46.6	71%	0.712	26%	0.256	S	S	*	.	H	α-helix	trans	-62.2	-41.9	179.9	-65.6	173.3	0	0	0	111.9	P179 Y180	P179-L182 PolarHBondContact O-N 3.09Å; Y180-L182 PolarHBondContact O-N 3.36Å
183	D	88.6	Confident	91.3	Very high	123 Å²	123	49.5 Å²	49.5	66%	0.658	27%	0.274	S	S	*	.	H	α-helix	trans	-96.6	-30	-173.6	-64.4	-42	0	0	0	113.1	Y180 F181 H203	Y180-D183 PolarHBondContact O-N 3.45Å; F181-D183 VanDerWaalsContact C-N 3.33Å; F181-D183 PolarHBondContact O-N 3.23Å; D183-H203 PolarHBondContact O-CE1 2.71Å
184	H	89.1	Confident	90.6	Very high	106 Å²	106	53.2 Å²	53.2	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-128.8	-5.1	-169.9	-59.4	84.2	0	0	0	114.6	Y180	Y180-H184 HydrophobicContact CD1-CB 4.15Å; Y180-H184 HydrophobicContact CD2-CB 4.43Å; Y180-H184 HydrophobicContact CE1-CB 3.54Å; Y180-H184 HydrophobicContact CE2-CB 3.87Å; Y180-H184 AromaticContact CE2-CG 3.77Å; Y180-H184 AromaticContact CE2-ND1 3.77Å; Y180-H184 AromaticContact CZ-CG 3.74Å; Y180-H184 PolarHBondContact O-N 2.97Å; Y180-H184 VanDerWaalsContact O-N 3.07Å
185	G	90.7	Very high	90.1	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.313	C	S	.	.			trans	69.1	-156.1	-173.1	0	0	0	0	0	113	Y180 F181 H203	Y180-G185 WeakPolarHBondContact CD1-O 3.32Å; F181-G185 WeakPolarHBondContact CA-O 3.5Å; F181-G185 VanDerWaalsContact CD2-C 3.5Å; F181-G185 WeakPolarHBondContact O-CA 3.22Å; F181-G185 PolarHBondContact O-N 2.95Å; G185-H203 PolarHBondContact N-CE1 2.94Å; G185-H203 VanDerWaalsContact N-CE1 3.32Å
186	I	93.4	Very high	89.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-69.4	137.8	175.4	-59.1	-177.4	0	0	0	109.3	Y172 W175 F181 C190 L202 L205 A208 V212	Y172-I186 HydrophobicContact CD2-CD1 3.72Å; W175-I186 HydrophobicContact CB-CG1 3.94Å; W175-I186 HydrophobicContact CG-CG1 4.38Å; W175-I186 HydrophobicContact CG-CG2 4.24Å; F181-I186 HydrophobicContact CD2-CG1 3.97Å; F181-I186 HydrophobicContact CE2-CG1 3.86Å; I186-C190 HydrophobicContact CG2-CB 3.7Å; I186-L202 HydrophobicContact CB-CB 4.32Å; I186-L202 HydrophobicContact CB-CD2 3.85Å; I186-L202 HydrophobicContact CG2-CD2 4.19Å; I186-L202 PolarHBondContact N-O 2.86Å; I186-L202 WeakPolarHBondContact O-CB 3.22Å; I186-L202 WeakPolarHBondContact O-CD1 3.48Å; I186-L205 HydrophobicContact CD1-CD2 4.37Å; I186-A208 HydrophobicContact CD1-CB 3.9Å; I186-V212 HydrophobicContact CG2-CG1 4.33Å
187	P	93.3	Very high	89.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.319	C	S	.	.			trans	-65.2	147.3	179.7	27.9	-36.8	0	0	0	112.4	Y147 W175 Y180 S189 C190	Y147-P187 HydrophobicContact CE1-CB 4.12Å; W175-P187 VanDerWaalsContact CD2-CD 3.41Å; W175-P187 HydrophobicContact CD2-CG 4.02Å; W175-P187 VanDerWaalsContact CE2-CD 3.43Å; W175-P187 HydrophobicContact CE3-CG 4.23Å; W175-P187 HydrophobicContact CH2-CG 3.57Å; W175-P187 HydrophobicContact CZ2-CG 3.31Å; W175-P187 HydrophobicContact CZ3-CG 4.02Å; Y180-P187 HydrophobicContact CE1-CB 4.11Å; P187-S189 PolarHBondContact O-N 2.91Å; P187-S189 VanDerWaalsContact O-N 3.15Å; P187-C190 WeakPolarHBondContact O-CB 3.4Å; P187-C190 PolarHBondContact O-N 2.87Å
188	P	91.4	Very high	89.3	Confident	72 Å²	72	59.1 Å²	59.1	47%	0.468	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-66.1	-18.3	-176.5	26	-34.2	0	0	0	113.6	C190 C191	P188-C190 PolarHBondContact O-N 2.83Å; P188-C191 VanDerWaalsContact O-CB 3.26Å; P188-C191 WeakPolarHBondContact O-CB 3.49Å; P188-C191 PolarHBondContact O-N 3.34Å; P188-C191 VanDerWaalsContact O-N 3.09Å; P188-C191 PolarHBondContact O-SG 3.39Å
189	S	90.6	Very high	89	Confident	4 Å²	4	63 Å²	63	3%	0.028	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-58.9	-21.7	170.8	49.1	0	0	0	0	114	D158 Q161 P187	D158-S189 PolarHBondContact OD1-OG 3.46Å; D158-S189 VanDerWaalsContact OD1-OG 3.09Å; Q161-S189 PolarHBondContact OE1-OG 2.73Å; P187-S189 PolarHBondContact O-N 2.91Å; P187-S189 VanDerWaalsContact O-N 3.15Å
190	C	93.5	Very high	88.7	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-80.2	-13.2	176.3	-82.4	0	0	0	0	114.4	Q161 C167 W175 I186 P187 P188 V212 N213	Q161-C190 PolarHBondContact NE2-SG 2.93Å; Q161-C190 VanDerWaalsContact NE2-SG 3.39Å; Q161-C190 PolarHBondContact OE1-SG 2.82Å; Q161-C190 VanDerWaalsContact OE1-SG 3.39Å; C167-C190 WeakPolarHBondContact CA-SG 3.35Å; C167-C190 HydrophobicContact CB-CB 3.63Å; C167-C190 WeakPolarHBondContact CB-SG 3.38Å; C167-C190 WeakPolarHBondContact SG-CB 3.36Å; C167-C190 CovalentContact SG-SG 2.03Å; C167-C190 PolarHBondContact SG-SG 2.86Å; W175-C190 PolarHBondContact NE1-SG 3.46Å; W175-C190 VanDerWaalsContact NE1-SG 3.42Å; I186-C190 HydrophobicContact CG2-CB 3.7Å; P187-C190 WeakPolarHBondContact O-CB 3.4Å; P187-C190 PolarHBondContact O-N 2.87Å; P188-C190 PolarHBondContact O-N 2.83Å; C190-V212 HydrophobicContact CB-CB 4.19Å; C190-V212 HydrophobicContact CB-CG1 4.31Å; C190-V212 WeakPolarHBondContact O-CA 3.5Å; C190-N213 PolarHBondContact O-N 2.9Å; C190-N213 PolarHBondContact O-ND2 3.2Å
191	C	93.1	Very high	88.5	Confident	15 Å²	15	66.7 Å²	66.7	10%	0.101	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-65.6	140.2	-174.3	-60.7	0	0	0	0	111.7	P188 N193 C197	P188-C191 VanDerWaalsContact O-CB 3.26Å; P188-C191 WeakPolarHBondContact O-CB 3.49Å; P188-C191 PolarHBondContact O-N 3.34Å; P188-C191 VanDerWaalsContact O-N 3.09Å; P188-C191 PolarHBondContact O-SG 3.39Å; C191-N193 VanDerWaalsContact C-N 3.33Å; C191-C197 HydrophobicContact CB-CB 3.46Å; C191-C197 VanDerWaalsContact CB-CB 3.46Å; C191-C197 WeakPolarHBondContact CB-SG 3.48Å; C191-C197 WeakPolarHBondContact SG-CB 3.46Å; C191-C197 CovalentContact SG-SG 2.01Å; C191-C197 PolarHBondContact SG-SG 3.1Å
192	M	90.9	Very high	88.4	Confident	113 Å²	113	65.5 Å²	65.5	56%	0.557	35%	0.35	S	S	*	.	S	Bend	trans	-70.7	-34.3	171.8	-64.1	-172	-177.2	0	0	111.4	K211 V212	M192-K211 PolarHBondContact N-O 2.92Å; M192-V212 WeakPolarHBondContact CE-O 3.2Å
193	N	87.1	Confident	88.5	Confident	91 Å²	91	62.5 Å²	62.5	49%	0.487	33%	0.332	S	S	.	.			trans	-140	120.1	-179.9	-163.3	-2.8	0	0	0	109.4	C191 T195 D196 C197	C191-N193 VanDerWaalsContact C-N 3.33Å; N193-T195 PolarHBondContact O-N 2.93Å; N193-T195 PolarHBondContact OD1-OG1 2.93Å; N193-D196 PolarHBondContact O-N 3.42Å; N193-C197 WeakPolarHBondContact O-CB 3.4Å
194	E	78.8	Confident	88.5	Confident	133 Å²	133	60.2 Å²	60.2	62%	0.621	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-66.4	-22.2	-174.4	-65.2	-166.4	155.5	0	0	112.8	R162	R162-E194 IonicContact CZ-OE1 2.77Å; R162-E194 IonicContact NE-OE1 2.83Å; R162-E194 PolarHBondContact NE-OE1 3.21Å; R162-E194 IonicContact NH2-OE1 3.48Å; R162-E194 PolarHBondContact NH2-OE1 2.65Å
195	T	82.5	Confident	88.4	Confident	119 Å²	119	57.6 Å²	57.6	73%	0.73	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-82.6	-17.7	-178.5	55.2	0	0	0	0	114.4	N193	N193-T195 PolarHBondContact O-N 2.93Å; N193-T195 PolarHBondContact OD1-OG1 2.93Å
196	D	84.1	Confident	88.3	Confident	79 Å²	79	62.6 Å²	62.6	42%	0.422	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-121.9	30.5	-173.2	-172.5	27	0	0	0	111.3	N193 K211	N193-D196 PolarHBondContact O-N 3.42Å; D196-K211 WeakPolarHBondContact O-CD 3.24Å; D196-K211 IonicContact OD1-NZ 2.65Å; D196-K211 PolarHBondContact OD1-NZ 3.39Å; D196-K211 IonicContact OD2-NZ 2.61Å; D196-K211 PolarHBondContact OD2-NZ 3.3Å
197	C	85.5	Confident	88.1	Confident	13 Å²	13	65 Å²	65	9%	0.088	36%	0.355	C	S	.	.			trans	-134.2	79	-173.7	-155.5	0	0	0	0	110.2	C191 N193	C191-C197 HydrophobicContact CB-CB 3.46Å; C191-C197 VanDerWaalsContact CB-CB 3.46Å; C191-C197 WeakPolarHBondContact CB-SG 3.48Å; C191-C197 WeakPolarHBondContact SG-CB 3.46Å; C191-C197 CovalentContact SG-SG 2.01Å; C191-C197 PolarHBondContact SG-SG 3.1Å; N193-C197 WeakPolarHBondContact O-CB 3.4Å
198	N	88.4	Confident	87.9	Confident	95 Å²	95	65 Å²	65	51%	0.508	36%	0.355	S	S	.	.			trans	-77.1	147.5	-178.3	-69.9	-30.7	0	0	0	111	Q200 D201 L202	N198-Q200 PolarHBondContact O-N 3.47Å; N198-Q200 VanDerWaalsContact O-N 3.12Å; N198-D201 PolarHBondContact O-N 2.99Å; N198-L202 PolarHBondContact O-N 2.93Å
199	P	85.1	Confident	87.8	Confident	84 Å²	84	62.3 Å²	62.3	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-52.4	-36.7	176.5	-28.7	35.5	0	0	0	113.7	D201 L202 H203	P199-D201 VanDerWaalsContact C-N 3.33Å; P199-D201 PolarHBondContact O-N 3.46Å; P199-L202 WeakPolarHBondContact O-CB 3.17Å; P199-L202 PolarHBondContact O-N 3.36Å; P199-H203 PolarHBondContact O-CD2 3.18Å; P199-H203 VanDerWaalsContact O-CD2 3.28Å; P199-H203 PolarHBondContact O-N 3.43Å
200	Q	85.2	Confident	87.8	Confident	143 Å²	143	66.8 Å²	66.8	67%	0.668	37%	0.366	S	S	*	.	H	α-helix	trans	-70	-29.9	-178.6	-53.4	-51.6	-5.9	0	0	113.9	N198 L202	N198-Q200 PolarHBondContact O-N 3.47Å; N198-Q200 VanDerWaalsContact O-N 3.12Å; Q200-L202 VanDerWaalsContact C-N 3.28Å
201	D	87.1	Confident	87.7	Confident	46 Å²	46	69.1 Å²	69.1	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-72.1	-28.9	175.7	-60.9	-33.3	0	0	0	110.8	N198 P199 H203 N204 V207 A208	N198-D201 PolarHBondContact O-N 2.99Å; P199-D201 VanDerWaalsContact C-N 3.33Å; P199-D201 PolarHBondContact O-N 3.46Å; D201-H203 VanDerWaalsContact C-N 3.34Å; D201-N204 PolarHBondContact O-N 3.41Å; D201-N204 VanDerWaalsContact O-O 3.11Å; D201-V207 HydrophobicContact CB-CG1 3.84Å; D201-A208 PolarHBondContact O-N 2.66Å
202	L	89.3	Confident	87.7	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-76.3	-17.4	-178.8	-68.1	163.6	0	0	0	113.7	I186 N198 P199 Q200 N204 V212	I186-L202 HydrophobicContact CB-CB 4.32Å; I186-L202 HydrophobicContact CB-CD2 3.85Å; I186-L202 HydrophobicContact CG2-CD2 4.19Å; I186-L202 PolarHBondContact N-O 2.86Å; I186-L202 WeakPolarHBondContact O-CB 3.22Å; I186-L202 WeakPolarHBondContact O-CD1 3.48Å; N198-L202 PolarHBondContact O-N 2.93Å; P199-L202 WeakPolarHBondContact O-CB 3.17Å; P199-L202 PolarHBondContact O-N 3.36Å; Q200-L202 VanDerWaalsContact C-N 3.28Å; L202-N204 VanDerWaalsContact C-N 3.35Å; L202-V212 HydrophobicContact CD2-CG1 3.52Å
203	H	89.9	Confident	87.8	Confident	72 Å²	72	64.1 Å²	64.1	33%	0.333	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-23.6	170	-79.8	-85	0	0	0	112.7	F181 D183 G185 P199 D201	F181-H203 WeakPolarHBondContact CZ-O 3.38Å; D183-H203 PolarHBondContact O-CE1 2.71Å; G185-H203 PolarHBondContact N-CE1 2.94Å; G185-H203 VanDerWaalsContact N-CE1 3.32Å; P199-H203 PolarHBondContact O-CD2 3.18Å; P199-H203 VanDerWaalsContact O-CD2 3.28Å; P199-H203 PolarHBondContact O-N 3.43Å; D201-H203 VanDerWaalsContact C-N 3.34Å
204	N	89.6	Confident	88	Confident	76 Å²	76	64.8 Å²	64.8	41%	0.406	35%	0.351	S	S	.	.			trans	-104.2	105.5	-179.4	-171.5	-25	0	0	0	110.8	D201 L202 T206 V207 A208	D201-N204 PolarHBondContact O-N 3.41Å; D201-N204 VanDerWaalsContact O-O 3.11Å; L202-N204 VanDerWaalsContact C-N 3.35Å; N204-T206 PolarHBondContact O-N 2.83Å; N204-T206 PolarHBondContact OD1-N 3.3Å; N204-T206 PolarHBondContact OD1-OG1 3.32Å; N204-V207 HydrophobicContact CB-CB 4.26Å; N204-V207 HydrophobicContact CB-CG2 4.12Å; N204-V207 PolarHBondContact O-N 2.97Å; N204-A208 VanDerWaalsContact O-CB 3.31Å; N204-A208 WeakPolarHBondContact O-CB 3.47Å; N204-A208 PolarHBondContact O-N 3.4Å
205	L	87.4	Confident	88.6	Confident	50 Å²	50	65.2 Å²	65.2	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-51.1	-35.5	-179.8	-74.9	150	0	0	0	113.7	Y172 T173 F181 I186 A209	Y172-L205 HydrophobicContact CD2-CD2 4.15Å; Y172-L205 HydrophobicContact CE2-CB 4.49Å; Y172-L205 HydrophobicContact CE2-CD2 3.91Å; Y172-L205 WeakPolarHBondContact CE2-O 3.32Å; T173-L205 HydrophobicContact CG2-CD2 4.19Å; F181-L205 HydrophobicContact CE2-CD2 4.46Å; F181-L205 HydrophobicContact CE2-CG 4.3Å; F181-L205 HydrophobicContact CZ-CD1 4.09Å; F181-L205 HydrophobicContact CZ-CG 3.98Å; I186-L205 HydrophobicContact CD1-CD2 4.37Å; L205-A209 PolarHBondContact O-N 3.08Å
206	T	88.6	Confident	89.1	Confident	105 Å²	105	59.5 Å²	59.5	64%	0.644	32%	0.315	S	S	*	.	H	α-helix	trans	-71.9	-37.4	-179	61.3	0	0	0	0	112.7	N204 A209	N204-T206 PolarHBondContact O-N 2.83Å; N204-T206 PolarHBondContact OD1-N 3.3Å; N204-T206 PolarHBondContact OD1-OG1 3.32Å; T206-A209 WeakPolarHBondContact O-CB 3.02Å
207	V	88.4	Confident	89.4	Confident	51 Å²	51	55.8 Å²	55.8	31%	0.309	30%	0.295	S	S	.	.	H	α-helix	trans	-77.2	-45.2	176.6	-177.3	0	0	0	0	109.5	D201 N204 A209 T210	D201-V207 HydrophobicContact CB-CG1 3.84Å; N204-V207 HydrophobicContact CB-CB 4.26Å; N204-V207 HydrophobicContact CB-CG2 4.12Å; N204-V207 PolarHBondContact O-N 2.97Å; V207-A209 PolarHBondContact O-N 2.93Å; V207-A209 VanDerWaalsContact O-N 3.17Å; V207-T210 PolarHBondContact O-N 2.92Å; V207-T210 PolarHBondContact O-OG1 3.17Å
208	A	88.6	Confident	89.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-53.9	-36.2	177	0	0	0	0	0	112.1	I186 D201 N204 T210 K211 V212	I186-A208 HydrophobicContact CD1-CB 3.9Å; D201-A208 PolarHBondContact O-N 2.66Å; N204-A208 VanDerWaalsContact O-CB 3.31Å; N204-A208 WeakPolarHBondContact O-CB 3.47Å; N204-A208 PolarHBondContact O-N 3.4Å; A208-T210 PolarHBondContact O-N 3.31Å; A208-K211 PolarHBondContact O-N 3.03Å; A208-V212 HydrophobicContact CB-CG1 4.3Å; A208-V212 VanDerWaalsContact O-CG2 3.24Å; A208-V212 WeakPolarHBondContact O-CG2 3.41Å; A208-V212 PolarHBondContact O-N 3.45Å
209	A	89.8	Confident	89.7	Confident	15 Å²	15	55.5 Å²	55.5	12%	0.124	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-28.6	175.8	0	0	0	0	0	114.2	Y172 L205 T206 V207 Q214	Y172-A209 HydrophobicContact CE1-CB 4.25Å; Y172-A209 HydrophobicContact CE2-CB 4.27Å; Y172-A209 VanDerWaalsContact OH-CB 3.3Å; Y172-A209 WeakPolarHBondContact OH-CB 3.43Å; L205-A209 PolarHBondContact O-N 3.08Å; T206-A209 WeakPolarHBondContact O-CB 3.02Å; V207-A209 PolarHBondContact O-N 2.93Å; V207-A209 VanDerWaalsContact O-N 3.17Å; A209-Q214 PolarHBondContact O-NE2 3.18Å
210	T	90.2	Very high	89.9	Confident	99 Å²	99	53.8 Å²	53.8	61%	0.607	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-12.9	179.5	66.9	0	0	0	0	113.9	V207 A208	V207-T210 PolarHBondContact O-N 2.92Å; V207-T210 PolarHBondContact O-OG1 3.17Å; A208-T210 PolarHBondContact O-N 3.31Å
211	K	91.6	Very high	89.9	Confident	48 Å²	48	48.7 Å²	48.7	21%	0.209	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-22.9	-172.5	-55.2	-59.2	-172.5	156.8	0	113.5	M192 D196 A208	M192-K211 PolarHBondContact N-O 2.92Å; D196-K211 WeakPolarHBondContact O-CD 3.24Å; D196-K211 IonicContact OD1-NZ 2.65Å; D196-K211 PolarHBondContact OD1-NZ 3.39Å; D196-K211 IonicContact OD2-NZ 2.61Å; D196-K211 PolarHBondContact OD2-NZ 3.3Å; A208-K211 PolarHBondContact O-N 3.03Å
212	V	93.6	Very high	89.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-107	153.3	-176.6	-51.5	0	0	0	0	112.4	Y172 I186 C190 M192 L202 A208 Q214	Y172-V212 HydrophobicContact CD1-CG2 4.3Å; Y172-V212 HydrophobicContact CD2-CG2 3.94Å; Y172-V212 HydrophobicContact CG-CG2 3.69Å; I186-V212 HydrophobicContact CG2-CG1 4.33Å; C190-V212 HydrophobicContact CB-CB 4.19Å; C190-V212 HydrophobicContact CB-CG1 4.31Å; C190-V212 WeakPolarHBondContact O-CA 3.5Å; M192-V212 WeakPolarHBondContact CE-O 3.2Å; L202-V212 HydrophobicContact CD2-CG1 3.52Å; A208-V212 HydrophobicContact CB-CG1 4.3Å; A208-V212 VanDerWaalsContact O-CG2 3.24Å; A208-V212 WeakPolarHBondContact O-CG2 3.41Å; A208-V212 PolarHBondContact O-N 3.45Å; V212-Q214 PolarHBondContact O-N 3.17Å
213	N	93	Very high	89.8	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.123	27%	0.267	C	S	.	.			trans	-60.3	119.2	175	-70.1	-67.2	0	0	0	110.9	S165 C167 C190	S165-N213 VanDerWaalsContact C-CG 3.42Å; S165-N213 WeakPolarHBondContact O-CB 3.42Å; S165-N213 VanDerWaalsContact O-CG 3.24Å; S165-N213 PolarHBondContact O-OD1 3.34Å; C167-N213 HydrophobicContact CB-CB 4.3Å; C167-N213 WeakPolarHBondContact CB-O 3.44Å; C190-N213 PolarHBondContact O-N 2.9Å; C190-N213 PolarHBondContact O-ND2 3.2Å
214	Q	91	Very high	89.6	Confident	106 Å²	106	52 Å²	52	50%	0.495	28%	0.276	S	S	.	.			trans	-78	-22.5	-175.4	-64.6	-158.6	-10.2	0	0	114.1	Y172 A209 V212	Y172-Q214 HydrophobicContact CD1-CG 4.39Å; Y172-Q214 HydrophobicContact CE1-CG 4.45Å; A209-Q214 PolarHBondContact O-NE2 3.18Å; V212-Q214 PolarHBondContact O-N 3.17Å
215	K	92.2	Very high	89.2	Confident	141 Å²	141	51.1 Å²	51.1	61%	0.613	27%	0.27	S	S	*	.	B	Isolated β-bridge	trans	-76.5	131.8	-179.2	-67	-173.1	179.2	-179.8	0	110.5	C166 C167 L220	C166-K215 CarbonylContact C-O 3.56Å; C166-K215 VanDerWaalsContact CA-O 3.3Å; C166-K215 WeakPolarHBondContact CA-O 3.29Å; C166-K215 WeakPolarHBondContact CB-O 3.44Å; C167-K215 PolarHBondContact N-O 3.28Å; K215-L220 HydrophobicContact CD-CD1 4.02Å
216	G	92.9	Very high	89.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.			trans	-65.2	146.3	169.3	0	0	0	0	0	112.9	V169 Q170 Y218 D219 L220	V169-G216 CarbonylContact O-C 3.56Å; V169-G216 VanDerWaalsContact O-C 3.29Å; V169-G216 VanDerWaalsContact O-CA 3.26Å; V169-G216 WeakPolarHBondContact O-CA 3.27Å; Q170-G216 WeakPolarHBondContact O-CA 3.49Å; Q170-G216 PolarHBondContact O-N 2.92Å; Q170-G216 VanDerWaalsContact O-N 3.09Å; G216-Y218 VanDerWaalsContact C-N 3.34Å; G216-D219 PolarHBondContact O-N 2.96Å; G216-L220 WeakPolarHBondContact O-CB 3.49Å; G216-L220 PolarHBondContact O-N 3.13Å
217	C	90.8	Very high	89.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.1	-34.4	178.1	-61.7	0	0	0	0	112.5	Y140 V160 C166 G168 V169 V221	Y140-C217 HydrophobicContact CE1-CB 3.84Å; Y140-C217 PolarHBondContact OH-SG 3.07Å; V160-C217 HydrophobicContact CG1-CB 4.31Å; C166-C217 HydrophobicContact CB-CB 3.94Å; C166-C217 WeakPolarHBondContact CB-SG 3.08Å; C166-C217 WeakPolarHBondContact SG-CA 3.36Å; C166-C217 WeakPolarHBondContact SG-CB 3.45Å; C166-C217 CovalentContact SG-SG 2.03Å; C166-C217 PolarHBondContact SG-SG 3.37Å; G168-C217 WeakPolarHBondContact O-CB 3.33Å; G168-C217 PolarHBondContact O-N 3.07Å; G168-C217 PolarHBondContact O-SG 3.25Å; V169-C217 PolarHBondContact O-N 3.21Å; C217-V221 WeakPolarHBondContact O-CB 3.26Å; C217-V221 WeakPolarHBondContact O-CG2 3.18Å; C217-V221 PolarHBondContact O-N 2.93Å
218	Y	89.6	Confident	88.9	Confident	33 Å²	33	54.2 Å²	54.2	13%	0.129	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-50	173.9	176.3	-101	0	0	0	111.5	K133 F136 L137 V169 Q170 G216 L220 V221 T222	K133-Y218 HydrophobicContact CB-CE2 4.3Å; K133-Y218 WeakPolarHBondContact O-CE2 3.49Å; F136-Y218 AromaticContact CD1-CD2 3.97Å; F136-Y218 HydrophobicContact CD1-CD2 3.97Å; L137-Y218 HydrophobicContact CB-CD2 3.76Å; L137-Y218 HydrophobicContact CB-CE2 3.61Å; L137-Y218 HydrophobicContact CD1-CD1 4.03Å; L137-Y218 HydrophobicContact CD1-CD2 3.73Å; L137-Y218 HydrophobicContact CD1-CE1 4.32Å; L137-Y218 HydrophobicContact CD1-CE2 4.1Å; L137-Y218 HydrophobicContact CD1-CG 3.7Å; L137-Y218 HydrophobicContact CG-CD2 4.31Å; L137-Y218 HydrophobicContact CG-CE2 4.29Å; V169-Y218 WeakPolarHBondContact O-CB 3.43Å; V169-Y218 PolarHBondContact O-N 3.46Å; Q170-Y218 HydrophobicContact CG-CD1 4.45Å; G216-Y218 VanDerWaalsContact C-N 3.34Å; Y218-L220 VanDerWaalsContact C-N 3.29Å; Y218-L220 PolarHBondContact O-N 3.27Å; Y218-V221 PolarHBondContact O-N 3.42Å; Y218-T222 HydrophobicContact CD1-CG2 4.29Å; Y218-T222 HydrophobicContact CD2-CG2 3.95Å; Y218-T222 HydrophobicContact CE1-CG2 3.9Å; Y218-T222 HydrophobicContact CE2-CG2 3.46Å; Y218-T222 VanDerWaalsContact CE2-CG2 3.46Å; Y218-T222 HydrophobicContact CG-CG2 4.32Å; Y218-T222 VanDerWaalsContact CZ-CG2 3.47Å; Y218-T222 WeakPolarHBondContact O-CB 3.41Å; Y218-T222 VanDerWaalsContact O-CG2 3.32Å; Y218-T222 WeakPolarHBondContact O-CG2 3.03Å; Y218-T222 PolarHBondContact O-N 2.92Å; Y218-T222 PolarHBondContact O-OG1 3.44Å
219	D	89.4	Confident	88.7	Confident	69 Å²	69	58 Å²	58	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-38.3	-178.2	-66.6	-23	0	0	0	111.4	G216 T222 S223	G216-D219 PolarHBondContact O-N 2.96Å; D219-T222 WeakPolarHBondContact CA-OG1 3.28Å; D219-T222 PolarHBondContact O-OG1 3.39Å; D219-S223 WeakPolarHBondContact O-CB 3.32Å; D219-S223 PolarHBondContact O-N 2.03Å
220	L	88.8	Confident	88.5	Confident	49 Å²	49	60.1 Å²	60.1	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-67.1	-45.7	177.1	-165.4	76.6	0	0	0	112	L164 C166 K215 G216 Y218 F224	L164-L220 HydrophobicContact CB-CD2 3.95Å; L164-L220 WeakPolarHBondContact O-CD2 2.94Å; C166-L220 HydrophobicContact CB-CD2 4.39Å; K215-L220 HydrophobicContact CD-CD1 4.02Å; G216-L220 WeakPolarHBondContact O-CB 3.49Å; G216-L220 PolarHBondContact O-N 3.13Å; Y218-L220 VanDerWaalsContact C-N 3.29Å; Y218-L220 PolarHBondContact O-N 3.27Å; L220-F224 WeakPolarHBondContact O-CB 3.23Å; L220-F224 PolarHBondContact O-N 3.39Å
221	V	86.3	Confident	88.4	Confident	36 Å²	36	60.5 Å²	60.5	22%	0.218	32%	0.32	C	S	.	.	H	α-helix	trans	-63.9	-45.4	178.4	170.1	0	0	0	0	110.7	F136 L164 C217 Y218 F224 M225	F136-V221 HydrophobicContact CD1-CG1 4.36Å; F136-V221 HydrophobicContact CE1-CB 4.06Å; F136-V221 HydrophobicContact CE1-CG1 4.22Å; F136-V221 HydrophobicContact CE1-CG2 3.99Å; F136-V221 HydrophobicContact CZ-CG2 4.09Å; L164-V221 HydrophobicContact CD1-CG2 3.61Å; C217-V221 WeakPolarHBondContact O-CB 3.26Å; C217-V221 WeakPolarHBondContact O-CG2 3.18Å; C217-V221 PolarHBondContact O-N 2.93Å; Y218-V221 PolarHBondContact O-N 3.42Å; V221-F224 PolarHBondContact O-N 3.15Å; V221-M225 HydrophobicContact CG1-SD 4.28Å; V221-M225 VanDerWaalsContact O-CG 3.29Å; V221-M225 WeakPolarHBondContact O-CG 3.2Å; V221-M225 PolarHBondContact O-N 3.06Å
222	T	86.6	Confident	88	Confident	15 Å²	15	62.2 Å²	62.2	9%	0.092	33%	0.331	C	S	.	.	H	α-helix	trans	-68.5	-42.8	-179.8	54.1	0	0	0	0	112.5	K133 Y218 D219 F224 M225 E226	K133-T222 HydrophobicContact CB-CG2 4.21Å; K133-T222 HydrophobicContact CD-CG2 3.84Å; K133-T222 HydrophobicContact CG-CG2 3.83Å; Y218-T222 HydrophobicContact CD1-CG2 4.29Å; Y218-T222 HydrophobicContact CD2-CG2 3.95Å; Y218-T222 HydrophobicContact CE1-CG2 3.9Å; Y218-T222 HydrophobicContact CE2-CG2 3.46Å; Y218-T222 VanDerWaalsContact CE2-CG2 3.46Å; Y218-T222 HydrophobicContact CG-CG2 4.32Å; Y218-T222 VanDerWaalsContact CZ-CG2 3.47Å; Y218-T222 WeakPolarHBondContact O-CB 3.41Å; Y218-T222 VanDerWaalsContact O-CG2 3.32Å; Y218-T222 WeakPolarHBondContact O-CG2 3.03Å; Y218-T222 PolarHBondContact O-N 2.92Å; Y218-T222 PolarHBondContact O-OG1 3.44Å; D219-T222 WeakPolarHBondContact CA-OG1 3.28Å; D219-T222 PolarHBondContact O-OG1 3.39Å; T222-F224 VanDerWaalsContact C-N 3.3Å; T222-F224 PolarHBondContact O-N 2.94Å; T222-M225 PolarHBondContact O-N 2.62Å; T222-E226 WeakPolarHBondContact O-CG 3.32Å; T222-E226 PolarHBondContact O-N 3.39Å
223	S	87.9	Confident	87.6	Confident	60 Å²	60	65 Å²	65	42%	0.42	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-39.5	173.9	-179.7	0	0	0	0	111.5	D219 E226 T227	D219-S223 WeakPolarHBondContact O-CB 3.32Å; D219-S223 PolarHBondContact O-N 2.03Å; S223-E226 PolarHBondContact O-N 3.15Å; S223-T227 WeakPolarHBondContact O-CB 3.42Å; S223-T227 PolarHBondContact O-N 3.09Å; S223-T227 PolarHBondContact O-OG1 3.46Å
224	F	84.4	Confident	87.4	Confident	116 Å²	116	66 Å²	66	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-47.2	173.8	179.7	-92.1	0	0	0	111.2	L220 V221 T222 E226 N228 I232	L220-F224 WeakPolarHBondContact O-CB 3.23Å; L220-F224 PolarHBondContact O-N 3.39Å; V221-F224 PolarHBondContact O-N 3.15Å; T222-F224 VanDerWaalsContact C-N 3.3Å; T222-F224 PolarHBondContact O-N 2.94Å; F224-E226 VanDerWaalsContact C-N 3.35Å; F224-E226 PolarHBondContact O-N 2.01Å; F224-N228 WeakPolarHBondContact CD2-ND2 3.38Å; F224-N228 HydrophobicContact CE2-CB 4.27Å; F224-N228 HydrophobicContact CZ-CB 4.31Å; F224-N228 VanDerWaalsContact O-CB 3.24Å; F224-N228 WeakPolarHBondContact O-CB 3.48Å; F224-N228 PolarHBondContact O-N 3.18Å; F224-N228 PolarHBondContact O-ND2 3.42Å; F224-I232 HydrophobicContact CE1-CD1 4.15Å
225	M	81.8	Confident	87.1	Confident	58 Å²	58	65.1 Å²	65.1	29%	0.286	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-40.5	178.2	-73.5	179.5	79.8	0	0	112.5	I132 K133 V221 T222 M229	I132-M225 HydrophobicContact CG2-CE 4.42Å; K133-M225 HydrophobicContact CG-SD 4.37Å; V221-M225 HydrophobicContact CG1-SD 4.28Å; V221-M225 VanDerWaalsContact O-CG 3.29Å; V221-M225 WeakPolarHBondContact O-CG 3.2Å; V221-M225 PolarHBondContact O-N 3.06Å; T222-M225 PolarHBondContact O-N 2.62Å; M225-M229 WeakPolarHBondContact O-CA 3.43Å; M225-M229 VanDerWaalsContact O-CB 3.28Å; M225-M229 WeakPolarHBondContact O-CB 3.43Å; M225-M229 PolarHBondContact O-N 2.88Å
226	E	86.2	Confident	86.7	Confident	122 Å²	122	61 Å²	61	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-75	-47.7	-179.1	-71.9	178.2	178.7	0	0	112.3	K133 T222 S223 F224	K133-E226 VanDerWaalsContact NZ-CG 3.26Å; K133-E226 IonicContact NZ-OE1 3.34Å; K133-E226 PolarHBondContact NZ-OE1 3.25Å; T222-E226 WeakPolarHBondContact O-CG 3.32Å; T222-E226 PolarHBondContact O-N 3.39Å; S223-E226 PolarHBondContact O-N 3.15Å; F224-E226 VanDerWaalsContact C-N 3.35Å; F224-E226 PolarHBondContact O-N 2.01Å
227	T	87.5	Confident	86.5	Confident	106 Å²	106	68.1 Å²	68.1	65%	0.65	39%	0.394	S	S	*	.	H	α-helix	trans	-72.7	-37.8	-174.9	-50.5	0	0	0	0	111.7	S223	S223-T227 WeakPolarHBondContact O-CB 3.42Å; S223-T227 PolarHBondContact O-N 3.09Å; S223-T227 PolarHBondContact O-OG1 3.46Å
228	N	85.6	Confident	86.3	Confident	42 Å²	42	69.6 Å²	69.6	23%	0.225	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	9.2	-176	-56.4	-81.4	0	0	0	113	F224 G230 I231 I232	F224-N228 WeakPolarHBondContact CD2-ND2 3.38Å; F224-N228 HydrophobicContact CE2-CB 4.27Å; F224-N228 HydrophobicContact CZ-CB 4.31Å; F224-N228 VanDerWaalsContact O-CB 3.24Å; F224-N228 WeakPolarHBondContact O-CB 3.48Å; F224-N228 PolarHBondContact O-N 3.18Å; F224-N228 PolarHBondContact O-ND2 3.42Å; N228-G230 PolarHBondContact O-N 3.33Å; N228-G230 VanDerWaalsContact O-N 3.13Å; N228-I231 HydrophobicContact CB-CD1 4.44Å; N228-I231 WeakPolarHBondContact O-CB 3.42Å; N228-I231 PolarHBondContact O-N 3.34Å; N228-I232 WeakPolarHBondContact O-CG1 3.48Å; N228-I232 PolarHBondContact O-N 3.18Å
229	M	84.1	Confident	86.1	Confident	80 Å²	80	71.1 Å²	71.1	39%	0.394	42%	0.419	S	S	.	.	H	α-helix	trans	-52.7	-38.6	179.5	-165.9	172	57.8	0	0	111.9	F126 M225 I232 A233	F126-M229 HydrophobicContact CD2-SD 4.47Å; F126-M229 HydrophobicContact CE2-SD 4.18Å; M225-M229 WeakPolarHBondContact O-CA 3.43Å; M225-M229 VanDerWaalsContact O-CB 3.28Å; M225-M229 WeakPolarHBondContact O-CB 3.43Å; M225-M229 PolarHBondContact O-N 2.88Å; M229-I232 PolarHBondContact O-N 3.28Å; M229-A233 VanDerWaalsContact O-CB 3.27Å; M229-A233 WeakPolarHBondContact O-CB 3.34Å; M229-A233 PolarHBondContact O-N 3.33Å
230	G	85.9	Confident	86	Confident	59 Å²	59	68.6 Å²	68.6	61%	0.608	41%	0.408	S	S	*	.	H	α-helix	trans	-64.8	-39.3	176.5	0	0	0	0	0	113.4	N228 G234	N228-G230 PolarHBondContact O-N 3.33Å; N228-G230 VanDerWaalsContact O-N 3.13Å; G230-G234 PolarHBondContact O-N 2.72Å
231	I	87	Confident	86	Confident	108 Å²	108	71.6 Å²	71.6	55%	0.554	42%	0.419	S	S	*	.	H	α-helix	trans	-67.3	-46.5	176.3	-59	178.1	0	0	0	109.7	N228 A233 G234 V235	N228-I231 HydrophobicContact CB-CD1 4.44Å; N228-I231 WeakPolarHBondContact O-CB 3.42Å; N228-I231 PolarHBondContact O-N 3.34Å; I231-A233 VanDerWaalsContact C-N 3.35Å; I231-A233 PolarHBondContact O-N 2.9Å; I231-G234 PolarHBondContact O-N 3.16Å; I231-V235 HydrophobicContact CG2-CG2 4.44Å; I231-V235 WeakPolarHBondContact O-CG2 3.37Å; I231-V235 PolarHBondContact O-N 3.23Å
232	I	82.5	Confident	85.8	Confident	84 Å²	84	70.2 Å²	70.2	43%	0.431	41%	0.411	S	S	.	.	H	α-helix	trans	-59.7	-47.2	178.6	-62.6	166.6	0	0	0	110.3	F224 N228 M229 G234 V235 A236	F224-I232 HydrophobicContact CE1-CD1 4.15Å; N228-I232 WeakPolarHBondContact O-CG1 3.48Å; N228-I232 PolarHBondContact O-N 3.18Å; M229-I232 PolarHBondContact O-N 3.28Å; I232-G234 VanDerWaalsContact C-N 3.35Å; I232-G234 PolarHBondContact O-N 3.36Å; I232-V235 PolarHBondContact O-N 3.12Å; I232-A236 WeakPolarHBondContact O-CB 3.03Å; I232-A236 PolarHBondContact O-N 3.15Å
233	A	86.7	Confident	85.8	Confident	57 Å²	57	70.2 Å²	70.2	47%	0.471	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-40.8	176.4	0	0	0	0	0	112.1	M229 I231 A236 F237	M229-A233 VanDerWaalsContact O-CB 3.27Å; M229-A233 WeakPolarHBondContact O-CB 3.34Å; M229-A233 PolarHBondContact O-N 3.33Å; I231-A233 VanDerWaalsContact C-N 3.35Å; I231-A233 PolarHBondContact O-N 2.9Å; A233-A236 PolarHBondContact O-N 3.07Å; A233-F237 WeakPolarHBondContact O-CB 3.45Å; A233-F237 PolarHBondContact O-N 2.61Å
234	G	88.3	Confident	85.8	Confident	44 Å²	44	70.8 Å²	70.8	45%	0.454	41%	0.408	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.4	0	0	0	0	0	112.8	G230 I231 I232 F237 G238	G230-G234 PolarHBondContact O-N 2.72Å; I231-G234 PolarHBondContact O-N 3.16Å; I232-G234 VanDerWaalsContact C-N 3.35Å; I232-G234 PolarHBondContact O-N 3.36Å; G234-F237 PolarHBondContact O-N 3.45Å; G234-G238 PolarHBondContact O-N 3.01Å
235	V	83.8	Confident	85.9	Confident	89 Å²	89	68.1 Å²	68.1	54%	0.539	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-47.8	174.4	172.6	0	0	0	0	110.4	I231 I232 F237 G238 I239	I231-V235 HydrophobicContact CG2-CG2 4.44Å; I231-V235 WeakPolarHBondContact O-CG2 3.37Å; I231-V235 PolarHBondContact O-N 3.23Å; I232-V235 PolarHBondContact O-N 3.12Å; V235-F237 VanDerWaalsContact C-N 3.34Å; V235-F237 PolarHBondContact O-N 3.27Å; V235-G238 PolarHBondContact O-N 3.16Å; V235-G238 VanDerWaalsContact O-N 3.15Å; V235-I239 HydrophobicContact CG1-CD1 3.99Å; V235-I239 WeakPolarHBondContact O-CG1 3.26Å; V235-I239 PolarHBondContact O-N 3.42Å
236	A	83.9	Confident	86	Confident	54 Å²	54	65.4 Å²	65.4	45%	0.446	39%	0.385	S	S	.	.	H	α-helix	trans	-59.9	-43.4	178	0	0	0	0	0	112.1	I232 A233 G238 I239 A240	I232-A236 WeakPolarHBondContact O-CB 3.03Å; I232-A236 PolarHBondContact O-N 3.15Å; A233-A236 PolarHBondContact O-N 3.07Å; A236-G238 VanDerWaalsContact C-N 3.34Å; A236-G238 PolarHBondContact O-N 3.18Å; A236-I239 PolarHBondContact O-N 3.46Å; A236-A240 WeakPolarHBondContact O-CB 3.18Å; A236-A240 PolarHBondContact O-N 3.49Å
237	F	90	Very high	86	Confident	149 Å²	149	60.8 Å²	60.8	65%	0.654	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-40.4	175.1	-176	-95.8	0	0	0	112.1	A233 G234 V235 I239 A240 F241	A233-F237 WeakPolarHBondContact O-CB 3.45Å; A233-F237 PolarHBondContact O-N 2.61Å; G234-F237 PolarHBondContact O-N 3.45Å; V235-F237 VanDerWaalsContact C-N 3.34Å; V235-F237 PolarHBondContact O-N 3.27Å; F237-I239 VanDerWaalsContact C-N 3.32Å; F237-I239 PolarHBondContact O-N 3.46Å; F237-A240 PolarHBondContact O-N 3.29Å; F237-F241 VanDerWaalsContact O-CB 3.27Å; F237-F241 WeakPolarHBondContact O-CB 3.4Å; F237-F241 PolarHBondContact O-N 3.07Å
238	G	87.2	Confident	86	Confident	32 Å²	32	61.4 Å²	61.4	33%	0.33	36%	0.363	S	S	.	.	H	α-helix	trans	-60.7	-40.3	175	0	0	0	0	0	112.8	G234 V235 A236 S242	G234-G238 PolarHBondContact O-N 3.01Å; V235-G238 PolarHBondContact O-N 3.16Å; V235-G238 VanDerWaalsContact O-N 3.15Å; A236-G238 VanDerWaalsContact C-N 3.34Å; A236-G238 PolarHBondContact O-N 3.18Å; G238-S242 VanDerWaalsContact O-CB 3.3Å; G238-S242 WeakPolarHBondContact O-CB 3.02Å; G238-S242 PolarHBondContact O-N 3.06Å; G238-S242 PolarHBondContact O-OG 3.45Å
239	I	83.7	Confident	85.9	Confident	65 Å²	65	60.9 Å²	60.9	33%	0.333	36%	0.36	S	S	.	.	H	α-helix	trans	-66.4	-47.1	174.8	-63.5	166.2	0	0	0	110.6	E118 V235 A236 F237 F241 S242 Q243	E118-I239 WeakPolarHBondContact OE1-CG2 3.09Å; E118-I239 WeakPolarHBondContact OE2-CG2 3.43Å; V235-I239 HydrophobicContact CG1-CD1 3.99Å; V235-I239 WeakPolarHBondContact O-CG1 3.26Å; V235-I239 PolarHBondContact O-N 3.42Å; A236-I239 PolarHBondContact O-N 3.46Å; F237-I239 VanDerWaalsContact C-N 3.32Å; F237-I239 PolarHBondContact O-N 3.46Å; I239-F241 VanDerWaalsContact C-N 3.34Å; I239-F241 PolarHBondContact O-N 3.06Å; I239-S242 PolarHBondContact O-N 3.02Å; I239-S242 PolarHBondContact O-OG 2.86Å; I239-Q243 WeakPolarHBondContact O-CG 3.43Å; I239-Q243 PolarHBondContact O-N 2.83Å
240	A	87.3	Confident	85.8	Confident	16 Å²	16	57.1 Å²	57.1	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-43.7	178.4	0	0	0	0	0	111.8	F115 A236 F237 S242 Q243 L244	F115-A240 HydrophobicContact CD2-CB 4.26Å; F115-A240 HydrophobicContact CE2-CB 3.93Å; A236-A240 WeakPolarHBondContact O-CB 3.18Å; A236-A240 PolarHBondContact O-N 3.49Å; F237-A240 PolarHBondContact O-N 3.29Å; A240-S242 VanDerWaalsContact C-N 3.35Å; A240-S242 PolarHBondContact O-N 3.48Å; A240-Q243 PolarHBondContact O-N 2.86Å; A240-L244 WeakPolarHBondContact O-CG 3.48Å; A240-L244 PolarHBondContact O-N 3.21Å
241	F	89	Confident	85.8	Confident	112 Å²	112	57.2 Å²	57.2	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-39.2	177.1	-177.8	-105.2	0	0	0	112.2	F237 I239 L244 I245	F237-F241 VanDerWaalsContact O-CB 3.27Å; F237-F241 WeakPolarHBondContact O-CB 3.4Å; F237-F241 PolarHBondContact O-N 3.07Å; I239-F241 VanDerWaalsContact C-N 3.34Å; I239-F241 PolarHBondContact O-N 3.06Å; F241-L244 WeakPolarHBondContact O-CB 3.46Å; F241-L244 PolarHBondContact O-N 2.94Å; F241-I245 HydrophobicContact CD1-CD1 3.93Å; F241-I245 HydrophobicContact CE1-CD1 3.46Å; F241-I245 VanDerWaalsContact CE1-CD1 3.46Å; F241-I245 HydrophobicContact CE1-CG1 4.31Å; F241-I245 HydrophobicContact CZ-CD1 4Å; F241-I245 HydrophobicContact CZ-CG1 4.49Å; F241-I245 PolarHBondContact O-N 3.37Å
242	S	82.6	Confident	85.7	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-43.7	177.9	77.3	0	0	0	0	111.6	Y22 F26 G238 I239 A240 L244 I245 G246	Y22-S242 WeakPolarHBondContact CE2-O 3.21Å; Y22-S242 VanDerWaalsContact CZ-O 3.26Å; Y22-S242 WeakPolarHBondContact OH-CA 3.4Å; Y22-S242 WeakPolarHBondContact OH-CB 3.3Å; Y22-S242 PolarHBondContact OH-O 2.82Å; Y22-S242 PolarHBondContact OH-OG 3.15Å; Y22-S242 VanDerWaalsContact OH-OG 3.11Å; F26-S242 WeakPolarHBondContact CE1-OG 3.24Å; F26-S242 VanDerWaalsContact CE2-CB 3.48Å; F26-S242 WeakPolarHBondContact CZ-OG 3.22Å; G238-S242 VanDerWaalsContact O-CB 3.3Å; G238-S242 WeakPolarHBondContact O-CB 3.02Å; G238-S242 PolarHBondContact O-N 3.06Å; G238-S242 PolarHBondContact O-OG 3.45Å; I239-S242 PolarHBondContact O-N 3.02Å; I239-S242 PolarHBondContact O-OG 2.86Å; A240-S242 VanDerWaalsContact C-N 3.35Å; A240-S242 PolarHBondContact O-N 3.48Å; S242-L244 VanDerWaalsContact C-N 3.26Å; S242-L244 PolarHBondContact O-N 2.9Å; S242-I245 WeakPolarHBondContact O-CA 3.01Å; S242-I245 WeakPolarHBondContact O-CB 3.28Å; S242-I245 PolarHBondContact O-N 2.87Å; S242-G246 PolarHBondContact O-N 3.45Å
243	Q	85.8	Confident	85.5	Confident	16 Å²	16	51.6 Å²	51.6	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-56.9	-39.7	175.2	-71.1	173.8	4.8	0	0	112.5	Y22 E118 I239 A240 I245 G246 M247	Y22-Q243 PolarHBondContact OH-N 2.88Å; E118-Q243 PolarHBondContact OE1-NE2 2.64Å; E118-Q243 PolarHBondContact OE2-NE2 3.31Å; E118-Q243 VanDerWaalsContact OE2-NE2 3.07Å; E118-Q243 PolarHBondContact OE2-OE1 2.94Å; I239-Q243 WeakPolarHBondContact O-CG 3.43Å; I239-Q243 PolarHBondContact O-N 2.83Å; A240-Q243 PolarHBondContact O-N 2.86Å; Q243-I245 PolarHBondContact O-N 3.15Å; Q243-G246 PolarHBondContact O-N 3.45Å; Q243-M247 HydrophobicContact CB-CE 4.44Å; Q243-M247 WeakPolarHBondContact O-CG 3.02Å; Q243-M247 PolarHBondContact O-N 3.32Å
244	L	89.3	Confident	85.3	Confident	71 Å²	71	49 Å²	49	37%	0.372	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-45.6	173.5	-68.5	170.7	0	0	0	111.9	F115 A240 F241 S242 G246 M247 L248	F115-L244 HydrophobicContact CD2-CG 4.49Å; F115-L244 HydrophobicContact CE2-CD1 4.22Å; F115-L244 HydrophobicContact CE2-CD2 4.13Å; F115-L244 HydrophobicContact CE2-CG 4.01Å; F115-L244 HydrophobicContact CZ-CD1 4.44Å; F115-L244 HydrophobicContact CZ-CD2 4.14Å; F115-L244 HydrophobicContact CZ-CG 4.42Å; A240-L244 WeakPolarHBondContact O-CG 3.48Å; A240-L244 PolarHBondContact O-N 3.21Å; F241-L244 WeakPolarHBondContact O-CB 3.46Å; F241-L244 PolarHBondContact O-N 2.94Å; S242-L244 VanDerWaalsContact C-N 3.26Å; S242-L244 PolarHBondContact O-N 2.9Å; L244-G246 PolarHBondContact O-N 3.04Å; L244-M247 HydrophobicContact CD2-CE 3.78Å; L244-M247 HydrophobicContact CG-CE 4.39Å; L244-M247 PolarHBondContact O-N 3.28Å; L244-L248 VanDerWaalsContact O-CG 3.27Å; L244-L248 WeakPolarHBondContact O-CG 3.09Å; L244-L248 PolarHBondContact O-N 3.31Å
245	I	86.3	Confident	85.1	Confident	61 Å²	61	56.5 Å²	56.5	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-45.6	175.4	-64.8	170.6	0	0	0	110.8	Y22 F241 S242 Q243 M247 L248 L249	Y22-I245 HydrophobicContact CD2-CG2 4.21Å; Y22-I245 HydrophobicContact CE2-CB 4.31Å; Y22-I245 HydrophobicContact CE2-CG2 4.35Å; F241-I245 HydrophobicContact CD1-CD1 3.93Å; F241-I245 HydrophobicContact CE1-CD1 3.46Å; F241-I245 VanDerWaalsContact CE1-CD1 3.46Å; F241-I245 HydrophobicContact CE1-CG1 4.31Å; F241-I245 HydrophobicContact CZ-CD1 4Å; F241-I245 HydrophobicContact CZ-CG1 4.49Å; F241-I245 PolarHBondContact O-N 3.37Å; S242-I245 WeakPolarHBondContact O-CA 3.01Å; S242-I245 WeakPolarHBondContact O-CB 3.28Å; S242-I245 PolarHBondContact O-N 2.87Å; Q243-I245 PolarHBondContact O-N 3.15Å; I245-M247 VanDerWaalsContact C-N 3.34Å; I245-M247 PolarHBondContact O-N 3.06Å; I245-L248 PolarHBondContact O-N 3.07Å; I245-L249 HydrophobicContact CG2-CD1 3.93Å; I245-L249 HydrophobicContact CG2-CG 4.3Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.18Å
246	G	82.9	Confident	84.9	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-43.6	177.6	0	0	0	0	0	112.8	S242 Q243 L244 A250	S242-G246 PolarHBondContact O-N 3.45Å; Q243-G246 PolarHBondContact O-N 3.45Å; L244-G246 PolarHBondContact O-N 3.04Å; G246-A250 WeakPolarHBondContact O-CB 2.93Å; G246-A250 PolarHBondContact O-N 2.8Å
247	M	87.2	Confident	84.5	Confident	25 Å²	25	53.8 Å²	53.8	12%	0.123	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-45.7	175.2	-75.6	-173.5	-80.3	0	0	112.1	L111 S112 F115 Q243 L244 I245 L249 A250 C251	L111-M247 HydrophobicContact CB-CG 3.51Å; L111-M247 HydrophobicContact CB-SD 4.16Å; L111-M247 HydrophobicContact CD1-CG 4.1Å; L111-M247 HydrophobicContact CG-CG 4.49Å; S112-M247 WeakPolarHBondContact CA-SD 3.34Å; S112-M247 PolarHBondContact N-SD 2.89Å; S112-M247 VanDerWaalsContact N-SD 3.42Å; F115-M247 HydrophobicContact CB-CE 4.13Å; F115-M247 HydrophobicContact CG-CE 4.25Å; Q243-M247 HydrophobicContact CB-CE 4.44Å; Q243-M247 WeakPolarHBondContact O-CG 3.02Å; Q243-M247 PolarHBondContact O-N 3.32Å; L244-M247 HydrophobicContact CD2-CE 3.78Å; L244-M247 HydrophobicContact CG-CE 4.39Å; L244-M247 PolarHBondContact O-N 3.28Å; I245-M247 VanDerWaalsContact C-N 3.34Å; I245-M247 PolarHBondContact O-N 3.06Å; M247-L249 PolarHBondContact O-N 2.03Å; M247-A250 PolarHBondContact O-N 3.46Å; M247-C251 VanDerWaalsContact O-CB 3.31Å; M247-C251 WeakPolarHBondContact O-CB 3.35Å; M247-C251 PolarHBondContact O-N 2.91Å; M247-C251 PolarHBondContact O-SG 3.23Å
248	L	87.4	Confident	84	Confident	119 Å²	119	48.2 Å²	48.2	62%	0.623	25%	0.251	S	S	*	.	H	α-helix	trans	-59.7	-48	177.8	-71.7	172.5	0	0	0	111.3	L244 I245 A250 C251 C252	L244-L248 VanDerWaalsContact O-CG 3.27Å; L244-L248 WeakPolarHBondContact O-CG 3.09Å; L244-L248 PolarHBondContact O-N 3.31Å; I245-L248 PolarHBondContact O-N 3.07Å; L248-A250 PolarHBondContact O-N 3.42Å; L248-C251 PolarHBondContact O-N 3.06Å; L248-C252 VanDerWaalsContact O-CB 3.31Å; L248-C252 WeakPolarHBondContact O-CB 3.3Å; L248-C252 PolarHBondContact O-N 3.42Å; L248-C252 PolarHBondContact O-SG 3.12Å
249	L	83.2	Confident	83.5	Confident	31 Å²	31	49.3 Å²	49.3	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-44	178.3	-69.2	174.5	0	0	0	111.9	L15 L19 I245 M247 C252 L253	L15-L249 HydrophobicContact CD2-CD2 3.95Å; L19-L249 HydrophobicContact CB-CD1 4.47Å; L19-L249 HydrophobicContact CD1-CB 3.94Å; L19-L249 HydrophobicContact CG-CB 4.45Å; I245-L249 HydrophobicContact CG2-CD1 3.93Å; I245-L249 HydrophobicContact CG2-CG 4.3Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.18Å; M247-L249 PolarHBondContact O-N 2.03Å; L249-C252 PolarHBondContact O-N 3.38Å; L249-L253 VanDerWaalsContact O-CB 3.23Å; L249-L253 WeakPolarHBondContact O-CB 3.45Å; L249-L253 PolarHBondContact O-N 2.86Å
250	A	82.5	Confident	82.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-43.6	178	0	0	0	0	0	112.3	L19 Y107 A108 G246 M247 L248 S254	L19-A250 HydrophobicContact CD1-CB 4.41Å; Y107-A250 HydrophobicContact CD1-CB 3.9Å; Y107-A250 HydrophobicContact CE1-CB 4.38Å; A108-A250 HydrophobicContact CB-CB 4.07Å; G246-A250 WeakPolarHBondContact O-CB 2.93Å; G246-A250 PolarHBondContact O-N 2.8Å; M247-A250 PolarHBondContact O-N 3.46Å; L248-A250 PolarHBondContact O-N 3.42Å; A250-S254 WeakPolarHBondContact O-CB 3.34Å; A250-S254 PolarHBondContact O-N 3.02Å
251	C	84.8	Confident	82	Confident	62 Å²	62	52.6 Å²	52.6	42%	0.419	27%	0.27	S	S	.	.	H	α-helix	trans	-64.7	-47.2	176.6	-75.6	0	0	0	0	111.8	M247 L248 L253 S254 R255	M247-C251 VanDerWaalsContact O-CB 3.31Å; M247-C251 WeakPolarHBondContact O-CB 3.35Å; M247-C251 PolarHBondContact O-N 2.91Å; M247-C251 PolarHBondContact O-SG 3.23Å; L248-C251 PolarHBondContact O-N 3.06Å; C251-L253 PolarHBondContact O-N 2.71Å; C251-S254 PolarHBondContact O-N 2.62Å; C251-R255 WeakPolarHBondContact O-CG 3.32Å; C251-R255 PolarHBondContact O-N 2.94Å
252	C	84.6	Confident	80.6	Confident	68 Å²	68	55.6 Å²	55.6	46%	0.459	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-48.2	176.1	-74.1	0	0	0	0	111.3	L248 L249 S254 R255 F256	L248-C252 VanDerWaalsContact O-CB 3.31Å; L248-C252 WeakPolarHBondContact O-CB 3.3Å; L248-C252 PolarHBondContact O-N 3.42Å; L248-C252 PolarHBondContact O-SG 3.12Å; L249-C252 PolarHBondContact O-N 3.38Å; C252-S254 PolarHBondContact O-N 2.98Å; C252-R255 PolarHBondContact O-N 3.17Å; C252-F256 WeakPolarHBondContact O-CB 3.45Å; C252-F256 PolarHBondContact O-N 3.02Å
253	L	79.6	Confident	79.4	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-41.4	178.6	-175.8	62.9	0	0	0	111.9	I12 L15 K16 L104 L249 C251 F256 I257	I12-L253 HydrophobicContact CG2-CD1 4.08Å; L15-L253 HydrophobicContact CB-CD1 4.1Å; K16-L253 HydrophobicContact CG-CD1 4.09Å; K16-L253 HydrophobicContact CG-CD2 3.74Å; L104-L253 HydrophobicContact CD1-CB 4.25Å; L104-L253 HydrophobicContact CD1-CD2 3.8Å; L104-L253 HydrophobicContact CD1-CG 3.7Å; L104-L253 HydrophobicContact CD2-CD2 3.88Å; L249-L253 VanDerWaalsContact O-CB 3.23Å; L249-L253 WeakPolarHBondContact O-CB 3.45Å; L249-L253 PolarHBondContact O-N 2.86Å; C251-L253 PolarHBondContact O-N 2.71Å; L253-F256 PolarHBondContact O-N 3.17Å; L253-I257 HydrophobicContact CD1-CD1 4Å; L253-I257 HydrophobicContact CD1-CG1 4.38Å; L253-I257 HydrophobicContact CG-CD1 3.9Å; L253-I257 VanDerWaalsContact O-CG1 3.3Å; L253-I257 WeakPolarHBondContact O-CG1 3.4Å; L253-I257 PolarHBondContact O-N 3.06Å
254	S	82.1	Confident	77.7	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-63.5	-45.7	176.6	-177.2	0	0	0	0	112.1	P101 K105 A250 C251 C252 F256 I257 T258	P101-S254 PolarHBondContact O-OG 3.27Å; K105-S254 WeakPolarHBondContact CG-OG 3.3Å; A250-S254 WeakPolarHBondContact O-CB 3.34Å; A250-S254 PolarHBondContact O-N 3.02Å; C251-S254 PolarHBondContact O-N 2.62Å; C252-S254 PolarHBondContact O-N 2.98Å; S254-F256 VanDerWaalsContact C-N 3.32Å; S254-F256 PolarHBondContact O-N 3.07Å; S254-I257 PolarHBondContact O-N 2.82Å; S254-T258 VanDerWaalsContact O-CB 3.29Å; S254-T258 WeakPolarHBondContact O-CB 3.44Å; S254-T258 PolarHBondContact O-N 3.47Å; S254-T258 PolarHBondContact O-OG1 2.88Å
255	R	82.9	Confident	75.8	Confident	202 Å²	202	70 Å²	70	76%	0.762	36%	0.358	S	S	*	.	H	α-helix	trans	-59.8	-43.5	176.7	-72.3	-176.5	77.2	177.3	4.5	111.4	C251 C252 T258 A259	C251-R255 WeakPolarHBondContact O-CG 3.32Å; C251-R255 PolarHBondContact O-N 2.94Å; C252-R255 PolarHBondContact O-N 3.17Å; R255-T258 PolarHBondContact O-N 3.05Å; R255-A259 WeakPolarHBondContact O-CB 3.24Å; R255-A259 PolarHBondContact O-N 2.88Å
256	F	79.6	Confident	75.2	Confident	64 Å²	64	70.5 Å²	70.5	28%	0.281	36%	0.36	S	S	.	.	H	α-helix	trans	-68.2	-41.2	-177.9	-152.2	-92.2	0	0	0	112.7	T8 V11 I12 C252 L253 S254 N260	T8-F256 VanDerWaalsContact CB-CE1 3.47Å; T8-F256 HydrophobicContact CG2-CE1 3.61Å; T8-F256 HydrophobicContact CG2-CZ 3.52Å; V11-F256 HydrophobicContact CB-CE1 4.3Å; V11-F256 HydrophobicContact CB-CZ 4.01Å; V11-F256 HydrophobicContact CG1-CE1 4.29Å; V11-F256 HydrophobicContact CG1-CE2 4.16Å; V11-F256 HydrophobicContact CG1-CZ 3.83Å; I12-F256 HydrophobicContact CD1-CD1 3.78Å; I12-F256 HydrophobicContact CD1-CE1 3.99Å; I12-F256 HydrophobicContact CG1-CD1 3.4Å; I12-F256 HydrophobicContact CG1-CE1 3.65Å; C252-F256 WeakPolarHBondContact O-CB 3.45Å; C252-F256 PolarHBondContact O-N 3.02Å; L253-F256 PolarHBondContact O-N 3.17Å; S254-F256 VanDerWaalsContact C-N 3.32Å; S254-F256 PolarHBondContact O-N 3.07Å; F256-N260 PolarHBondContact O-N 3.09Å; F256-N260 PolarHBondContact O-ND2 3.04Å
257	I	77.4	Confident	74.8	Confident	21 Å²	21	74.2 Å²	74.2	11%	0.108	38%	0.378	C	S	.	.	H	α-helix	trans	-65.8	-41.4	174.5	-68.2	168.2	0	0	0	110.8	P101 L104 L253 S254 N260 Q261	P101-I257 HydrophobicContact CB-CB 4.44Å; P101-I257 HydrophobicContact CB-CG2 4.06Å; P101-I257 HydrophobicContact CG-CG2 4.06Å; L104-I257 HydrophobicContact CD1-CD1 3.62Å; L253-I257 HydrophobicContact CD1-CD1 4Å; L253-I257 HydrophobicContact CD1-CG1 4.38Å; L253-I257 HydrophobicContact CG-CD1 3.9Å; L253-I257 VanDerWaalsContact O-CG1 3.3Å; L253-I257 WeakPolarHBondContact O-CG1 3.4Å; L253-I257 PolarHBondContact O-N 3.06Å; S254-I257 PolarHBondContact O-N 2.82Å; I257-N260 PolarHBondContact O-N 3.27Å; I257-Q261 VanDerWaalsContact O-CG 3.23Å; I257-Q261 WeakPolarHBondContact O-CG 3.18Å; I257-Q261 PolarHBondContact O-N 3Å
258	T	78.8	Confident	74.2	Confident	32 Å²	32	76.9 Å²	76.9	20%	0.196	39%	0.392	C	S	.	.	H	α-helix	trans	-64.3	-46.2	179.5	-56.6	0	0	0	0	111.5	P101 S254 R255 N260 Q261 Y262	P101-T258 VanDerWaalsContact CB-OG1 3.3Å; P101-T258 WeakPolarHBondContact CB-OG1 3.31Å; S254-T258 VanDerWaalsContact O-CB 3.29Å; S254-T258 WeakPolarHBondContact O-CB 3.44Å; S254-T258 PolarHBondContact O-N 3.47Å; S254-T258 PolarHBondContact O-OG1 2.88Å; R255-T258 PolarHBondContact O-N 3.05Å; T258-N260 VanDerWaalsContact C-N 3.31Å; T258-N260 PolarHBondContact O-N 3.17Å; T258-Q261 PolarHBondContact O-N 2.75Å; T258-Q261 VanDerWaalsContact O-N 3.09Å; T258-Y262 HydrophobicContact CG2-CD2 3.96Å; T258-Y262 HydrophobicContact CG2-CE2 3.47Å; T258-Y262 VanDerWaalsContact CG2-CE2 3.47Å; T258-Y262 WeakPolarHBondContact O-CD2 3.3Å; T258-Y262 PolarHBondContact O-N 3.2Å
259	A	77.2	Confident	73.4	Confident	55 Å²	55	74.4 Å²	74.4	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-59.1	-41.6	178	0	0	0	0	0	112.2	R255 Q261 Y262 E263	R255-A259 WeakPolarHBondContact O-CB 3.24Å; R255-A259 PolarHBondContact O-N 2.88Å; A259-Q261 VanDerWaalsContact C-N 3.27Å; A259-Q261 PolarHBondContact O-N 2.98Å; A259-Y262 PolarHBondContact O-N 2.81Å; A259-E263 PolarHBondContact O-N 3.07Å
260	N	69.6	Low	72.8	Confident	41 Å²	41	77.1 Å²	77.1	22%	0.219	39%	0.392	C	S	.	.	H	α-helix	trans	-70.5	-18	177.5	-72.4	-24.8	0	0	0	114.2	F256 I257 T258 M264	F256-N260 PolarHBondContact O-N 3.09Å; F256-N260 PolarHBondContact O-ND2 3.04Å; I257-N260 PolarHBondContact O-N 3.27Å; T258-N260 VanDerWaalsContact C-N 3.31Å; T258-N260 PolarHBondContact O-N 3.17Å; N260-M264 WeakPolarHBondContact O-CG 3.48Å
261	Q	68.5	Low	72.1	Confident	109 Å²	109	82.3 Å²	82.3	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-79.8	-35.3	174.6	-65.7	-114.6	-73.7	0	0	111.7	I257 T258 A259 M264	I257-Q261 VanDerWaalsContact O-CG 3.23Å; I257-Q261 WeakPolarHBondContact O-CG 3.18Å; I257-Q261 PolarHBondContact O-N 3Å; T258-Q261 PolarHBondContact O-N 2.75Å; T258-Q261 VanDerWaalsContact O-N 3.09Å; A259-Q261 VanDerWaalsContact C-N 3.27Å; A259-Q261 PolarHBondContact O-N 2.98Å; Q261-M264 PolarHBondContact O-N 2.66Å
262	Y	59.8	Low	71.2	Confident	175 Å²	175	83.7 Å²	83.7	69%	0.686	42%	0.419	S	S	*	.	H	α-helix	trans	-73.8	-27.9	178.1	-73.2	-71.5	0	0	0	113.5	T258 A259 M264	T258-Y262 HydrophobicContact CG2-CD2 3.96Å; T258-Y262 HydrophobicContact CG2-CE2 3.47Å; T258-Y262 VanDerWaalsContact CG2-CE2 3.47Å; T258-Y262 WeakPolarHBondContact O-CD2 3.3Å; T258-Y262 PolarHBondContact O-N 3.2Å; A259-Y262 PolarHBondContact O-N 2.81Å; Y262-M264 PolarHBondContact O-N 2.65Å
263	E	58.3	Low	70.2	Confident	105 Å²	105	84.9 Å²	84.9	49%	0.491	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-1.4	173.1	-72	-168.1	163.4	0	0	113.9	R4 A259	R4-E263 IonicContact NH1-OE1 2.71Å; A259-E263 PolarHBondContact O-N 3.07Å
264	M	50.6	Low	69.4	Low	107 Å²	107	91.5 Å²	91.5	53%	0.527	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	6.5	-179.7	-61.1	-160.7	-52.3	0	0	114.5	R5 N260 Q261 Y262	R5-M264 PolarHBondContact NH2-SD 3.06Å; N260-M264 WeakPolarHBondContact O-CG 3.48Å; Q261-M264 PolarHBondContact O-N 2.66Å; Y262-M264 PolarHBondContact O-N 2.65Å
265	V	48.1	Very low	68.2	Low	185 Å²	185	99.6 Å²	99.6	100%	1.121	49%	0.487	S	S	*	.			trans	-112.5	0	169.4	-176.3	0	0	0	0	107.9

Retrieved 265 of 265 residues in 58.5 ms (Link to these results)

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