A0A077YWN3_TRITR Loading...

Protein FAM40B

AlphaFold DB , UniProt , Accession A0A077YWN3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 830 aa.

						>A0A077YWN3_TRITR|A0A077YWN3
MLFDECLLALKAEQSAASEAEIEFEYDDCDELAHELNEMYSYSESLEFFENYQAFHDFCSCRRFSGWQQSARPQRCCLVEAMLDQLESSVADVRLKALQALAYILQGCFMDHDTEEALLESISSNAFLCYDCGAWSLLCMVLQMEIDQSWDIACSLPPRSLRVFSGSKVTSDSLKDSHVLRLTLACMYTIVECVRRFECNKERSDNSDDTLSEEDVLRTEVKRSLLNELDDATSSLNVVPVLFDMLSRFCAGLVPHYPIRKVLLLLWKCLLAVLGGWRALHNLKNDKRQAFGLQPCEDTIEIASTMQPISNLTFKLSCDREPGGDNNNNGNGEFPVDVSMIVADLVSDDGALTDASDQRPSSPFPKENKPSNVQAVKDACKNANQQQKRLPWSSKVTFKAVENFLEMKRMKFFGYSFGEGDRVTTVGLPKPIQESYNAQVRHVYVSLSEMQIARERLIQMYPMTHKDDVESDGPSERLYQMILPNMRKLTFGLVKVLLASAPCSKGKADMVNIVYEVLPYSDDVESATSLVDTPEALRLNADVIRQKEIIAKCVSAMLLLILKHLKVNHIYQFEQICQQLVFANCIPLILKYFDQNVSYDTGESATGRPYVWRNLFSLVNLLRILNKLTKWKHGRTMMLVVYKSAPILKRTLRVKQALLQLFALKLLKSQAKYLGRQWRRSNMELLSAIYRNRVPSIDSEDFKAGILKLSVCRFSHFSLSAQFVFLFRIASRLSSLGCFEHFSMLLSHCFFIFAFIFFFFLSSFFLSFLCSIYIAVLSISVCSNYFFFFFPGYCISSVECATIIPRHNICPNLTYVHSLIAVVCHIVSDI
					

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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	45.1	Very low	58	Low	186 Å²	186	114.4 Å²	114.4	92%	0.916	59%	0.59	S	S	*	*				0	-85.8	0	-66.3	-121.6	-60.8	0	0	111.1	F3 D4 E5	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 3.27Å; M1-D4 PolarHBondContact N-OD2 3Å; M1-D4 PolarHBondContact O-N 3.35Å; M1-E5 PolarHBondContact O-N 3.23Å
2	L	50.6	Low	57.4	Low	140 Å²	140	109.8 Å²	109.8	73%	0.733	58%	0.582	S	S	*	*	H	α-helix	trans	-57.7	-37.9	177.8	-84	159.2	0	0	0	113.3	E5 C6	L2-E5 PolarHBondContact O-N 3.34Å; L2-C6 PolarHBondContact O-N 3.46Å; L2-C6 VanDerWaalsContact O-N 3.08Å
3	F	53.7	Low	56.7	Low	161 Å²	161	111.8 Å²	111.8	71%	0.706	59%	0.586	S	S	*	*	H	α-helix	trans	-67.3	-34.5	175.7	-162.4	-94.2	0	0	0	113	M1 L7	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 3.27Å; F3-L7 HydrophobicContact CE1-CD1 4.21Å; F3-L7 WeakPolarHBondContact O-CB 3.35Å; F3-L7 PolarHBondContact O-N 3.36Å; F3-L7 VanDerWaalsContact O-N 3.08Å
4	D	66.8	Low	55.7	Low	98 Å²	98	113.1 Å²	113.1	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-74.1	-36.1	177.8	-61.3	-59.9	0	0	0	111.6	M1 L7 L8	M1-D4 PolarHBondContact N-OD2 3Å; M1-D4 PolarHBondContact O-N 3.35Å; D4-L7 PolarHBondContact O-N 3.32Å; D4-L8 WeakPolarHBondContact O-CB 3.43Å; D4-L8 WeakPolarHBondContact O-CG 3.45Å; D4-L8 PolarHBondContact O-N 2.98Å
5	E	67.5	Low	55.1	Low	133 Å²	133	109.4 Å²	109.4	62%	0.621	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-44.1	173.7	-79.6	-176.1	157.9	0	0	111.6	M1 L2 L7 L8 A9	M1-E5 PolarHBondContact O-N 3.23Å; L2-E5 PolarHBondContact O-N 3.34Å; E5-L7 VanDerWaalsContact C-N 3.32Å; E5-L7 PolarHBondContact O-N 3.3Å; E5-L8 PolarHBondContact O-N 2.99Å; E5-A9 WeakPolarHBondContact O-CB 3.39Å; E5-A9 PolarHBondContact O-N 3.46Å
6	C	53.3	Low	54.5	Low	78 Å²	78	106.2 Å²	106.2	53%	0.527	57%	0.569	S	S	.	*	H	α-helix	trans	-61.6	-40	173.8	-78.4	0	0	0	0	112	L2 A9 L10	L2-C6 PolarHBondContact O-N 3.46Å; L2-C6 VanDerWaalsContact O-N 3.08Å; C6-A9 PolarHBondContact O-N 3.34Å; C6-L10 WeakPolarHBondContact O-CB 3.45Å; C6-L10 PolarHBondContact O-N 3.48Å
7	L	63	Low	54	Low	74 Å²	74	103.9 Å²	103.9	39%	0.387	57%	0.568	S	S	.	*	H	α-helix	trans	-70.1	-33.8	178.9	-151.3	112	0	0	0	112.2	F3 D4 E5 K11	F3-L7 HydrophobicContact CE1-CD1 4.21Å; F3-L7 WeakPolarHBondContact O-CB 3.35Å; F3-L7 PolarHBondContact O-N 3.36Å; F3-L7 VanDerWaalsContact O-N 3.08Å; D4-L7 PolarHBondContact O-N 3.32Å; E5-L7 VanDerWaalsContact C-N 3.32Å; E5-L7 PolarHBondContact O-N 3.3Å; L7-K11 HydrophobicContact CD2-CD 4.29Å; L7-K11 WeakPolarHBondContact O-CB 3.44Å; L7-K11 VanDerWaalsContact O-CG 3.3Å; L7-K11 WeakPolarHBondContact O-CG 3.42Å; L7-K11 PolarHBondContact O-N 3.14Å
8	L	65.6	Low	53.5	Low	118 Å²	118	102 Å²	102	62%	0.618	56%	0.564	S	S	*	*	H	α-helix	trans	-69.9	-40.2	172.4	-83.7	164.5	0	0	0	111.9	D4 E5 K11 A12	D4-L8 WeakPolarHBondContact O-CB 3.43Å; D4-L8 WeakPolarHBondContact O-CG 3.45Å; D4-L8 PolarHBondContact O-N 2.98Å; E5-L8 PolarHBondContact O-N 2.99Å; L8-K11 PolarHBondContact O-N 3.47Å; L8-A12 WeakPolarHBondContact O-CB 3.39Å; L8-A12 PolarHBondContact O-N 2.88Å
9	A	61	Low	53	Low	51 Å²	51	103.6 Å²	103.6	42%	0.421	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-45.6	174.4	0	0	0	0	0	111.2	E5 C6 K11 A12 E13	E5-A9 WeakPolarHBondContact O-CB 3.39Å; E5-A9 PolarHBondContact O-N 3.46Å; C6-A9 PolarHBondContact O-N 3.34Å; A9-K11 PolarHBondContact O-N 3.03Å; A9-A12 CarbonylContact O-C 3.59Å; A9-A12 PolarHBondContact O-N 2.75Å; A9-A12 VanDerWaalsContact O-N 3.17Å; A9-E13 PolarHBondContact O-N 3.31Å
10	L	54.8	Low	53	Low	95 Å²	95	101.7 Å²	101.7	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-61.4	-41.3	173.5	-96.6	150.7	0	0	0	112.5	C6 Q14	C6-L10 WeakPolarHBondContact O-CB 3.45Å; C6-L10 PolarHBondContact O-N 3.48Å; L10-Q14 WeakPolarHBondContact O-CB 3.4Å; L10-Q14 VanDerWaalsContact O-CG 3.25Å; L10-Q14 WeakPolarHBondContact O-CG 3.31Å; L10-Q14 PolarHBondContact O-N 3.47Å
11	K	56.4	Low	53.2	Low	124 Å²	124	101.3 Å²	101.3	54%	0.539	56%	0.559	S	S	.	*	H	α-helix	trans	-68.1	-34.3	174.3	-79.8	177.9	178.2	176.7	0	112.3	L7 L8 A9 S15	L7-K11 HydrophobicContact CD2-CD 4.29Å; L7-K11 WeakPolarHBondContact O-CB 3.44Å; L7-K11 VanDerWaalsContact O-CG 3.3Å; L7-K11 WeakPolarHBondContact O-CG 3.42Å; L7-K11 PolarHBondContact O-N 3.14Å; L8-K11 PolarHBondContact O-N 3.47Å; A9-K11 PolarHBondContact O-N 3.03Å; K11-S15 WeakPolarHBondContact O-CB 3.37Å; K11-S15 PolarHBondContact O-N 3.3Å
12	A	51.2	Low	54.2	Low	59 Å²	59	94.7 Å²	94.7	49%	0.488	53%	0.527	S	S	.	.	H	α-helix	trans	-70.8	-41.1	176	0	0	0	0	0	111.1	L8 A9 S15 A16	L8-A12 WeakPolarHBondContact O-CB 3.39Å; L8-A12 PolarHBondContact O-N 2.88Å; A9-A12 CarbonylContact O-C 3.59Å; A9-A12 PolarHBondContact O-N 2.75Å; A9-A12 VanDerWaalsContact O-N 3.17Å; A12-S15 PolarHBondContact O-N 3.37Å; A12-A16 WeakPolarHBondContact O-CB 3.41Å; A12-A16 PolarHBondContact O-N 3.49Å
13	E	47.7	Very low	54.9	Low	137 Å²	137	96.3 Å²	96.3	64%	0.64	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-42.8	172.2	-77.6	-177.5	171.4	0	0	111.5	A9 S15 A16 A17	A9-E13 PolarHBondContact O-N 3.31Å; E13-S15 VanDerWaalsContact C-N 3.34Å; E13-S15 PolarHBondContact O-N 3.33Å; E13-A16 PolarHBondContact O-N 3.3Å; E13-A17 WeakPolarHBondContact O-CB 3.44Å; E13-A17 PolarHBondContact O-N 2.87Å
14	Q	43.6	Very low	55.9	Low	130 Å²	130	89.9 Å²	89.9	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-64.6	-37.8	173.5	-75.7	177.1	-2.4	0	0	112.1	L10 S18	L10-Q14 WeakPolarHBondContact O-CB 3.4Å; L10-Q14 VanDerWaalsContact O-CG 3.25Å; L10-Q14 WeakPolarHBondContact O-CG 3.31Å; L10-Q14 PolarHBondContact O-N 3.47Å; Q14-S18 WeakPolarHBondContact O-CB 3.27Å; Q14-S18 PolarHBondContact O-N 3.12Å
15	S	45.6	Very low	56.4	Low	57 Å²	57	92.2 Å²	92.2	40%	0.399	51%	0.51	S	S	.	.	H	α-helix	trans	-66.4	-46.1	174.4	-179.1	0	0	0	0	111.3	K11 A12 E13 S18 E19	K11-S15 WeakPolarHBondContact O-CB 3.37Å; K11-S15 PolarHBondContact O-N 3.3Å; A12-S15 PolarHBondContact O-N 3.37Å; E13-S15 VanDerWaalsContact C-N 3.34Å; E13-S15 PolarHBondContact O-N 3.33Å; S15-S18 CarbonylContact O-C 3.52Å; S15-S18 WeakPolarHBondContact O-CB 3.42Å; S15-S18 PolarHBondContact O-N 3.24Å; S15-S18 VanDerWaalsContact O-N 3.15Å; S15-S18 PolarHBondContact O-OG 2.89Å; S15-E19 PolarHBondContact O-N 3.45Å
16	A	46	Very low	57.1	Low	58 Å²	58	86.9 Å²	86.9	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-41	178.3	0	0	0	0	0	111.2	A12 E13 S18 E19 A20	A12-A16 WeakPolarHBondContact O-CB 3.41Å; A12-A16 PolarHBondContact O-N 3.49Å; E13-A16 PolarHBondContact O-N 3.3Å; A16-S18 VanDerWaalsContact C-N 3.3Å; A16-S18 PolarHBondContact O-N 2.88Å; A16-E19 CarbonylContact O-C 3.59Å; A16-E19 WeakPolarHBondContact O-CA 3.32Å; A16-E19 PolarHBondContact O-N 3.02Å; A16-A20 PolarHBondContact O-N 3.15Å
17	A	45.9	Very low	58.7	Low	67 Å²	67	85.2 Å²	85.2	55%	0.554	47%	0.471	S	S	*	.	H	α-helix	trans	-63.9	-34.8	172.3	0	0	0	0	0	112	E13 E19	E13-A17 WeakPolarHBondContact O-CB 3.44Å; E13-A17 PolarHBondContact O-N 2.87Å; A17-E19 VanDerWaalsContact C-N 3.25Å; A17-E19 PolarHBondContact O-N 3.41Å
18	S	45.7	Very low	59.7	Low	70 Å²	70	82.6 Å²	82.6	49%	0.49	46%	0.457	S	S	.	.	H	α-helix	trans	-70.9	-22.1	172.6	87.8	0	0	0	0	113.1	Q14 S15 A16 K655	Q14-S18 WeakPolarHBondContact O-CB 3.27Å; Q14-S18 PolarHBondContact O-N 3.12Å; S15-S18 CarbonylContact O-C 3.52Å; S15-S18 WeakPolarHBondContact O-CB 3.42Å; S15-S18 PolarHBondContact O-N 3.24Å; S15-S18 VanDerWaalsContact O-N 3.15Å; S15-S18 PolarHBondContact O-OG 2.89Å; A16-S18 VanDerWaalsContact C-N 3.3Å; A16-S18 PolarHBondContact O-N 2.88Å; S18-K655 PolarHBondContact O-NZ 3.22Å
19	E	44.1	Very low	60.6	Low	132 Å²	132	77.9 Å²	77.9	62%	0.617	43%	0.434	S	S	*	.	H	α-helix	trans	-92.2	-13	179.6	-78.7	-174.1	169.4	0	0	114.1	S15 A16 A17 E21	S15-E19 PolarHBondContact O-N 3.45Å; A16-E19 CarbonylContact O-C 3.59Å; A16-E19 WeakPolarHBondContact O-CA 3.32Å; A16-E19 PolarHBondContact O-N 3.02Å; A17-E19 VanDerWaalsContact C-N 3.25Å; A17-E19 PolarHBondContact O-N 3.41Å; E19-E21 PolarHBondContact O-N 3.01Å
20	A	51.7	Low	61.9	Low	65 Å²	65	77.2 Å²	77.2	54%	0.537	42%	0.423	S	S	.	.			trans	-53.4	116.2	177.7	0	0	0	0	0	110.6	A16	A16-A20 PolarHBondContact O-N 3.15Å
21	E	58.4	Low	63.5	Low	95 Å²	95	78.6 Å²	78.6	44%	0.444	43%	0.427	S	S	.	.			trans	-62.9	140.7	170.1	-65.7	-166.4	148	0	0	108.5	E19 E23 Q307 P308	E19-E21 PolarHBondContact O-N 3.01Å; E21-E23 PolarHBondContact O-N 3.1Å; E21-Q307 PolarHBondContact OE1-NE2 2.78Å; E21-Q307 PolarHBondContact OE1-OE1 2.85Å; E21-Q307 PolarHBondContact OE2-NE2 2.78Å; E21-P308 HydrophobicContact CG-CG 4.33Å; E21-P308 WeakPolarHBondContact OE1-CD 3.18Å; E21-P308 WeakPolarHBondContact OE1-CG 3.33Å
22	I	64.6	Low	65.1	Low	47 Å²	47	74.4 Å²	74.4	24%	0.241	41%	0.41	C	S	.	.			trans	-68.5	104.9	174.4	-59.3	177.5	0	0	0	106.4	F24 Y610 L615 V654	I22-F24 VanDerWaalsContact C-N 3.33Å; I22-F24 HydrophobicContact CG2-CB 3.93Å; I22-F24 PolarHBondContact O-N 3.3Å; I22-Y610 HydrophobicContact CG2-CD1 3.49Å; I22-Y610 VanDerWaalsContact CG2-CD1 3.49Å; I22-Y610 HydrophobicContact CG2-CD2 3.87Å; I22-Y610 HydrophobicContact CG2-CE1 3.56Å; I22-Y610 HydrophobicContact CG2-CE2 3.98Å; I22-Y610 HydrophobicContact CG2-CG 3.64Å; I22-L615 HydrophobicContact CG2-CD2 3.89Å; I22-V654 HydrophobicContact CD1-CG1 4.04Å
23	E	65.7	Low	67	Low	173 Å²	173	72.5 Å²	72.5	81%	0.808	39%	0.394	S	S	*	.			trans	-67.2	93	172.2	-176.8	171.8	-158.5	0	0	108.3	E21 Y610	E21-E23 PolarHBondContact O-N 3.1Å; E23-Y610 PolarHBondContact O-OH 3.39Å
24	F	75.2	Confident	69	Low	26 Å²	26	70.1 Å²	70.1	11%	0.114	38%	0.383	C	S	.	.			trans	-132.2	108.2	-174.2	174.2	-105.8	0	0	0	110.1	I22 Y26 Y610 W612 L615 F616 Q656	I22-F24 VanDerWaalsContact C-N 3.33Å; I22-F24 HydrophobicContact CG2-CB 3.93Å; I22-F24 PolarHBondContact O-N 3.3Å; F24-Y26 AromaticContact CE1-CD2 3.39Å; F24-Y26 HydrophobicContact CE1-CD2 3.39Å; F24-Y26 HydrophobicContact CE1-CE2 4.41Å; F24-Y26 AromaticContact CE1-CG 3.87Å; F24-Y26 HydrophobicContact CE1-CG 3.87Å; F24-Y26 AromaticContact CZ-CD2 3.51Å; F24-Y26 HydrophobicContact CZ-CD2 3.51Å; F24-Y26 HydrophobicContact CZ-CE2 4.36Å; F24-Y26 HydrophobicContact CZ-CG 4.35Å; F24-Y610 HydrophobicContact CD2-CE2 4.1Å; F24-W612 AromaticContact CD2-CD1 3.44Å; F24-W612 VanDerWaalsContact CD2-CD1 3.44Å; F24-W612 HydrophobicContact CD2-CG 4.22Å; F24-W612 AromaticContact CD2-NE1 3.63Å; F24-W612 AromaticContact CE2-CD1 3.37Å; F24-W612 HydrophobicContact CE2-CD2 4.12Å; F24-W612 AromaticContact CE2-CE2 3.82Å; F24-W612 AromaticContact CE2-CG 3.84Å; F24-W612 HydrophobicContact CE2-CG 3.84Å; F24-W612 AromaticContact CE2-NE1 3.31Å; F24-W612 VanDerWaalsContact CE2-NE1 3.31Å; F24-L615 HydrophobicContact CB-CD2 3.96Å; F24-L615 HydrophobicContact CD1-CD2 3.88Å; F24-L615 HydrophobicContact CD1-CG 4.29Å; F24-L615 HydrophobicContact CD2-CD2 3.52Å; F24-L615 HydrophobicContact CD2-CG 4.15Å; F24-L615 HydrophobicContact CE1-CD2 4.14Å; F24-L615 HydrophobicContact CE1-CG 4.04Å; F24-L615 HydrophobicContact CE2-CB 4.09Å; F24-L615 HydrophobicContact CE2-CD2 3.82Å; F24-L615 HydrophobicContact CE2-CG 3.92Å; F24-L615 HydrophobicContact CG-CD2 3.52Å; F24-L615 HydrophobicContact CG-CG 4.3Å; F24-L615 HydrophobicContact CZ-CB 4.29Å; F24-L615 HydrophobicContact CZ-CD2 4.1Å; F24-L615 HydrophobicContact CZ-CG 3.84Å; F24-F616 HydrophobicContact CZ-CB 4.24Å; F24-Q656 HydrophobicContact CD1-CG 4.28Å
25	E	77.5	Confident	71.3	Confident	147 Å²	147	64 Å²	64	69%	0.687	35%	0.354	S	S	*	.			trans	-84	129.4	167.7	-171.8	166.5	-169.8	0	0	109.8	W612	E25-W612 PolarHBondContact O-NE1 3.42Å
26	Y	82.4	Confident	73.6	Confident	21 Å²	21	62 Å²	62	8%	0.082	34%	0.339	C	S	.	.			trans	-112.1	91.1	-174.7	-174.4	-98.7	0	0	0	109.3	F24 W277 I300 F616 V619 N620 R623 L658	F24-Y26 AromaticContact CE1-CD2 3.39Å; F24-Y26 HydrophobicContact CE1-CD2 3.39Å; F24-Y26 HydrophobicContact CE1-CE2 4.41Å; F24-Y26 AromaticContact CE1-CG 3.87Å; F24-Y26 HydrophobicContact CE1-CG 3.87Å; F24-Y26 AromaticContact CZ-CD2 3.51Å; F24-Y26 HydrophobicContact CZ-CD2 3.51Å; F24-Y26 HydrophobicContact CZ-CE2 4.36Å; F24-Y26 HydrophobicContact CZ-CG 4.35Å; Y26-W277 HydrophobicContact CD1-CH2 4.39Å; Y26-W277 HydrophobicContact CD1-CZ3 4.04Å; Y26-W277 HydrophobicContact CE1-CE3 4.29Å; Y26-W277 AromaticContact CE1-CH2 3.21Å; Y26-W277 HydrophobicContact CE1-CH2 3.21Å; Y26-W277 AromaticContact CE1-CZ3 3.05Å; Y26-W277 HydrophobicContact CE1-CZ3 3.05Å; Y26-W277 HydrophobicContact CE2-CH2 4.46Å; Y26-W277 AromaticContact CZ-CH2 3.4Å; Y26-W277 AromaticContact CZ-CZ3 3.74Å; Y26-W277 WeakPolarHBondContact OH-CH2 3.46Å; Y26-I300 HydrophobicContact CD1-CD1 4.46Å; Y26-I300 HydrophobicContact CD1-CG1 4.47Å; Y26-I300 HydrophobicContact CD1-CG2 4.07Å; Y26-I300 HydrophobicContact CE1-CD1 4.34Å; Y26-F616 AromaticContact CD2-CD2 3.82Å; Y26-F616 HydrophobicContact CD2-CD2 3.82Å; Y26-F616 HydrophobicContact CD2-CE2 4.39Å; Y26-F616 AromaticContact CE2-CD2 3.47Å; Y26-F616 HydrophobicContact CE2-CD2 3.47Å; Y26-F616 VanDerWaalsContact CE2-CD2 3.47Å; Y26-F616 AromaticContact CE2-CE2 3.89Å; Y26-F616 HydrophobicContact CE2-CE2 3.89Å; Y26-F616 HydrophobicContact CE2-CG 4.32Å; Y26-V619 HydrophobicContact CD2-CG1 4.34Å; Y26-V619 HydrophobicContact CE1-CG1 4.29Å; Y26-V619 HydrophobicContact CE2-CB 3.74Å; Y26-V619 HydrophobicContact CE2-CG1 3.56Å; Y26-V619 HydrophobicContact CE2-CG2 4.39Å; Y26-V619 VanDerWaalsContact CZ-CG1 3.44Å; Y26-V619 WeakPolarHBondContact OH-CG1 3.46Å; Y26-N620 PolarHBondContact OH-OD1 3.19Å; Y26-R623 PolarHBondContact OH-NH1 3.39Å; Y26-L658 HydrophobicContact CD1-CD2 3.34Å; Y26-L658 HydrophobicContact CD2-CD2 4.1Å; Y26-L658 HydrophobicContact CE1-CD2 3.83Å; Y26-L658 HydrophobicContact CE2-CD2 4.34Å; Y26-L658 HydrophobicContact CG-CD2 3.53Å
27	D	85.8	Confident	75.8	Confident	44 Å²	44	63 Å²	63	24%	0.235	34%	0.337	C	S	.	.			trans	-116.9	179.3	175.8	-150.1	-17.4	0	0	0	111.1	C29 R278 F616	D27-C29 VanDerWaalsContact C-N 3.28Å; D27-C29 PolarHBondContact O-N 3.25Å; D27-R278 IonicContact OD1-NH1 3.69Å; D27-R278 IonicContact OD2-CZ 3.39Å; D27-R278 IonicContact OD2-NH1 3.37Å; D27-R278 PolarHBondContact OD2-NH1 2.97Å; D27-R278 IonicContact OD2-NH2 3.84Å; D27-R278 PolarHBondContact OD2-NH2 3.47Å; D27-R278 VanDerWaalsContact OD2-NH2 3.12Å; D27-F616 VanDerWaalsContact O-CE2 3.29Å; D27-F616 WeakPolarHBondContact O-CE2 3.26Å
28	D	85	Confident	78	Confident	18 Å²	18	59.9 Å²	59.9	10%	0.096	31%	0.311	C	S	.	.	S	Bend	trans	-63.9	-32.4	-177.7	-65.9	-28.7	0	0	0	113.2	W267 L271 G276 W277	D28-W267 WeakPolarHBondContact O-CZ2 3.46Å; D28-L271 HydrophobicContact CB-CD2 4.42Å; D28-G276 VanDerWaalsContact OD2-C 3.27Å; D28-G276 WeakPolarHBondContact OD2-CA 3.35Å; D28-W277 VanDerWaalsContact OD1-CB 3.25Å; D28-W277 WeakPolarHBondContact OD1-CB 3.15Å; D28-W277 PolarHBondContact OD1-N 2.96Å; D28-W277 PolarHBondContact OD1-NE1 3.19Å; D28-W277 PolarHBondContact OD2-N 2.93Å
29	C	85.3	Confident	80.1	Confident	20 Å²	20	56.6 Å²	56.6	14%	0.135	29%	0.287	C	S	.	.	S	Bend	trans	-144.2	162.4	-178.1	-66	0	0	0	0	109	D27 E35 K268 L271	D27-C29 VanDerWaalsContact C-N 3.28Å; D27-C29 PolarHBondContact O-N 3.25Å; C29-E35 HydrophobicContact CB-CG 4.33Å; C29-K268 PolarHBondContact SG-NZ 3.46Å; C29-L271 WeakPolarHBondContact SG-CD1 3.35Å
30	D	87.3	Confident	82.4	Confident	36 Å²	36	51.9 Å²	51.9	19%	0.193	26%	0.264	C	S	.	.			trans	-81	-178.2	169.1	-150.5	-22.6	0	0	0	110.8	H34 E35 R196 W612	D30-H34 HydrophobicContact CB-CB 4.03Å; D30-H34 IonicContact OD1-ND1 3.78Å; D30-H34 IonicContact OD2-CG 3.07Å; D30-E35 HydrophobicContact CB-CG 4.11Å; D30-E35 WeakPolarHBondContact CB-OE1 3.35Å; D30-E35 PolarHBondContact N-OE1 2.91Å; D30-R196 PolarHBondContact O-NH1 3.23Å; D30-R196 PolarHBondContact O-NH2 3.03Å; D30-W612 HydrophobicContact CB-CH2 4.35Å; D30-W612 HydrophobicContact CB-CZ3 4.36Å
31	E	88.3	Confident	84	Confident	125 Å²	125	49.1 Å²	49.1	58%	0.584	24%	0.241	S	C	*	.			trans	-58.3	158.2	173	-61.3	177	163.9	0	0	112.3	A33 H34 E35	E31-A33 VanDerWaalsContact C-N 3.33Å; E31-A33 PolarHBondContact O-N 3.23Å; E31-H34 PolarHBondContact O-N 3.43Å; E31-H34 IonicContact OE2-CE1 3.25Å; E31-H34 PolarHBondContact OE2-CE1 3.48Å; E31-H34 IonicContact OE2-ND1 3.19Å; E31-H34 PolarHBondContact OE2-ND1 3Å; E31-E35 PolarHBondContact O-N 3.45Å
32	L	89.3	Confident	85.2	Confident	35 Å²	35	49.9 Å²	49.9	18%	0.183	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-43.6	-172.1	176.5	61	0	0	0	111.4	H34 E35 L36 L119 E192 R196	L32-H34 VanDerWaalsContact C-N 3.34Å; L32-H34 PolarHBondContact O-N 3.37Å; L32-E35 PolarHBondContact O-N 2.74Å; L32-L36 HydrophobicContact CD1-CD1 3.84Å; L32-L36 HydrophobicContact CD1-CD2 4.4Å; L32-L36 HydrophobicContact CD1-CG 3.84Å; L32-L36 HydrophobicContact CG-CD1 3.86Å; L32-L36 HydrophobicContact CG-CG 4.28Å; L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 3.27Å; L32-L119 HydrophobicContact CD2-CD2 4.42Å; L32-L119 HydrophobicContact CG-CD2 4.31Å; L32-E192 HydrophobicContact CD1-CG 4.14Å; L32-R196 VanDerWaalsContact CA-NH1 3.27Å
33	A	91.1	Very high	85.8	Confident	19 Å²	19	49.7 Å²	49.7	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-56.6	-47.3	176.8	0	0	0	0	0	112.1	E31 L36 N37 E115 L119	E31-A33 VanDerWaalsContact C-N 3.33Å; E31-A33 PolarHBondContact O-N 3.23Å; A33-L36 PolarHBondContact O-N 3.38Å; A33-N37 VanDerWaalsContact O-CB 3.23Å; A33-N37 WeakPolarHBondContact O-CB 3.41Å; A33-N37 PolarHBondContact O-N 3.06Å; A33-E115 VanDerWaalsContact CB-OE1 3.29Å; A33-E115 WeakPolarHBondContact CB-OE1 3.41Å; A33-L119 HydrophobicContact CB-CD1 4.07Å; A33-L119 HydrophobicContact CB-CD2 4.2Å
34	H	90.4	Very high	86.5	Confident	88 Å²	88	41.8 Å²	41.8	41%	0.407	21%	0.207	S	C	.	.	H	α-helix	trans	-64.4	-43.3	179.9	-67.5	103.1	0	0	0	112	D30 E31 L32 N37 E38	D30-H34 HydrophobicContact CB-CB 4.03Å; D30-H34 IonicContact OD1-ND1 3.78Å; D30-H34 IonicContact OD2-CG 3.07Å; E31-H34 PolarHBondContact O-N 3.43Å; E31-H34 IonicContact OE2-CE1 3.25Å; E31-H34 PolarHBondContact OE2-CE1 3.48Å; E31-H34 IonicContact OE2-ND1 3.19Å; E31-H34 PolarHBondContact OE2-ND1 3Å; L32-H34 VanDerWaalsContact C-N 3.34Å; L32-H34 PolarHBondContact O-N 3.37Å; H34-N37 PolarHBondContact O-N 3.25Å; H34-E38 WeakPolarHBondContact O-CG 3.38Å; H34-E38 PolarHBondContact O-N 3.22Å
35	E	92.2	Very high	86.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.3	-35.4	178.8	-68	-68.5	170	0	0	113.3	C29 D30 E31 L32 E38 Y188 K268 K552	C29-E35 HydrophobicContact CB-CG 4.33Å; D30-E35 HydrophobicContact CB-CG 4.11Å; D30-E35 WeakPolarHBondContact CB-OE1 3.35Å; D30-E35 PolarHBondContact N-OE1 2.91Å; E31-E35 PolarHBondContact O-N 3.45Å; L32-E35 PolarHBondContact O-N 2.74Å; E35-E38 PolarHBondContact O-N 3.34Å; E35-Y188 PolarHBondContact O-OH 2.87Å; E35-K268 IonicContact OE1-NZ 3.17Å; E35-K268 WeakPolarHBondContact OE2-CE 3.49Å; E35-K268 IonicContact OE2-NZ 2.7Å; E35-K268 PolarHBondContact OE2-NZ 3.02Å; E35-K552 VanDerWaalsContact CD-NZ 3.34Å; E35-K552 IonicContact OE1-NZ 3.77Å; E35-K552 PolarHBondContact OE1-NZ 2.84Å; E35-K552 IonicContact OE2-NZ 3.8Å; E35-K552 PolarHBondContact OE2-NZ 3.32Å
36	L	93.1	Very high	87.1	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-68.5	-39.7	172.5	-70.6	175.5	0	0	0	111	L32 A33 E38 M39 Y40 L119 I122 Y188 T189	L32-L36 HydrophobicContact CD1-CD1 3.84Å; L32-L36 HydrophobicContact CD1-CD2 4.4Å; L32-L36 HydrophobicContact CD1-CG 3.84Å; L32-L36 HydrophobicContact CG-CD1 3.86Å; L32-L36 HydrophobicContact CG-CG 4.28Å; L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 3.27Å; A33-L36 PolarHBondContact O-N 3.38Å; L36-E38 VanDerWaalsContact C-N 3.3Å; L36-E38 PolarHBondContact O-N 3.41Å; L36-M39 VanDerWaalsContact O-CB 3.25Å; L36-M39 WeakPolarHBondContact O-CB 3.37Å; L36-M39 PolarHBondContact O-N 2.87Å; L36-Y40 WeakPolarHBondContact O-CD2 3.42Å; L36-L119 HydrophobicContact CD1-CD2 4.04Å; L36-I122 HydrophobicContact CD1-CD1 4Å; L36-I122 HydrophobicContact CD1-CG2 3.93Å; L36-Y188 HydrophobicContact CD2-CE1 4.27Å; L36-T189 HydrophobicContact CD2-CG2 4.24Å
37	N	92.4	Very high	87.3	Confident	80 Å²	80	42.7 Å²	42.7	43%	0.428	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-35.5	176.4	-175.3	17.3	0	0	0	111.9	A33 H34 M39 Y40 R545	A33-N37 VanDerWaalsContact O-CB 3.23Å; A33-N37 WeakPolarHBondContact O-CB 3.41Å; A33-N37 PolarHBondContact O-N 3.06Å; H34-N37 PolarHBondContact O-N 3.25Å; N37-M39 PolarHBondContact O-N 3.22Å; N37-M39 VanDerWaalsContact O-N 3.16Å; N37-Y40 PolarHBondContact O-N 3.41Å; N37-Y40 VanDerWaalsContact O-N 3.16Å; N37-R545 VanDerWaalsContact C-NH2 3.32Å; N37-R545 PolarHBondContact O-NH2 3.42Å; N37-R545 PolarHBondContact OD1-NH2 3.46Å
38	E	92.1	Very high	87.4	Confident	2 Å²	2	43 Å²	43	1%	0.009	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.6	176.1	-76.1	-176.6	-177.8	0	0	114	H34 E35 L36 Y40 I549 K552 R613	H34-E38 WeakPolarHBondContact O-CG 3.38Å; H34-E38 PolarHBondContact O-N 3.22Å; E35-E38 PolarHBondContact O-N 3.34Å; L36-E38 VanDerWaalsContact C-N 3.3Å; L36-E38 PolarHBondContact O-N 3.41Å; E38-Y40 VanDerWaalsContact C-N 3.33Å; E38-Y40 PolarHBondContact O-N 2.9Å; E38-I549 HydrophobicContact CB-CD1 4.06Å; E38-I549 HydrophobicContact CB-CG1 4.35Å; E38-I549 HydrophobicContact CB-CG2 4.46Å; E38-I549 HydrophobicContact CG-CD1 4.02Å; E38-I549 HydrophobicContact CG-CG1 4Å; E38-K552 IonicContact OE1-NZ 3.02Å; E38-K552 PolarHBondContact OE1-NZ 2.98Å; E38-K552 WeakPolarHBondContact OE2-CE 3.47Å; E38-K552 IonicContact OE2-NZ 3.73Å; E38-K552 PolarHBondContact OE2-NZ 3.48Å; E38-R613 VanDerWaalsContact OE1-CD 3.3Å; E38-R613 WeakPolarHBondContact OE1-CD 3.47Å; E38-R613 WeakPolarHBondContact OE1-CG 3.36Å
39	M	91.1	Very high	87.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-34	176	-178.3	51.3	63.4	0	0	112.7	L36 N37 A185 Y188 K261 L264	L36-M39 VanDerWaalsContact O-CB 3.25Å; L36-M39 WeakPolarHBondContact O-CB 3.37Å; L36-M39 PolarHBondContact O-N 2.87Å; N37-M39 PolarHBondContact O-N 3.22Å; N37-M39 VanDerWaalsContact O-N 3.16Å; M39-A185 HydrophobicContact CG-CB 4.02Å; M39-A185 HydrophobicContact SD-CB 4.2Å; M39-Y188 HydrophobicContact CB-CD1 4.33Å; M39-Y188 HydrophobicContact CB-CE1 4.27Å; M39-Y188 HydrophobicContact CE-CD1 3.29Å; M39-Y188 HydrophobicContact CE-CD2 3.38Å; M39-Y188 HydrophobicContact CE-CE1 3.85Å; M39-Y188 HydrophobicContact CE-CE2 3.94Å; M39-Y188 HydrophobicContact CE-CG 3.01Å; M39-Y188 HydrophobicContact CG-CD1 4.45Å; M39-K261 PolarHBondContact O-NZ 2.97Å; M39-K261 HydrophobicContact SD-CB 3.86Å; M39-K261 HydrophobicContact SD-CD 3.64Å; M39-K261 HydrophobicContact SD-CG 3.49Å; M39-K261 WeakPolarHBondContact SD-CG 3.48Å; M39-L264 HydrophobicContact CE-CB 4.17Å; M39-L264 HydrophobicContact CE-CD1 4.1Å
40	Y	90.8	Very high	88	Confident	33 Å²	33	51 Å²	51	13%	0.129	26%	0.255	C	S	.	.			trans	-106.8	134.4	-169.9	-56.6	-78.9	0	0	0	111.6	L36 N37 E38 E44 F48 Q106 A185 R545	L36-Y40 WeakPolarHBondContact O-CD2 3.42Å; N37-Y40 PolarHBondContact O-N 3.41Å; N37-Y40 VanDerWaalsContact O-N 3.16Å; E38-Y40 VanDerWaalsContact C-N 3.33Å; E38-Y40 PolarHBondContact O-N 2.9Å; Y40-E44 WeakPolarHBondContact CA-OE2 3.46Å; Y40-F48 AromaticContact CD1-CE2 3.58Å; Y40-F48 HydrophobicContact CD1-CE2 3.58Å; Y40-F48 AromaticContact CD1-CZ 3.52Å; Y40-F48 HydrophobicContact CD1-CZ 3.52Å; Y40-F48 AromaticContact CD2-CZ 3.9Å; Y40-F48 HydrophobicContact CD2-CZ 3.9Å; Y40-F48 HydrophobicContact CE1-CE2 4.06Å; Y40-F48 AromaticContact CE1-CZ 3.82Å; Y40-F48 HydrophobicContact CE1-CZ 3.82Å; Y40-F48 HydrophobicContact CE2-CZ 4.18Å; Y40-F48 AromaticContact CG-CE2 3.93Å; Y40-F48 HydrophobicContact CG-CE2 3.93Å; Y40-F48 AromaticContact CG-CZ 3.56Å; Y40-F48 HydrophobicContact CG-CZ 3.56Å; Y40-Q106 WeakPolarHBondContact OH-CG 3.27Å; Y40-Q106 PolarHBondContact OH-NE2 2.58Å; Y40-A185 HydrophobicContact CE1-CB 4.34Å; Y40-R545 PolarHBondContact O-NH1 3.32Å; Y40-R545 VanDerWaalsContact O-NH1 3.14Å
41	S	86.2	Confident	88.2	Confident	7 Å²	7	49.4 Å²	49.4	5%	0.049	25%	0.246	C	C	.	.			trans	-78.1	161.7	166.8	63.6	0	0	0	0	109.9	S43 E44	S41-S43 VanDerWaalsContact C-N 3.29Å; S41-E44 PolarHBondContact N-OE2 2.94Å; S41-E44 PolarHBondContact O-N 2.93Å; S41-E44 WeakPolarHBondContact OG-CG 3.34Å; S41-E44 PolarHBondContact OG-N 3.28Å; S41-E44 PolarHBondContact OG-OE2 2.76Å
42	Y	83.4	Confident	88.5	Confident	112 Å²	112	46.6 Å²	46.6	44%	0.439	23%	0.23	S	C	.	.	S	Bend	trans	-62.2	-45.4	170.1	-60.2	-55.5	0	0	0	109.3	E44 S45 R538 D542	Y42-E44 PolarHBondContact O-N 3.08Å; Y42-E44 VanDerWaalsContact O-N 3.07Å; Y42-S45 WeakPolarHBondContact O-CB 3.3Å; Y42-S45 PolarHBondContact O-N 3.19Å; Y42-R538 VanDerWaalsContact C-NH2 3.26Å; Y42-R538 PolarHBondContact O-NH2 2.77Å; Y42-D542 WeakPolarHBondContact CB-OD1 3.38Å; Y42-D542 WeakPolarHBondContact CB-OD2 3.33Å; Y42-D542 WeakPolarHBondContact CD2-OD1 3.49Å; Y42-D542 PolarHBondContact N-OD1 3.44Å; Y42-D542 PolarHBondContact N-OD2 3.38Å
43	S	76.3	Confident	88.7	Confident	43 Å²	43	49.1 Å²	49.1	30%	0.301	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-29.8	-178.8	-57.8	0	0	0	0	114.7	S41 S45 D542	S41-S43 VanDerWaalsContact C-N 3.29Å; S43-S45 PolarHBondContact O-N 3.42Å; S43-D542 PolarHBondContact N-OD2 3.05Å; S43-D542 PolarHBondContact OG-OD2 2.88Å
44	E	82.1	Confident	88.8	Confident	7 Å²	7	48.4 Å²	48.4	3%	0.033	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-3.8	175.9	-75	167.9	134.6	0	0	114	Y40 S41 Y42 L46 E47 F48 R181 R260 K261	Y40-E44 WeakPolarHBondContact CA-OE2 3.46Å; S41-E44 PolarHBondContact N-OE2 2.94Å; S41-E44 PolarHBondContact O-N 2.93Å; S41-E44 WeakPolarHBondContact OG-CG 3.34Å; S41-E44 PolarHBondContact OG-N 3.28Å; S41-E44 PolarHBondContact OG-OE2 2.76Å; Y42-E44 PolarHBondContact O-N 3.08Å; Y42-E44 VanDerWaalsContact O-N 3.07Å; E44-L46 PolarHBondContact O-N 3.3Å; E44-L46 VanDerWaalsContact O-N 3.08Å; E44-E47 WeakPolarHBondContact O-CB 3.44Å; E44-E47 PolarHBondContact O-N 3.18Å; E44-F48 WeakPolarHBondContact O-CD2 3.48Å; E44-R181 IonicContact OE1-NH1 3.91Å; E44-R181 PolarHBondContact OE1-NH1 3.29Å; E44-R260 IonicContact OE2-NH2 3.67Å; E44-R260 PolarHBondContact OE2-NH2 3.49Å; E44-K261 WeakPolarHBondContact OE1-CE 3.33Å; E44-K261 IonicContact OE1-NZ 3.52Å; E44-K261 PolarHBondContact OE1-NZ 2.94Å; E44-K261 IonicContact OE2-NZ 3.58Å; E44-K261 PolarHBondContact OE2-NZ 3.07Å
45	S	82.2	Confident	89	Confident	59 Å²	59	44.9 Å²	44.9	41%	0.413	22%	0.219	S	C	.	.	H	α-helix	trans	-56.5	-30	-176.5	73.6	0	0	0	0	114.7	Y42 S43 R538	Y42-S45 WeakPolarHBondContact O-CB 3.3Å; Y42-S45 PolarHBondContact O-N 3.19Å; S43-S45 PolarHBondContact O-N 3.42Å; S45-R538 PolarHBondContact OG-NH2 3.07Å
46	L	81.9	Confident	89	Confident	130 Å²	130	49.3 Å²	49.3	68%	0.681	24%	0.239	S	C	*	.	H	α-helix	trans	-71.8	-33.7	177.7	-65.2	174.3	0	0	0	111.5	E44 F48 F49 E50	E44-L46 PolarHBondContact O-N 3.3Å; E44-L46 VanDerWaalsContact O-N 3.08Å; L46-F48 PolarHBondContact O-N 2.92Å; L46-F49 PolarHBondContact O-N 3.25Å; L46-F49 VanDerWaalsContact O-N 3.12Å; L46-E50 PolarHBondContact O-N 3.06Å
47	E	86.1	Confident	88.9	Confident	23 Å²	23	52 Å²	52	11%	0.107	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-26.4	179	-55.9	-178.2	173.3	0	0	111.5	E44 F49 E50 N51 H178 R181	E44-E47 WeakPolarHBondContact O-CB 3.44Å; E44-E47 PolarHBondContact O-N 3.18Å; E47-F49 VanDerWaalsContact C-N 3.3Å; E47-F49 PolarHBondContact O-N 3.47Å; E47-E50 PolarHBondContact O-N 3.44Å; E47-N51 PolarHBondContact O-N 2.91Å; E47-N51 PolarHBondContact O-OD1 3.33Å; E47-H178 IonicContact OE1-CD2 3.49Å; E47-H178 IonicContact OE2-CD2 3.12Å; E47-H178 IonicContact OE2-NE2 2.96Å; E47-R181 VanDerWaalsContact CD-NH1 3.25Å; E47-R181 IonicContact OE1-CZ 3.31Å; E47-R181 VanDerWaalsContact OE1-CZ 3.29Å; E47-R181 IonicContact OE1-NH1 3.33Å; E47-R181 PolarHBondContact OE1-NH1 3.23Å; E47-R181 IonicContact OE1-NH2 2.67Å; E47-R181 PolarHBondContact OE1-NH2 3.05Å; E47-R181 IonicContact OE2-CZ 2.74Å; E47-R181 IonicContact OE2-NH1 3.75Å; E47-R181 PolarHBondContact OE2-NH1 2.9Å; E47-R181 IonicContact OE2-NH2 2.91Å
48	F	89.5	Confident	88.8	Confident	52 Å²	52	49 Å²	49	23%	0.228	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-38.3	173.7	-79.4	-118.1	0	0	0	111.9	Y40 E44 L46 N51 Y52 Q106 F109	Y40-F48 AromaticContact CD1-CE2 3.58Å; Y40-F48 HydrophobicContact CD1-CE2 3.58Å; Y40-F48 AromaticContact CD1-CZ 3.52Å; Y40-F48 HydrophobicContact CD1-CZ 3.52Å; Y40-F48 AromaticContact CD2-CZ 3.9Å; Y40-F48 HydrophobicContact CD2-CZ 3.9Å; Y40-F48 HydrophobicContact CE1-CE2 4.06Å; Y40-F48 AromaticContact CE1-CZ 3.82Å; Y40-F48 HydrophobicContact CE1-CZ 3.82Å; Y40-F48 HydrophobicContact CE2-CZ 4.18Å; Y40-F48 AromaticContact CG-CE2 3.93Å; Y40-F48 HydrophobicContact CG-CE2 3.93Å; Y40-F48 AromaticContact CG-CZ 3.56Å; Y40-F48 HydrophobicContact CG-CZ 3.56Å; E44-F48 WeakPolarHBondContact O-CD2 3.48Å; L46-F48 PolarHBondContact O-N 2.92Å; F48-N51 PolarHBondContact O-N 3.01Å; F48-Y52 PolarHBondContact O-N 2.96Å; F48-Q106 HydrophobicContact CE1-CG 4.5Å; F48-F109 HydrophobicContact CB-CE1 4.49Å; F48-F109 HydrophobicContact CB-CZ 4.17Å; F48-F109 AromaticContact CD1-CE1 3.83Å; F48-F109 HydrophobicContact CD1-CE1 3.83Å; F48-F109 HydrophobicContact CD1-CZ 4.15Å
49	F	90.6	Very high	88.7	Confident	125 Å²	125	49.6 Å²	49.6	55%	0.548	24%	0.241	S	C	.	.	H	α-helix	trans	-70.5	-37.5	176.9	-176.4	-99.6	0	0	0	111.3	L46 E47 N51 Y52 Q53	L46-F49 PolarHBondContact O-N 3.25Å; L46-F49 VanDerWaalsContact O-N 3.12Å; E47-F49 VanDerWaalsContact C-N 3.3Å; E47-F49 PolarHBondContact O-N 3.47Å; F49-N51 VanDerWaalsContact C-N 3.32Å; F49-N51 PolarHBondContact O-N 3.44Å; F49-Y52 HydrophobicContact CD2-CD1 4.38Å; F49-Y52 HydrophobicContact CE2-CD1 4.22Å; F49-Y52 PolarHBondContact O-N 2.85Å; F49-Q53 WeakPolarHBondContact O-CB 3.4Å; F49-Q53 PolarHBondContact O-N 3.27Å
50	E	90.9	Very high	88.5	Confident	81 Å²	81	53 Å²	53	38%	0.379	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-38.7	174.1	-60.7	-177.6	179.9	0	0	112.1	L46 E47 Q53 A54 Q99	L46-E50 PolarHBondContact O-N 3.06Å; E47-E50 PolarHBondContact O-N 3.44Å; E50-Q53 PolarHBondContact O-N 2.93Å; E50-A54 WeakPolarHBondContact O-CB 3.15Å; E50-A54 PolarHBondContact O-N 3.12Å; E50-Q99 PolarHBondContact OE2-NE2 3.37Å
51	N	93.1	Very high	88.4	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.011	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-46.1	174.5	-67.2	-12.1	0	0	0	111.6	E47 F48 F49 A54 F55 Q99	E47-N51 PolarHBondContact O-N 2.91Å; E47-N51 PolarHBondContact O-OD1 3.33Å; F48-N51 PolarHBondContact O-N 3.01Å; F49-N51 VanDerWaalsContact C-N 3.32Å; F49-N51 PolarHBondContact O-N 3.44Å; N51-A54 PolarHBondContact O-N 2.79Å; N51-F55 PolarHBondContact O-N 3.43Å; N51-Q99 WeakPolarHBondContact CB-O 3.47Å; N51-Q99 WeakPolarHBondContact OD1-CB 3.39Å; N51-Q99 WeakPolarHBondContact OD1-CG 3.43Å
52	Y	93.8	Very high	88.4	Confident	65 Å²	65	62.7 Å²	62.7	26%	0.255	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-45.8	173.7	167.4	-104.2	0	0	0	111.9	F48 F49 A54 F55 H56 Y103 M110	F48-Y52 PolarHBondContact O-N 2.96Å; F49-Y52 HydrophobicContact CD2-CD1 4.38Å; F49-Y52 HydrophobicContact CE2-CD1 4.22Å; F49-Y52 PolarHBondContact O-N 2.85Å; Y52-A54 PolarHBondContact O-N 2.62Å; Y52-F55 WeakPolarHBondContact O-CB 3.12Å; Y52-F55 PolarHBondContact O-N 3.48Å; Y52-H56 WeakPolarHBondContact O-CB 3.45Å; Y52-H56 PolarHBondContact O-N 3.25Å; Y52-Y103 HydrophobicContact CD2-CE1 4.3Å; Y52-Y103 AromaticContact CD2-CE2 3.83Å; Y52-Y103 HydrophobicContact CD2-CE2 3.83Å; Y52-Y103 AromaticContact CD2-CZ 3.68Å; Y52-Y103 HydrophobicContact CG-CE2 4.37Å; Y52-M110 HydrophobicContact CD2-CB 4.48Å; Y52-M110 HydrophobicContact CD2-CG 3.82Å; Y52-M110 HydrophobicContact CE2-CB 4.3Å; Y52-M110 HydrophobicContact CE2-CG 3.99Å; Y52-M110 HydrophobicContact CG-CG 4.34Å
53	Q	93.7	Very high	88.3	Confident	88 Å²	88	68.5 Å²	68.5	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-44.3	-179.7	-172.9	173.3	12.2	0	0	111.4	F49 E50 F55 H56 D57	F49-Q53 WeakPolarHBondContact O-CB 3.4Å; F49-Q53 PolarHBondContact O-N 3.27Å; E50-Q53 PolarHBondContact O-N 2.93Å; Q53-F55 VanDerWaalsContact C-N 3.32Å; Q53-F55 PolarHBondContact O-N 3.1Å; Q53-H56 PolarHBondContact O-N 3.46Å; Q53-D57 WeakPolarHBondContact O-CB 3.39Å; Q53-D57 PolarHBondContact O-N 2.9Å
54	A	92.5	Very high	88.8	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-41.9	175.8	0	0	0	0	0	112	E50 N51 Y52 F58 K96 Q99 A100	E50-A54 WeakPolarHBondContact O-CB 3.15Å; E50-A54 PolarHBondContact O-N 3.12Å; N51-A54 PolarHBondContact O-N 2.79Å; Y52-A54 PolarHBondContact O-N 2.62Å; A54-F58 WeakPolarHBondContact O-CB 3.33Å; A54-F58 PolarHBondContact O-N 3.43Å; A54-K96 HydrophobicContact CB-CD 3.91Å; A54-Q99 HydrophobicContact CB-CB 3.67Å; A54-A100 HydrophobicContact CB-CB 4.44Å
55	F	94	Very high	88.6	Confident	14 Å²	14	72.1 Å²	72.1	6%	0.061	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-45.2	174.6	174.5	-96.8	0	0	0	112.5	N51 Y52 Q53 F58 C59 W67 L78 M82 A100 Y103 I104	N51-F55 PolarHBondContact O-N 3.43Å; Y52-F55 WeakPolarHBondContact O-CB 3.12Å; Y52-F55 PolarHBondContact O-N 3.48Å; Q53-F55 VanDerWaalsContact C-N 3.32Å; Q53-F55 PolarHBondContact O-N 3.1Å; F55-F58 WeakPolarHBondContact O-CB 3.38Å; F55-F58 PolarHBondContact O-N 3.39Å; F55-C59 VanDerWaalsContact CE1-SG 3.53Å; F55-C59 WeakPolarHBondContact CZ-SG 3.49Å; F55-C59 PolarHBondContact O-N 2.86Å; F55-C59 PolarHBondContact O-SG 3.48Å; F55-W67 HydrophobicContact CE2-CE3 4.23Å; F55-W67 HydrophobicContact CZ-CB 4.3Å; F55-W67 HydrophobicContact CZ-CE3 4.25Å; F55-L78 HydrophobicContact CE2-CD2 4.15Å; F55-M82 HydrophobicContact CD2-CE 3.8Å; F55-M82 HydrophobicContact CE2-CE 4.1Å; F55-A100 HydrophobicContact CB-CB 4.2Å; F55-Y103 HydrophobicContact CB-CD1 3.57Å; F55-Y103 HydrophobicContact CB-CE1 4.29Å; F55-Y103 HydrophobicContact CB-CG 4.07Å; F55-Y103 AromaticContact CD1-CD1 3.55Å; F55-Y103 HydrophobicContact CD1-CD1 3.55Å; F55-Y103 AromaticContact CD1-CE1 3.45Å; F55-Y103 HydrophobicContact CD1-CE1 3.45Å; F55-Y103 VanDerWaalsContact CD1-CE1 3.45Å; F55-Y103 AromaticContact CD2-CD1 3.86Å; F55-Y103 HydrophobicContact CD2-CD1 3.86Å; F55-Y103 HydrophobicContact CD2-CE1 4.46Å; F55-Y103 HydrophobicContact CE1-CD1 4.18Å; F55-Y103 AromaticContact CE1-CE1 3.82Å; F55-Y103 HydrophobicContact CE1-CE1 3.82Å; F55-Y103 HydrophobicContact CE2-CD1 4.45Å; F55-Y103 AromaticContact CG-CD1 3.36Å; F55-Y103 HydrophobicContact CG-CD1 3.36Å; F55-Y103 AromaticContact CG-CE1 3.82Å; F55-Y103 HydrophobicContact CG-CE1 3.82Å; F55-Y103 HydrophobicContact CG-CG 4.33Å; F55-Y103 HydrophobicContact CZ-CE1 4.47Å; F55-I104 HydrophobicContact CD2-CD1 4.2Å; F55-I104 HydrophobicContact CD2-CG1 3.94Å; F55-I104 HydrophobicContact CE2-CD1 3.96Å; F55-I104 HydrophobicContact CE2-CG1 3.78Å
56	H	92.2	Very high	88.7	Confident	94 Å²	94	70.5 Å²	70.5	44%	0.435	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-44.9	178.6	177.5	-86	0	0	0	111.4	Y52 Q53 F58 C59 S60	Y52-H56 WeakPolarHBondContact O-CB 3.45Å; Y52-H56 PolarHBondContact O-N 3.25Å; Q53-H56 PolarHBondContact O-N 3.46Å; H56-F58 VanDerWaalsContact C-N 3.3Å; H56-F58 PolarHBondContact O-N 3.08Å; H56-C59 PolarHBondContact O-N 3.36Å; H56-S60 WeakPolarHBondContact O-CB 3.26Å; H56-S60 PolarHBondContact O-N 2.93Å
57	D	91.9	Very high	89	Confident	70 Å²	70	64.4 Å²	64.4	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-59.5	-43.8	176.2	-68.3	-15.5	0	0	0	110.5	Q53 C59 S60 C61	Q53-D57 WeakPolarHBondContact O-CB 3.39Å; Q53-D57 PolarHBondContact O-N 2.9Å; D57-C59 PolarHBondContact O-N 2.92Å; D57-S60 PolarHBondContact O-N 2.82Å; D57-S60 PolarHBondContact O-OG 3.08Å; D57-C61 PolarHBondContact O-N 3.43Å; D57-C61 VanDerWaalsContact O-N 3.14Å; D57-C61 PolarHBondContact O-SG 3.37Å
58	F	90	Very high	88.9	Confident	17 Å²	17	67.7 Å²	67.7	8%	0.075	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-42.9	176.3	-156	-85	0	0	0	112.7	A54 F55 H56 R62 L78 A81 M82 Q85	A54-F58 WeakPolarHBondContact O-CB 3.33Å; A54-F58 PolarHBondContact O-N 3.43Å; F55-F58 WeakPolarHBondContact O-CB 3.38Å; F55-F58 PolarHBondContact O-N 3.39Å; H56-F58 VanDerWaalsContact C-N 3.3Å; H56-F58 PolarHBondContact O-N 3.08Å; F58-R62 PolarHBondContact O-N 3.3Å; F58-L78 HydrophobicContact CD1-CD1 3.77Å; F58-L78 HydrophobicContact CE1-CD1 3.76Å; F58-L78 HydrophobicContact CE1-CG 4.49Å; F58-A81 HydrophobicContact CE1-CB 4.16Å; F58-A81 HydrophobicContact CZ-CB 4.09Å; F58-M82 HydrophobicContact CB-CE 4.19Å; F58-M82 HydrophobicContact CD1-CE 3.51Å; F58-M82 HydrophobicContact CD1-CG 4.02Å; F58-M82 HydrophobicContact CD2-CG 4.25Å; F58-M82 HydrophobicContact CE1-CE 3.95Å; F58-M82 HydrophobicContact CE1-CG 3.57Å; F58-M82 HydrophobicContact CE2-CG 3.8Å; F58-M82 HydrophobicContact CG-CE 3.85Å; F58-M82 HydrophobicContact CG-CG 4.34Å; F58-M82 HydrophobicContact CZ-CB 4.22Å; F58-M82 HydrophobicContact CZ-CG 3.46Å; F58-M82 VanDerWaalsContact CZ-CG 3.46Å; F58-Q85 VanDerWaalsContact CE2-CD 3.42Å; F58-Q85 HydrophobicContact CE2-CG 4.31Å
59	C	89.8	Confident	88.7	Confident	15 Å²	15	73 Å²	73	10%	0.101	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-42.2	176.9	-69.6	0	0	0	0	112.1	F55 H56 D57 C61 R62 R63 F64	F55-C59 VanDerWaalsContact CE1-SG 3.53Å; F55-C59 WeakPolarHBondContact CZ-SG 3.49Å; F55-C59 PolarHBondContact O-N 2.86Å; F55-C59 PolarHBondContact O-SG 3.48Å; H56-C59 PolarHBondContact O-N 3.36Å; D57-C59 PolarHBondContact O-N 2.92Å; C59-C61 PolarHBondContact O-N 3.25Å; C59-R62 PolarHBondContact O-N 3.32Å; C59-R63 PolarHBondContact O-N 3.02Å; C59-F64 HydrophobicContact CB-CB 4.17Å; C59-F64 PolarHBondContact O-N 3.42Å; C59-F64 VanDerWaalsContact O-N 3.12Å
60	S	88.3	Confident	88.5	Confident	71 Å²	71	67.3 Å²	67.3	50%	0.497	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-41.3	-179	77	0	0	0	0	112.1	H56 D57 R62 R63	H56-S60 WeakPolarHBondContact O-CB 3.26Å; H56-S60 PolarHBondContact O-N 2.93Å; D57-S60 PolarHBondContact O-N 2.82Å; D57-S60 PolarHBondContact O-OG 3.08Å; S60-R62 VanDerWaalsContact C-N 3.28Å; S60-R62 PolarHBondContact O-N 3.04Å; S60-R63 PolarHBondContact O-N 3.01Å
61	C	87.5	Confident	88.4	Confident	111 Å²	111	65.9 Å²	65.9	75%	0.75	34%	0.337	S	S	*	.	H	α-helix	trans	-65.2	-29.1	177.5	-74.7	0	0	0	0	113.2	D57 C59	D57-C61 PolarHBondContact O-N 3.43Å; D57-C61 VanDerWaalsContact O-N 3.14Å; D57-C61 PolarHBondContact O-SG 3.37Å; C59-C61 PolarHBondContact O-N 3.25Å
62	R	85.6	Confident	88.2	Confident	133 Å²	133	70.2 Å²	70.2	50%	0.502	35%	0.353	S	S	.	.	H	α-helix	trans	-103.7	2	-177.7	-67.4	-176.1	177.8	-110.6	0.4	114.5	F58 C59 S60 F64 A81	F58-R62 PolarHBondContact O-N 3.3Å; C59-R62 PolarHBondContact O-N 3.32Å; S60-R62 VanDerWaalsContact C-N 3.28Å; S60-R62 PolarHBondContact O-N 3.04Å; R62-F64 VanDerWaalsContact C-N 3.26Å; R62-F64 PolarHBondContact O-N 2.93Å; R62-A81 VanDerWaalsContact NH2-CB 3.32Å
63	R	82.7	Confident	88.1	Confident	235 Å²	235	71.3 Å²	71.3	89%	0.887	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	40.6	-175.7	-58	-179.9	178.6	164.4	0	112.9	C59 S60	C59-R63 PolarHBondContact O-N 3.02Å; S60-R63 PolarHBondContact O-N 3.01Å
64	F	85.3	Confident	88	Confident	40 Å²	40	71.9 Å²	71.9	18%	0.175	37%	0.371	C	S	.	.			trans	-76.4	131.4	178.1	-169	-102.6	0	0	0	110.5	C59 R62 G66 W67 S70 Q74 L78	C59-F64 HydrophobicContact CB-CB 4.17Å; C59-F64 PolarHBondContact O-N 3.42Å; C59-F64 VanDerWaalsContact O-N 3.12Å; R62-F64 VanDerWaalsContact C-N 3.26Å; R62-F64 PolarHBondContact O-N 2.93Å; F64-G66 VanDerWaalsContact C-N 3.35Å; F64-G66 VanDerWaalsContact CE1-C 3.4Å; F64-G66 VanDerWaalsContact CE1-O 3.32Å; F64-G66 WeakPolarHBondContact CE1-O 3.4Å; F64-G66 PolarHBondContact O-N 2.96Å; F64-W67 HydrophobicContact CE1-CE3 4.4Å; F64-W67 HydrophobicContact CZ-CE3 4.5Å; F64-S70 VanDerWaalsContact CZ-OG 3.26Å; F64-S70 WeakPolarHBondContact CZ-OG 3.49Å; F64-Q74 HydrophobicContact CE2-CB 4.22Å; F64-L78 HydrophobicContact CD1-CD2 3.98Å; F64-L78 HydrophobicContact CD2-CD1 4.41Å; F64-L78 HydrophobicContact CD2-CD2 4.22Å; F64-L78 HydrophobicContact CE1-CD2 3.83Å; F64-L78 HydrophobicContact CE2-CB 4.32Å; F64-L78 HydrophobicContact CE2-CD2 4.09Å; F64-L78 HydrophobicContact CG-CD2 4.16Å; F64-L78 HydrophobicContact CZ-CD2 3.88Å
65	S	79.5	Confident	88	Confident	85 Å²	85	74.1 Å²	74.1	59%	0.594	38%	0.379	S	S	*	.			trans	-76.8	-16.1	-170.1	53.3	0	0	0	0	114.9
66	G	83.7	Confident	88	Confident	25 Å²	25	74.5 Å²	74.5	26%	0.258	38%	0.382	S	S	.	.			trans	137.5	148.8	179.4	0	0	0	0	0	112.5	F64 S70	F64-G66 VanDerWaalsContact C-N 3.35Å; F64-G66 VanDerWaalsContact CE1-C 3.4Å; F64-G66 VanDerWaalsContact CE1-O 3.32Å; F64-G66 WeakPolarHBondContact CE1-O 3.4Å; F64-G66 PolarHBondContact O-N 2.96Å; G66-S70 WeakPolarHBondContact O-CB 3.36Å; G66-S70 PolarHBondContact O-N 3Å; G66-S70 PolarHBondContact O-OG 3.5Å
67	W	88.1	Confident	88	Confident	3 Å²	3	73.7 Å²	73.7	1%	0.011	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-56.2	-172	-172.2	-103.3	0	0	0	112.2	F55 F64 Q69 S70 R75 L78 V79 I104 C108 N125 L128	F55-W67 HydrophobicContact CE2-CE3 4.23Å; F55-W67 HydrophobicContact CZ-CB 4.3Å; F55-W67 HydrophobicContact CZ-CE3 4.25Å; F64-W67 HydrophobicContact CE1-CE3 4.4Å; F64-W67 HydrophobicContact CZ-CE3 4.5Å; W67-Q69 VanDerWaalsContact C-N 3.31Å; W67-Q69 PolarHBondContact O-N 3.42Å; W67-S70 PolarHBondContact O-N 3.49Å; W67-S70 PolarHBondContact O-OG 2.88Å; W67-R75 HydrophobicContact CD2-CG 4.37Å; W67-R75 HydrophobicContact CE3-CG 4.24Å; W67-R75 HydrophobicContact CH2-CB 3.82Å; W67-R75 HydrophobicContact CH2-CG 4.16Å; W67-R75 HydrophobicContact CZ2-CB 4.26Å; W67-R75 HydrophobicContact CZ2-CG 4.28Å; W67-R75 HydrophobicContact CZ3-CB 4.01Å; W67-R75 HydrophobicContact CZ3-CG 4.13Å; W67-R75 PolarHBondContact O-NE 3.16Å; W67-R75 PolarHBondContact O-NH2 3.29Å; W67-L78 HydrophobicContact CE3-CD2 4.12Å; W67-L78 HydrophobicContact CZ3-CD2 4.01Å; W67-V79 HydrophobicContact CH2-CG2 3.87Å; W67-V79 HydrophobicContact CZ3-CG2 4.36Å; W67-I104 HydrophobicContact CE3-CD1 4.38Å; W67-I104 HydrophobicContact CE3-CG1 4.42Å; W67-I104 HydrophobicContact CH2-CD1 3.85Å; W67-I104 HydrophobicContact CH2-CG1 4.14Å; W67-I104 HydrophobicContact CH2-CG2 3.58Å; W67-I104 HydrophobicContact CZ2-CG2 3.49Å; W67-I104 VanDerWaalsContact CZ2-CG2 3.49Å; W67-I104 HydrophobicContact CZ3-CD1 3.68Å; W67-I104 HydrophobicContact CZ3-CG1 4.09Å; W67-I104 HydrophobicContact CZ3-CG2 4.37Å; W67-C108 HydrophobicContact CG-CB 4.37Å; W67-C108 VanDerWaalsContact CG-SG 3.56Å; W67-N125 WeakPolarHBondContact CZ2-OD1 3.44Å; W67-N125 PolarHBondContact NE1-OD1 3.26Å; W67-N125 VanDerWaalsContact NE1-OD1 3.16Å; W67-L128 HydrophobicContact CH2-CD2 4.42Å
68	Q	84.5	Confident	88.1	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.43	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.7	-177.4	-70.2	-174.3	-11.2	0	0	113.9	S70 R75 D111 H112	Q68-S70 VanDerWaalsContact C-N 3.33Å; Q68-R75 PolarHBondContact O-NH2 2.99Å; Q68-D111 HydrophobicContact CG-CB 3.95Å; Q68-D111 PolarHBondContact NE2-O 3.36Å; Q68-H112 PolarHBondContact NE2-CD2 3.46Å; Q68-H112 PolarHBondContact NE2-CE1 3.17Å; Q68-H112 PolarHBondContact NE2-ND1 2.8Å; Q68-H112 PolarHBondContact NE2-NE2 2.85Å; Q68-H112 VanDerWaalsContact NE2-NE2 3.13Å
69	Q	84.2	Confident	88.3	Confident	164 Å²	164	69.9 Å²	69.9	77%	0.766	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-18.1	-176.7	-62.1	172.6	27.2	0	0	113	W67	W67-Q69 VanDerWaalsContact C-N 3.31Å; W67-Q69 PolarHBondContact O-N 3.42Å
70	S	86.3	Confident	88.6	Confident	5 Å²	5	73.4 Å²	73.4	4%	0.035	38%	0.382	C	S	.	.	S	Bend	trans	-79.3	146.6	-177.4	67.5	0	0	0	0	112.5	F64 G66 W67 Q68 R75	F64-S70 VanDerWaalsContact CZ-OG 3.26Å; F64-S70 WeakPolarHBondContact CZ-OG 3.49Å; G66-S70 WeakPolarHBondContact O-CB 3.36Å; G66-S70 PolarHBondContact O-N 3Å; G66-S70 PolarHBondContact O-OG 3.5Å; W67-S70 PolarHBondContact O-N 3.49Å; W67-S70 PolarHBondContact O-OG 2.88Å; Q68-S70 VanDerWaalsContact C-N 3.33Å; S70-R75 PolarHBondContact O-NE 3.34Å; S70-R75 PolarHBondContact O-NH2 3.06Å; S70-R75 WeakPolarHBondContact OG-CG 3.43Å; S70-R75 PolarHBondContact OG-NE 3.24Å
71	A	89.5	Confident	88.9	Confident	50 Å²	50	70.2 Å²	70.2	41%	0.413	36%	0.36	S	S	.	.			trans	-74.3	153.1	174.7	0	0	0	0	0	111.2	P73 Q74 R75	A71-P73 VanDerWaalsContact C-CD 3.48Å; A71-P73 HydrophobicContact CB-CG 4.21Å; A71-Q74 WeakPolarHBondContact O-CA 3.48Å; A71-Q74 WeakPolarHBondContact O-CB 3.33Å; A71-Q74 PolarHBondContact O-N 2.88Å; A71-R75 PolarHBondContact O-N 3.41Å; A71-R75 VanDerWaalsContact O-N 3.09Å
72	R	89.6	Confident	89.2	Confident	94 Å²	94	65 Å²	65	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-43.3	-49.8	176.5	-173.9	178.4	176.8	99	2.7	114.5	Q74 R75 C76 L128 D131	R72-Q74 VanDerWaalsContact C-N 3.3Å; R72-Q74 PolarHBondContact O-N 3.14Å; R72-R75 WeakPolarHBondContact O-CB 3.49Å; R72-R75 PolarHBondContact O-N 3.06Å; R72-R75 VanDerWaalsContact O-N 3.13Å; R72-C76 PolarHBondContact O-N 2.73Å; R72-C76 PolarHBondContact O-SG 2.87Å; R72-C76 VanDerWaalsContact O-SG 3.34Å; R72-L128 HydrophobicContact CG-CD1 4.2Å; R72-D131 IonicContact CZ-OD2 3.08Å; R72-D131 IonicContact NH2-OD2 2.75Å; R72-D131 PolarHBondContact NH2-OD2 3.18Å
73	P	90.7	Very high	89.7	Confident	87 Å²	87	58.9 Å²	58.9	57%	0.565	30%	0.302	S	S	*	.	H	α-helix	trans	-61.9	-34.8	178.9	22.9	-34.7	0	0	0	113.3	A71 C76 C77	A71-P73 VanDerWaalsContact C-CD 3.48Å; A71-P73 HydrophobicContact CB-CG 4.21Å; P73-C76 PolarHBondContact O-N 3.42Å; P73-C77 PolarHBondContact O-N 3.09Å; P73-C77 PolarHBondContact O-SG 3.24Å
74	Q	91.4	Very high	90.3	Very high	101 Å²	101	53 Å²	53	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-36.9	176.2	-65.5	175	-30	0	0	111.6	F64 A71 R72 L78	F64-Q74 HydrophobicContact CE2-CB 4.22Å; A71-Q74 WeakPolarHBondContact O-CA 3.48Å; A71-Q74 WeakPolarHBondContact O-CB 3.33Å; A71-Q74 PolarHBondContact O-N 2.88Å; R72-Q74 VanDerWaalsContact C-N 3.3Å; R72-Q74 PolarHBondContact O-N 3.14Å; Q74-L78 PolarHBondContact O-N 3.33Å; Q74-L78 VanDerWaalsContact O-N 3.09Å
75	R	93	Very high	90.7	Very high	51 Å²	51	54 Å²	54	19%	0.192	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-44.2	173.1	-63.3	-179.3	-165.8	176.6	3.1	111.2	W67 Q68 S70 A71 R72 L78 V79 L128	W67-R75 HydrophobicContact CD2-CG 4.37Å; W67-R75 HydrophobicContact CE3-CG 4.24Å; W67-R75 HydrophobicContact CH2-CB 3.82Å; W67-R75 HydrophobicContact CH2-CG 4.16Å; W67-R75 HydrophobicContact CZ2-CB 4.26Å; W67-R75 HydrophobicContact CZ2-CG 4.28Å; W67-R75 HydrophobicContact CZ3-CB 4.01Å; W67-R75 HydrophobicContact CZ3-CG 4.13Å; W67-R75 PolarHBondContact O-NE 3.16Å; W67-R75 PolarHBondContact O-NH2 3.29Å; Q68-R75 PolarHBondContact O-NH2 2.99Å; S70-R75 PolarHBondContact O-NE 3.34Å; S70-R75 PolarHBondContact O-NH2 3.06Å; S70-R75 WeakPolarHBondContact OG-CG 3.43Å; S70-R75 PolarHBondContact OG-NE 3.24Å; A71-R75 PolarHBondContact O-N 3.41Å; A71-R75 VanDerWaalsContact O-N 3.09Å; R72-R75 WeakPolarHBondContact O-CB 3.49Å; R72-R75 PolarHBondContact O-N 3.06Å; R72-R75 VanDerWaalsContact O-N 3.13Å; R75-L78 WeakPolarHBondContact O-CB 3.44Å; R75-L78 PolarHBondContact O-N 2.98Å; R75-L78 VanDerWaalsContact O-N 3.16Å; R75-V79 WeakPolarHBondContact O-CG2 3.21Å; R75-V79 PolarHBondContact O-N 3.36Å; R75-L128 HydrophobicContact CB-CD1 3.7Å
76	C	93.7	Very high	91.3	Very high	21 Å²	21	50.3 Å²	50.3	14%	0.142	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-49.9	175.3	-67	0	0	0	0	111.5	R72 P73 L78 V79 E80 C132	R72-C76 PolarHBondContact O-N 2.73Å; R72-C76 PolarHBondContact O-SG 2.87Å; R72-C76 VanDerWaalsContact O-SG 3.34Å; P73-C76 PolarHBondContact O-N 3.42Å; C76-L78 PolarHBondContact O-N 3.46Å; C76-V79 PolarHBondContact O-N 3.46Å; C76-V79 VanDerWaalsContact O-N 3.1Å; C76-E80 WeakPolarHBondContact O-CB 3.44Å; C76-E80 WeakPolarHBondContact O-CG 3.47Å; C76-E80 PolarHBondContact O-N 3.28Å; C76-C132 VanDerWaalsContact CA-SG 3.58Å
77	C	93.5	Very high	91.7	Very high	78 Å²	78	55.5 Å²	55.5	53%	0.527	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-32.2	176.7	-66.6	0	0	0	0	113.1	P73 A81	P73-C77 PolarHBondContact O-N 3.09Å; P73-C77 PolarHBondContact O-SG 3.24Å; C77-A81 VanDerWaalsContact O-CB 3.25Å; C77-A81 WeakPolarHBondContact O-CB 3.32Å; C77-A81 PolarHBondContact O-N 2.94Å; C77-A81 VanDerWaalsContact O-N 3.15Å
78	L	92.9	Very high	91.9	Very high	7 Å²	7	57 Å²	57	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-71.5	-42.6	176.1	-170.6	68.9	0	0	0	111.6	F55 F58 F64 W67 Q74 R75 C76 A81 M82	F55-L78 HydrophobicContact CE2-CD2 4.15Å; F58-L78 HydrophobicContact CD1-CD1 3.77Å; F58-L78 HydrophobicContact CE1-CD1 3.76Å; F58-L78 HydrophobicContact CE1-CG 4.49Å; F64-L78 HydrophobicContact CD1-CD2 3.98Å; F64-L78 HydrophobicContact CD2-CD1 4.41Å; F64-L78 HydrophobicContact CD2-CD2 4.22Å; F64-L78 HydrophobicContact CE1-CD2 3.83Å; F64-L78 HydrophobicContact CE2-CB 4.32Å; F64-L78 HydrophobicContact CE2-CD2 4.09Å; F64-L78 HydrophobicContact CG-CD2 4.16Å; F64-L78 HydrophobicContact CZ-CD2 3.88Å; W67-L78 HydrophobicContact CE3-CD2 4.12Å; W67-L78 HydrophobicContact CZ3-CD2 4.01Å; Q74-L78 PolarHBondContact O-N 3.33Å; Q74-L78 VanDerWaalsContact O-N 3.09Å; R75-L78 WeakPolarHBondContact O-CB 3.44Å; R75-L78 PolarHBondContact O-N 2.98Å; R75-L78 VanDerWaalsContact O-N 3.16Å; C76-L78 PolarHBondContact O-N 3.46Å; L78-A81 WeakPolarHBondContact O-CB 3.33Å; L78-A81 PolarHBondContact O-N 3.04Å; L78-M82 HydrophobicContact CD1-CE 4.5Å; L78-M82 HydrophobicContact CD2-CE 4.2Å; L78-M82 HydrophobicContact CG-CE 4.01Å; L78-M82 WeakPolarHBondContact O-CG 3.48Å; L78-M82 PolarHBondContact O-N 3.29Å; L78-M82 VanDerWaalsContact O-N 3.13Å
79	V	95	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-48.2	177.2	172.8	0	0	0	0	110.7	W67 R75 C76 A81 M82 L83 L101 I104 L128 C132	W67-V79 HydrophobicContact CH2-CG2 3.87Å; W67-V79 HydrophobicContact CZ3-CG2 4.36Å; R75-V79 WeakPolarHBondContact O-CG2 3.21Å; R75-V79 PolarHBondContact O-N 3.36Å; C76-V79 PolarHBondContact O-N 3.46Å; C76-V79 VanDerWaalsContact O-N 3.1Å; V79-A81 PolarHBondContact O-N 2.86Å; V79-M82 CarbonylContact O-C 3.29Å; V79-M82 WeakPolarHBondContact O-CA 2.93Å; V79-M82 WeakPolarHBondContact O-CB 3.42Å; V79-M82 PolarHBondContact O-N 3.41Å; V79-L83 HydrophobicContact CG1-CD1 4.08Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CG 3.41Å; V79-L83 PolarHBondContact O-N 3.02Å; V79-L101 HydrophobicContact CG1-CD1 4.27Å; V79-I104 HydrophobicContact CG2-CD1 4.05Å; V79-L128 HydrophobicContact CB-CD2 4.22Å; V79-L128 HydrophobicContact CG2-CD2 3.63Å; V79-C132 HydrophobicContact CB-CB 4.31Å; V79-C132 HydrophobicContact CG1-CB 3.71Å
80	E	95.3	Very high	92.3	Very high	89 Å²	89	53.8 Å²	53.8	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-53.9	-42.8	174.6	-72	164.1	-170.1	0	0	111.4	C76 M82 L83 D84 C132	C76-E80 WeakPolarHBondContact O-CB 3.44Å; C76-E80 WeakPolarHBondContact O-CG 3.47Å; C76-E80 PolarHBondContact O-N 3.28Å; E80-M82 VanDerWaalsContact C-N 3.31Å; E80-M82 PolarHBondContact O-N 2.78Å; E80-L83 CarbonylContact O-C 3.55Å; E80-L83 WeakPolarHBondContact O-CB 3.12Å; E80-L83 PolarHBondContact O-N 2.97Å; E80-L83 VanDerWaalsContact O-N 3.16Å; E80-D84 VanDerWaalsContact O-CG 3.3Å; E80-D84 PolarHBondContact O-N 3.21Å; E80-C132 HydrophobicContact CG-CB 4.16Å
81	A	93.8	Very high	92.4	Very high	4 Å²	4	56.1 Å²	56.1	3%	0.033	32%	0.318	C	S	.	.	H	α-helix	trans	-63.1	-32.1	174.3	0	0	0	0	0	114.6	F58 R62 C77 L78 V79	F58-A81 HydrophobicContact CE1-CB 4.16Å; F58-A81 HydrophobicContact CZ-CB 4.09Å; R62-A81 VanDerWaalsContact NH2-CB 3.32Å; C77-A81 VanDerWaalsContact O-CB 3.25Å; C77-A81 WeakPolarHBondContact O-CB 3.32Å; C77-A81 PolarHBondContact O-N 2.94Å; C77-A81 VanDerWaalsContact O-N 3.15Å; L78-A81 WeakPolarHBondContact O-CB 3.33Å; L78-A81 PolarHBondContact O-N 3.04Å; V79-A81 PolarHBondContact O-N 2.86Å
82	M	94.5	Very high	92.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-73.9	-38.7	173.3	-68.1	173.8	179.8	0	0	110.5	F55 F58 L78 V79 E80 D84 Q85 L86 A100 I104	F55-M82 HydrophobicContact CD2-CE 3.8Å; F55-M82 HydrophobicContact CE2-CE 4.1Å; F58-M82 HydrophobicContact CB-CE 4.19Å; F58-M82 HydrophobicContact CD1-CE 3.51Å; F58-M82 HydrophobicContact CD1-CG 4.02Å; F58-M82 HydrophobicContact CD2-CG 4.25Å; F58-M82 HydrophobicContact CE1-CE 3.95Å; F58-M82 HydrophobicContact CE1-CG 3.57Å; F58-M82 HydrophobicContact CE2-CG 3.8Å; F58-M82 HydrophobicContact CG-CE 3.85Å; F58-M82 HydrophobicContact CG-CG 4.34Å; F58-M82 HydrophobicContact CZ-CB 4.22Å; F58-M82 HydrophobicContact CZ-CG 3.46Å; F58-M82 VanDerWaalsContact CZ-CG 3.46Å; L78-M82 HydrophobicContact CD1-CE 4.5Å; L78-M82 HydrophobicContact CD2-CE 4.2Å; L78-M82 HydrophobicContact CG-CE 4.01Å; L78-M82 WeakPolarHBondContact O-CG 3.48Å; L78-M82 PolarHBondContact O-N 3.29Å; L78-M82 VanDerWaalsContact O-N 3.13Å; V79-M82 CarbonylContact O-C 3.29Å; V79-M82 WeakPolarHBondContact O-CA 2.93Å; V79-M82 WeakPolarHBondContact O-CB 3.42Å; V79-M82 PolarHBondContact O-N 3.41Å; E80-M82 VanDerWaalsContact C-N 3.31Å; E80-M82 PolarHBondContact O-N 2.78Å; M82-D84 VanDerWaalsContact C-N 3.35Å; M82-Q85 PolarHBondContact O-N 2.85Å; M82-Q85 VanDerWaalsContact O-N 3.13Å; M82-L86 PolarHBondContact O-N 2.83Å; M82-A100 HydrophobicContact CE-CB 3.85Å; M82-A100 HydrophobicContact SD-CB 3.94Å; M82-I104 HydrophobicContact CE-CD1 3.89Å; M82-I104 HydrophobicContact SD-CD1 3.55Å; M82-I104 VanDerWaalsContact SD-CD1 3.55Å
83	L	95.7	Very high	92.5	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-40.3	174.6	-67.6	-178.5	0	0	0	111.8	V79 E80 Q85 L86 E87 L101 C132 A134 L137	V79-L83 HydrophobicContact CG1-CD1 4.08Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CG 3.41Å; V79-L83 PolarHBondContact O-N 3.02Å; E80-L83 CarbonylContact O-C 3.55Å; E80-L83 WeakPolarHBondContact O-CB 3.12Å; E80-L83 PolarHBondContact O-N 2.97Å; E80-L83 VanDerWaalsContact O-N 3.16Å; L83-Q85 VanDerWaalsContact C-N 3.26Å; L83-Q85 PolarHBondContact O-N 3.46Å; L83-L86 HydrophobicContact CD2-CD1 3.79Å; L83-L86 WeakPolarHBondContact O-CB 3.26Å; L83-L86 PolarHBondContact O-N 3.32Å; L83-L86 VanDerWaalsContact O-N 3.09Å; L83-E87 PolarHBondContact O-N 3.37Å; L83-L101 HydrophobicContact CD2-CD2 4.18Å; L83-C132 HydrophobicContact CD1-CB 4.04Å; L83-C132 WeakPolarHBondContact CD1-O 3.38Å; L83-A134 HydrophobicContact CD1-CB 4.12Å; L83-A134 HydrophobicContact CD2-CB 3.8Å; L83-L137 HydrophobicContact CB-CD1 3.53Å; L83-L137 HydrophobicContact CD1-CD1 4.14Å; L83-L137 HydrophobicContact CD2-CD1 3.89Å; L83-L137 HydrophobicContact CG-CD1 4.02Å
84	D	95.3	Very high	92.6	Very high	111 Å²	111	54.7 Å²	54.7	59%	0.594	31%	0.305	S	S	*	.	H	α-helix	trans	-59.3	-36.7	172.5	-66.8	-24	0	0	0	112.3	E80 M82 E87	E80-D84 VanDerWaalsContact O-CG 3.3Å; E80-D84 PolarHBondContact O-N 3.21Å; M82-D84 VanDerWaalsContact C-N 3.35Å; D84-E87 PolarHBondContact O-N 3.03Å
85	Q	93.8	Very high	92.7	Very high	63 Å²	63	51.7 Å²	51.7	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-76.8	-24.8	177.2	-71.9	-168	15.3	0	0	113.1	F58 M82 L83 E87 S88 V93 A97	F58-Q85 VanDerWaalsContact CE2-CD 3.42Å; F58-Q85 HydrophobicContact CE2-CG 4.31Å; M82-Q85 PolarHBondContact O-N 2.85Å; M82-Q85 VanDerWaalsContact O-N 3.13Å; L83-Q85 VanDerWaalsContact C-N 3.26Å; L83-Q85 PolarHBondContact O-N 3.46Å; Q85-E87 PolarHBondContact O-N 2.93Å; Q85-S88 WeakPolarHBondContact O-CB 3.35Å; Q85-S88 PolarHBondContact O-N 3.42Å; Q85-V93 HydrophobicContact CB-CG1 4.05Å; Q85-V93 HydrophobicContact CG-CG1 4.27Å; Q85-A97 HydrophobicContact CB-CB 3.65Å
86	L	93	Very high	92.7	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-66.9	-25.9	172.3	-84.9	153	0	0	0	112.3	M82 L83 S88 R94 A97 L98 L101 V141	M82-L86 PolarHBondContact O-N 2.83Å; L83-L86 HydrophobicContact CD2-CD1 3.79Å; L83-L86 WeakPolarHBondContact O-CB 3.26Å; L83-L86 PolarHBondContact O-N 3.32Å; L83-L86 VanDerWaalsContact O-N 3.09Å; L86-S88 VanDerWaalsContact C-N 3.27Å; L86-S88 PolarHBondContact O-N 3.23Å; L86-R94 WeakPolarHBondContact O-CD 3.32Å; L86-R94 WeakPolarHBondContact O-CG 3.4Å; L86-A97 HydrophobicContact CG-CB 3.97Å; L86-L98 HydrophobicContact CD2-CB 3.88Å; L86-L98 HydrophobicContact CD2-CD1 4.11Å; L86-L101 HydrophobicContact CD1-CD2 3.86Å; L86-V141 HydrophobicContact CD2-CG2 4.27Å
87	E	92.6	Very high	92.8	Very high	134 Å²	134	52.6 Å²	52.6	63%	0.626	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.9	173.4	-64.1	-172.2	163.7	0	0	113.8	L83 D84 Q85 L137	L83-E87 PolarHBondContact O-N 3.37Å; D84-E87 PolarHBondContact O-N 3.03Å; Q85-E87 PolarHBondContact O-N 2.93Å; E87-L137 HydrophobicContact CG-CD2 3.79Å; E87-L137 WeakPolarHBondContact OE1-CD2 3.07Å
88	S	92.2	Very high	92.9	Very high	35 Å²	35	48.9 Å²	48.9	25%	0.245	27%	0.27	C	S	.	.			trans	-60.7	142.6	-177.3	-178	0	0	0	0	112.7	Q85 L86 V90 R94	Q85-S88 WeakPolarHBondContact O-CB 3.35Å; Q85-S88 PolarHBondContact O-N 3.42Å; L86-S88 VanDerWaalsContact C-N 3.27Å; L86-S88 PolarHBondContact O-N 3.23Å; S88-V90 PolarHBondContact O-N 3.25Å; S88-V90 PolarHBondContact OG-N 2.75Å; S88-R94 WeakPolarHBondContact O-CD 3.3Å; S88-R94 WeakPolarHBondContact O-CG 3.25Å; S88-R94 PolarHBondContact O-NH1 3.47Å
89	S	87.2	Confident	93	Very high	114 Å²	114	48.7 Å²	48.7	80%	0.797	27%	0.269	S	S	*	.	S	Bend	trans	-67	-21.6	172.7	58.5	0	0	0	0	113.1	R94	S89-R94 VanDerWaalsContact C-NH1 3.29Å; S89-R94 PolarHBondContact O-NH1 3.01Å
90	V	89.9	Confident	93	Very high	73 Å²	73	48.7 Å²	48.7	44%	0.442	27%	0.269	S	S	.	.			trans	-85	117	-177.5	-176	0	0	0	0	110.8	S88 D92 V93 R94	S88-V90 PolarHBondContact O-N 3.25Å; S88-V90 PolarHBondContact OG-N 2.75Å; V90-D92 PolarHBondContact O-N 3.07Å; V90-V93 HydrophobicContact CB-CB 4.22Å; V90-V93 HydrophobicContact CB-CG2 3.97Å; V90-V93 HydrophobicContact CG1-CB 4.44Å; V90-V93 HydrophobicContact CG1-CG2 3.89Å; V90-V93 PolarHBondContact O-N 3.38Å; V90-R94 PolarHBondContact O-N 3.19Å; V90-R94 VanDerWaalsContact O-N 3.14Å
91	A	87.6	Confident	93.1	Very high	55 Å²	55	44.5 Å²	44.5	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-42.9	-175.6	0	0	0	0	0	113.8	V93 R94 L95	A91-V93 VanDerWaalsContact C-N 3.3Å; A91-V93 PolarHBondContact O-N 3.23Å; A91-R94 PolarHBondContact O-N 2.85Å; A91-L95 WeakPolarHBondContact O-CB 3.32Å; A91-L95 PolarHBondContact O-N 3.33Å
92	D	89.8	Confident	93.2	Very high	122 Å²	122	44.4 Å²	44.4	65%	0.652	25%	0.249	S	C	*	.	H	α-helix	trans	-63.3	-37.2	-179.8	-64.8	-33	0	0	0	112.5	V90 L95 K96	V90-D92 PolarHBondContact O-N 3.07Å; D92-L95 PolarHBondContact O-N 3.45Å; D92-K96 WeakPolarHBondContact O-CG 3.33Å; D92-K96 PolarHBondContact O-N 3.33Å
93	V	92	Very high	93.3	Very high	52 Å²	52	44.4 Å²	44.4	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-44.9	177	176.4	0	0	0	0	110.1	Q85 V90 A91 L95 K96 A97	Q85-V93 HydrophobicContact CB-CG1 4.05Å; Q85-V93 HydrophobicContact CG-CG1 4.27Å; V90-V93 HydrophobicContact CB-CB 4.22Å; V90-V93 HydrophobicContact CB-CG2 3.97Å; V90-V93 HydrophobicContact CG1-CB 4.44Å; V90-V93 HydrophobicContact CG1-CG2 3.89Å; V90-V93 PolarHBondContact O-N 3.38Å; A91-V93 VanDerWaalsContact C-N 3.3Å; A91-V93 PolarHBondContact O-N 3.23Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 3.41Å; V93-K96 PolarHBondContact O-N 3.3Å; V93-A97 WeakPolarHBondContact O-CB 3.41Å; V93-A97 PolarHBondContact O-N 2.94Å
94	R	92.8	Very high	93.3	Very high	26 Å²	26	44.2 Å²	44.2	10%	0.098	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-44.5	175	-66	-162.4	-58.2	-84.5	4.6	111.9	L86 S88 S89 V90 A91 A97 L98 E145	L86-R94 WeakPolarHBondContact O-CD 3.32Å; L86-R94 WeakPolarHBondContact O-CG 3.4Å; S88-R94 WeakPolarHBondContact O-CD 3.3Å; S88-R94 WeakPolarHBondContact O-CG 3.25Å; S88-R94 PolarHBondContact O-NH1 3.47Å; S89-R94 VanDerWaalsContact C-NH1 3.29Å; S89-R94 PolarHBondContact O-NH1 3.01Å; V90-R94 PolarHBondContact O-N 3.19Å; V90-R94 VanDerWaalsContact O-N 3.14Å; A91-R94 PolarHBondContact O-N 2.85Å; R94-A97 PolarHBondContact O-N 3.14Å; R94-L98 WeakPolarHBondContact O-CB 3.41Å; R94-L98 PolarHBondContact O-N 3.05Å; R94-E145 IonicContact NH2-OE1 3.29Å
95	L	92.4	Very high	93.3	Very high	39 Å²	39	39 Å²	39	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-46.5	179.1	174.7	60.6	0	0	0	111	A91 D92 V93 A97 L98 Q99 V179 L182	A91-L95 WeakPolarHBondContact O-CB 3.32Å; A91-L95 PolarHBondContact O-N 3.33Å; D92-L95 PolarHBondContact O-N 3.45Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 3.41Å; L95-A97 VanDerWaalsContact C-N 3.34Å; L95-A97 PolarHBondContact O-N 2.82Å; L95-L98 PolarHBondContact O-N 2.8Å; L95-Q99 HydrophobicContact CD1-CG 4.14Å; L95-Q99 HydrophobicContact CG-CG 4.46Å; L95-Q99 WeakPolarHBondContact O-CB 3.41Å; L95-Q99 VanDerWaalsContact O-CG 3.31Å; L95-Q99 WeakPolarHBondContact O-CG 3.27Å; L95-Q99 PolarHBondContact O-N 3.23Å; L95-V179 HydrophobicContact CD1-CG2 4.15Å; L95-L182 HydrophobicContact CD1-CD1 3.91Å
96	K	93.9	Very high	93.3	Very high	90 Å²	90	36.6 Å²	36.6	39%	0.391	21%	0.208	S	C	.	.	H	α-helix	trans	-62.9	-40	177.5	-74.6	-72.3	169.8	-158.5	0	112.5	A54 D92 V93 Q99 A100	A54-K96 HydrophobicContact CB-CD 3.91Å; D92-K96 WeakPolarHBondContact O-CG 3.33Å; D92-K96 PolarHBondContact O-N 3.33Å; V93-K96 PolarHBondContact O-N 3.3Å; K96-Q99 VanDerWaalsContact NZ-OE1 3.11Å; K96-Q99 PolarHBondContact O-N 2.67Å; K96-A100 WeakPolarHBondContact O-CB 3.3Å; K96-A100 PolarHBondContact O-N 2.87Å
97	A	95.2	Very high	93.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.4	-41.6	174.4	0	0	0	0	0	112	Q85 L86 V93 R94 L95 A100 L101	Q85-A97 HydrophobicContact CB-CB 3.65Å; L86-A97 HydrophobicContact CG-CB 3.97Å; V93-A97 WeakPolarHBondContact O-CB 3.41Å; V93-A97 PolarHBondContact O-N 2.94Å; R94-A97 PolarHBondContact O-N 3.14Å; L95-A97 VanDerWaalsContact C-N 3.34Å; L95-A97 PolarHBondContact O-N 2.82Å; A97-A100 PolarHBondContact O-N 3.38Å; A97-L101 WeakPolarHBondContact O-CB 3.46Å; A97-L101 PolarHBondContact O-N 3.19Å
98	L	95.6	Very high	93.3	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.4	-43	175.8	-172.6	60.1	0	0	0	112.3	L86 R94 L95 A100 L101 A102 L138 V179 L182 T183	L86-L98 HydrophobicContact CD2-CB 3.88Å; L86-L98 HydrophobicContact CD2-CD1 4.11Å; R94-L98 WeakPolarHBondContact O-CB 3.41Å; R94-L98 PolarHBondContact O-N 3.05Å; L95-L98 PolarHBondContact O-N 2.8Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-L101 PolarHBondContact O-N 3.43Å; L98-A102 WeakPolarHBondContact O-CB 3.22Å; L98-A102 PolarHBondContact O-N 3.26Å; L98-L138 HydrophobicContact CD1-CD2 3.93Å; L98-V179 HydrophobicContact CD2-CG1 3.82Å; L98-L182 HydrophobicContact CD2-CB 3.63Å; L98-L182 HydrophobicContact CD2-CD1 4.38Å; L98-L182 HydrophobicContact CG-CB 3.89Å; L98-L182 HydrophobicContact CG-CD1 4.46Å; L98-T183 WeakPolarHBondContact CD2-OG1 3.33Å
99	Q	95.7	Very high	93.2	Very high	3 Å²	3	30.8 Å²	30.8	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-44.8	174.8	-77.7	-171.5	-46.6	0	0	111.3	E50 N51 A54 L95 K96 A102 Y103 L182	E50-Q99 PolarHBondContact OE2-NE2 3.37Å; N51-Q99 WeakPolarHBondContact CB-O 3.47Å; N51-Q99 WeakPolarHBondContact OD1-CB 3.39Å; N51-Q99 WeakPolarHBondContact OD1-CG 3.43Å; A54-Q99 HydrophobicContact CB-CB 3.67Å; L95-Q99 HydrophobicContact CD1-CG 4.14Å; L95-Q99 HydrophobicContact CG-CG 4.46Å; L95-Q99 WeakPolarHBondContact O-CB 3.41Å; L95-Q99 VanDerWaalsContact O-CG 3.31Å; L95-Q99 WeakPolarHBondContact O-CG 3.27Å; L95-Q99 PolarHBondContact O-N 3.23Å; K96-Q99 VanDerWaalsContact NZ-OE1 3.11Å; K96-Q99 PolarHBondContact O-N 2.67Å; Q99-A102 PolarHBondContact O-N 3.41Å; Q99-Y103 PolarHBondContact O-N 3.24Å; Q99-L182 HydrophobicContact CG-CD1 3.73Å
100	A	95.4	Very high	93.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-41.3	176.6	0	0	0	0	0	112.5	A54 F55 M82 K96 A97 L98 Y103 I104	A54-A100 HydrophobicContact CB-CB 4.44Å; F55-A100 HydrophobicContact CB-CB 4.2Å; M82-A100 HydrophobicContact CE-CB 3.85Å; M82-A100 HydrophobicContact SD-CB 3.94Å; K96-A100 WeakPolarHBondContact O-CB 3.3Å; K96-A100 PolarHBondContact O-N 2.87Å; A97-A100 PolarHBondContact O-N 3.38Å; L98-A100 VanDerWaalsContact C-N 3.34Å; A100-Y103 PolarHBondContact O-N 3.26Å; A100-I104 PolarHBondContact O-N 3.2Å
101	L	96.6	Very high	93.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-40.6	174.9	-177	65.4	0	0	0	111.7	V79 L83 L86 A97 L98 Y103 I104 L105 L138	V79-L101 HydrophobicContact CG1-CD1 4.27Å; L83-L101 HydrophobicContact CD2-CD2 4.18Å; L86-L101 HydrophobicContact CD1-CD2 3.86Å; A97-L101 WeakPolarHBondContact O-CB 3.46Å; A97-L101 PolarHBondContact O-N 3.19Å; L98-L101 PolarHBondContact O-N 3.43Å; L101-Y103 VanDerWaalsContact C-N 3.32Å; L101-Y103 PolarHBondContact O-N 3.29Å; L101-I104 PolarHBondContact O-N 3.13Å; L101-L105 HydrophobicContact CG-CD1 4.34Å; L101-L105 PolarHBondContact O-N 3.22Å; L101-L138 HydrophobicContact CD2-CD2 4.32Å
102	A	95.8	Very high	93.1	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-40.9	175.9	0	0	0	0	0	111.5	L98 Q99 I104 L105 Q106 L182	L98-A102 WeakPolarHBondContact O-CB 3.22Å; L98-A102 PolarHBondContact O-N 3.26Å; Q99-A102 PolarHBondContact O-N 3.41Å; A102-I104 PolarHBondContact O-N 3.48Å; A102-L105 PolarHBondContact O-N 3.35Å; A102-Q106 WeakPolarHBondContact O-CB 3.07Å; A102-Q106 WeakPolarHBondContact O-CG 3.34Å; A102-Q106 PolarHBondContact O-N 3.01Å; A102-L182 HydrophobicContact CB-CD2 4.09Å
103	Y	96.4	Very high	93	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-41	175	178.8	-104.3	0	0	0	112.9	Y52 F55 Q99 A100 L101 Q106 G107 C108 F109 M110	Y52-Y103 HydrophobicContact CD2-CE1 4.3Å; Y52-Y103 AromaticContact CD2-CE2 3.83Å; Y52-Y103 HydrophobicContact CD2-CE2 3.83Å; Y52-Y103 AromaticContact CD2-CZ 3.68Å; Y52-Y103 HydrophobicContact CG-CE2 4.37Å; F55-Y103 HydrophobicContact CB-CD1 3.57Å; F55-Y103 HydrophobicContact CB-CE1 4.29Å; F55-Y103 HydrophobicContact CB-CG 4.07Å; F55-Y103 AromaticContact CD1-CD1 3.55Å; F55-Y103 HydrophobicContact CD1-CD1 3.55Å; F55-Y103 AromaticContact CD1-CE1 3.45Å; F55-Y103 HydrophobicContact CD1-CE1 3.45Å; F55-Y103 VanDerWaalsContact CD1-CE1 3.45Å; F55-Y103 AromaticContact CD2-CD1 3.86Å; F55-Y103 HydrophobicContact CD2-CD1 3.86Å; F55-Y103 HydrophobicContact CD2-CE1 4.46Å; F55-Y103 HydrophobicContact CE1-CD1 4.18Å; F55-Y103 AromaticContact CE1-CE1 3.82Å; F55-Y103 HydrophobicContact CE1-CE1 3.82Å; F55-Y103 HydrophobicContact CE2-CD1 4.45Å; F55-Y103 AromaticContact CG-CD1 3.36Å; F55-Y103 HydrophobicContact CG-CD1 3.36Å; F55-Y103 AromaticContact CG-CE1 3.82Å; F55-Y103 HydrophobicContact CG-CE1 3.82Å; F55-Y103 HydrophobicContact CG-CG 4.33Å; F55-Y103 HydrophobicContact CZ-CE1 4.47Å; Q99-Y103 PolarHBondContact O-N 3.24Å; A100-Y103 PolarHBondContact O-N 3.26Å; L101-Y103 VanDerWaalsContact C-N 3.32Å; L101-Y103 PolarHBondContact O-N 3.29Å; Y103-Q106 WeakPolarHBondContact O-CB 3.07Å; Y103-Q106 PolarHBondContact O-N 2.91Å; Y103-G107 PolarHBondContact O-N 3.2Å; Y103-C108 HydrophobicContact CE1-CB 3.88Å; Y103-C108 PolarHBondContact O-N 3.02Å; Y103-F109 HydrophobicContact CD2-CD1 4.15Å; Y103-F109 AromaticContact CD2-CE1 3.63Å; Y103-F109 HydrophobicContact CD2-CE1 3.63Å; Y103-F109 HydrophobicContact CD2-CZ 4.21Å; Y103-F109 AromaticContact CE2-CD1 3.84Å; Y103-F109 HydrophobicContact CE2-CD1 3.84Å; Y103-F109 AromaticContact CE2-CE1 3.53Å; Y103-F109 HydrophobicContact CE2-CE1 3.53Å; Y103-F109 HydrophobicContact CE2-CE2 4.45Å; Y103-F109 HydrophobicContact CE2-CG 4.42Å; Y103-F109 AromaticContact CE2-CZ 3.87Å; Y103-F109 HydrophobicContact CE2-CZ 3.87Å; Y103-M110 HydrophobicContact CE2-CG 4.34Å; Y103-M110 WeakPolarHBondContact OH-CB 3.38Å; Y103-M110 PolarHBondContact OH-N 3.04Å
104	I	95.5	Very high	93	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-46.8	175.2	-68	170.3	0	0	0	110.6	F55 W67 V79 M82 A100 L101 A102 Q106 G107 N125	F55-I104 HydrophobicContact CD2-CD1 4.2Å; F55-I104 HydrophobicContact CD2-CG1 3.94Å; F55-I104 HydrophobicContact CE2-CD1 3.96Å; F55-I104 HydrophobicContact CE2-CG1 3.78Å; W67-I104 HydrophobicContact CE3-CD1 4.38Å; W67-I104 HydrophobicContact CE3-CG1 4.42Å; W67-I104 HydrophobicContact CH2-CD1 3.85Å; W67-I104 HydrophobicContact CH2-CG1 4.14Å; W67-I104 HydrophobicContact CH2-CG2 3.58Å; W67-I104 HydrophobicContact CZ2-CG2 3.49Å; W67-I104 VanDerWaalsContact CZ2-CG2 3.49Å; W67-I104 HydrophobicContact CZ3-CD1 3.68Å; W67-I104 HydrophobicContact CZ3-CG1 4.09Å; W67-I104 HydrophobicContact CZ3-CG2 4.37Å; V79-I104 HydrophobicContact CG2-CD1 4.05Å; M82-I104 HydrophobicContact CE-CD1 3.89Å; M82-I104 HydrophobicContact SD-CD1 3.55Å; M82-I104 VanDerWaalsContact SD-CD1 3.55Å; A100-I104 PolarHBondContact O-N 3.2Å; L101-I104 PolarHBondContact O-N 3.13Å; A102-I104 PolarHBondContact O-N 3.48Å; I104-Q106 VanDerWaalsContact C-N 3.26Å; I104-Q106 PolarHBondContact O-N 3.12Å; I104-G107 WeakPolarHBondContact O-CA 3.27Å; I104-G107 PolarHBondContact O-N 3.14Å; I104-N125 HydrophobicContact CG2-CB 4Å; I104-N125 PolarHBondContact O-ND2 3.46Å
105	L	96.2	Very high	92.8	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-25.2	177.7	-72	171.3	0	0	0	112.8	L101 A102 G107 I122 A126 C129 C186 T189 I190	L101-L105 HydrophobicContact CG-CD1 4.34Å; L101-L105 PolarHBondContact O-N 3.22Å; A102-L105 PolarHBondContact O-N 3.35Å; L105-G107 PolarHBondContact O-N 3.48Å; L105-I122 WeakPolarHBondContact O-CG2 3.27Å; L105-A126 HydrophobicContact CD2-CB 4.33Å; L105-C129 HydrophobicContact CD2-CB 3.99Å; L105-C186 HydrophobicContact CD1-CB 3.54Å; L105-T189 HydrophobicContact CB-CG2 4.3Å; L105-T189 WeakPolarHBondContact O-CG2 3.12Å; L105-I190 HydrophobicContact CD1-CD1 4.16Å; L105-I190 HydrophobicContact CD1-CG1 4.2Å; L105-I190 HydrophobicContact CD2-CD1 4.44Å; L105-I190 HydrophobicContact CD2-CG1 3.86Å
106	Q	94.5	Very high	92.7	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.056	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	1.2	168.9	-72.1	168.7	-12.4	0	0	113	Y40 F48 A102 Y103 I104 F109	Y40-Q106 WeakPolarHBondContact OH-CG 3.27Å; Y40-Q106 PolarHBondContact OH-NE2 2.58Å; F48-Q106 HydrophobicContact CE1-CG 4.5Å; A102-Q106 WeakPolarHBondContact O-CB 3.07Å; A102-Q106 WeakPolarHBondContact O-CG 3.34Å; A102-Q106 PolarHBondContact O-N 3.01Å; Y103-Q106 WeakPolarHBondContact O-CB 3.07Å; Y103-Q106 PolarHBondContact O-N 2.91Å; I104-Q106 VanDerWaalsContact C-N 3.26Å; I104-Q106 PolarHBondContact O-N 3.12Å; Q106-F109 HydrophobicContact CB-CD1 4.16Å
107	G	93	Very high	92.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	15.9	172.8	0	0	0	0	0	114.7	Y103 I104 L105 F109 H112 S121	Y103-G107 PolarHBondContact O-N 3.2Å; I104-G107 WeakPolarHBondContact O-CA 3.27Å; I104-G107 PolarHBondContact O-N 3.14Å; L105-G107 PolarHBondContact O-N 3.48Å; G107-F109 VanDerWaalsContact C-N 3.29Å; G107-F109 PolarHBondContact O-N 3.26Å; G107-H112 PolarHBondContact O-CD2 2.9Å; G107-H112 PolarHBondContact O-NE2 3.3Å; G107-S121 PolarHBondContact O-OG 3.49Å
108	C	91.8	Very high	92.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.			trans	50.6	49.8	-175.4	-61.9	0	0	0	0	111.9	W67 Y103 M110 D111	W67-C108 HydrophobicContact CG-CB 4.37Å; W67-C108 VanDerWaalsContact CG-SG 3.56Å; Y103-C108 HydrophobicContact CE1-CB 3.88Å; Y103-C108 PolarHBondContact O-N 3.02Å; C108-M110 PolarHBondContact O-N 3.49Å; C108-D111 PolarHBondContact O-N 2.94Å
109	F	90.5	Very high	92.3	Very high	55 Å²	55	45.4 Å²	45.4	24%	0.241	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-55.9	-19.9	-165.4	61	-97.2	0	0	0	116	F48 Y103 Q106 G107 D111 H112 L118	F48-F109 HydrophobicContact CB-CE1 4.49Å; F48-F109 HydrophobicContact CB-CZ 4.17Å; F48-F109 AromaticContact CD1-CE1 3.83Å; F48-F109 HydrophobicContact CD1-CE1 3.83Å; F48-F109 HydrophobicContact CD1-CZ 4.15Å; Y103-F109 HydrophobicContact CD2-CD1 4.15Å; Y103-F109 AromaticContact CD2-CE1 3.63Å; Y103-F109 HydrophobicContact CD2-CE1 3.63Å; Y103-F109 HydrophobicContact CD2-CZ 4.21Å; Y103-F109 AromaticContact CE2-CD1 3.84Å; Y103-F109 HydrophobicContact CE2-CD1 3.84Å; Y103-F109 AromaticContact CE2-CE1 3.53Å; Y103-F109 HydrophobicContact CE2-CE1 3.53Å; Y103-F109 HydrophobicContact CE2-CE2 4.45Å; Y103-F109 HydrophobicContact CE2-CG 4.42Å; Y103-F109 AromaticContact CE2-CZ 3.87Å; Y103-F109 HydrophobicContact CE2-CZ 3.87Å; Q106-F109 HydrophobicContact CB-CD1 4.16Å; G107-F109 VanDerWaalsContact C-N 3.29Å; G107-F109 PolarHBondContact O-N 3.26Å; F109-D111 PolarHBondContact O-N 3.15Å; F109-H112 PolarHBondContact O-N 2.68Å; F109-L118 HydrophobicContact CB-CD1 3.8Å; F109-L118 HydrophobicContact CB-CD2 4.18Å
110	M	88.7	Confident	92.1	Very high	110 Å²	110	51.9 Å²	51.9	54%	0.542	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-70.2	-17.3	175.6	-62.1	-70.3	-79.6	0	0	113.3	Y52 Y103 C108	Y52-M110 HydrophobicContact CD2-CB 4.48Å; Y52-M110 HydrophobicContact CD2-CG 3.82Å; Y52-M110 HydrophobicContact CE2-CB 4.3Å; Y52-M110 HydrophobicContact CE2-CG 3.99Å; Y52-M110 HydrophobicContact CG-CG 4.34Å; Y103-M110 HydrophobicContact CE2-CG 4.34Å; Y103-M110 WeakPolarHBondContact OH-CB 3.38Å; Y103-M110 PolarHBondContact OH-N 3.04Å; C108-M110 PolarHBondContact O-N 3.49Å
111	D	86.6	Confident	92	Very high	67 Å²	67	52.6 Å²	52.6	36%	0.358	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-93.2	-4.9	-178.3	-60.5	-19.5	0	0	0	112.8	Q68 C108 F109	Q68-D111 HydrophobicContact CG-CB 3.95Å; Q68-D111 PolarHBondContact NE2-O 3.36Å; C108-D111 PolarHBondContact O-N 2.94Å; F109-D111 PolarHBondContact O-N 3.15Å
112	H	87.6	Confident	91.9	Very high	40 Å²	40	53.2 Å²	53.2	19%	0.185	27%	0.273	C	S	.	.			trans	-120.9	131.6	-171.4	-66.4	-86.9	0	0	0	112.1	Q68 G107 F109 L118 S121	Q68-H112 PolarHBondContact NE2-CD2 3.46Å; Q68-H112 PolarHBondContact NE2-CE1 3.17Å; Q68-H112 PolarHBondContact NE2-ND1 2.8Å; Q68-H112 PolarHBondContact NE2-NE2 2.85Å; Q68-H112 VanDerWaalsContact NE2-NE2 3.13Å; G107-H112 PolarHBondContact O-CD2 2.9Å; G107-H112 PolarHBondContact O-NE2 3.3Å; F109-H112 PolarHBondContact O-N 2.68Å; H112-L118 HydrophobicContact CB-CB 4.31Å; H112-S121 WeakPolarHBondContact NE2-CB 3.4Å; H112-S121 PolarHBondContact NE2-OG 2.9Å
113	D	87.5	Confident	91.8	Very high	174 Å²	174	54.3 Å²	54.3	93%	0.93	28%	0.28	S	S	*	.	S	Bend	trans	-92.6	-23.2	177.5	-63.1	-44.1	0	0	0	113.4
114	T	91.3	Very high	91.5	Very high	83 Å²	83	55.7 Å²	55.7	51%	0.509	29%	0.29	S	S	.	.	S	Bend	trans	-113.9	143.9	-176.7	65.6	0	0	0	0	111.8	E116 A117 L118	T114-E116 PolarHBondContact O-N 2.95Å; T114-A117 PolarHBondContact O-N 3.37Å; T114-A117 VanDerWaalsContact OG1-CB 3.23Å; T114-A117 WeakPolarHBondContact OG1-CB 3.34Å; T114-A117 PolarHBondContact OG1-N 3.5Å; T114-L118 PolarHBondContact O-N 2.82Å; T114-L118 VanDerWaalsContact O-N 3.14Å
115	E	89.6	Confident	91.5	Very high	128 Å²	128	55.8 Å²	55.8	60%	0.598	29%	0.29	S	S	*	.	H	α-helix	trans	-64.1	-39.3	178.6	-175.8	175.8	177.7	0	0	112.1	A33 A117 L118 L119	A33-E115 VanDerWaalsContact CB-OE1 3.29Å; A33-E115 WeakPolarHBondContact CB-OE1 3.41Å; E115-A117 PolarHBondContact O-N 3.18Å; E115-L118 WeakPolarHBondContact O-CB 3.34Å; E115-L118 PolarHBondContact O-N 3.33Å; E115-L119 HydrophobicContact CG-CD1 4.16Å; E115-L119 HydrophobicContact CG-CG 4.4Å; E115-L119 WeakPolarHBondContact O-CG 3.44Å; E115-L119 PolarHBondContact O-N 3.2Å
116	E	89.7	Confident	91.4	Very high	164 Å²	164	55.7 Å²	55.7	77%	0.766	29%	0.29	S	S	*	.	H	α-helix	trans	-61.6	-46	179.2	-65.5	173.9	-179.2	0	0	112	T114 L118 L119 E120	T114-E116 PolarHBondContact O-N 2.95Å; E116-L118 VanDerWaalsContact C-N 3.28Å; E116-L118 PolarHBondContact O-N 2.71Å; E116-L119 PolarHBondContact O-N 3.25Å; E116-E120 PolarHBondContact O-N 2.96Å
117	A	90.3	Very high	91.5	Very high	32 Å²	32	55.2 Å²	55.2	26%	0.264	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-34	177.3	0	0	0	0	0	111.7	T114 E115 S121	T114-A117 PolarHBondContact O-N 3.37Å; T114-A117 VanDerWaalsContact OG1-CB 3.23Å; T114-A117 WeakPolarHBondContact OG1-CB 3.34Å; T114-A117 PolarHBondContact OG1-N 3.5Å; E115-A117 PolarHBondContact O-N 3.18Å; A117-S121 VanDerWaalsContact O-CB 3.32Å; A117-S121 WeakPolarHBondContact O-CB 3.34Å; A117-S121 PolarHBondContact O-N 3.48Å
118	L	93.6	Very high	91.5	Very high	40 Å²	40	55.4 Å²	55.4	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-64.6	-47.1	174	177.7	60.8	0	0	0	111.3	F109 H112 T114 E115 E116 E120 S121 I122	F109-L118 HydrophobicContact CB-CD1 3.8Å; F109-L118 HydrophobicContact CB-CD2 4.18Å; H112-L118 HydrophobicContact CB-CB 4.31Å; T114-L118 PolarHBondContact O-N 2.82Å; T114-L118 VanDerWaalsContact O-N 3.14Å; E115-L118 WeakPolarHBondContact O-CB 3.34Å; E115-L118 PolarHBondContact O-N 3.33Å; E116-L118 VanDerWaalsContact C-N 3.28Å; E116-L118 PolarHBondContact O-N 2.71Å; L118-E120 VanDerWaalsContact C-N 3.33Å; L118-E120 PolarHBondContact O-N 3.37Å; L118-S121 WeakPolarHBondContact O-CB 3.18Å; L118-S121 PolarHBondContact O-N 3.15Å; L118-I122 HydrophobicContact CD1-CD1 4.31Å; L118-I122 HydrophobicContact CD1-CG1 4.37Å; L118-I122 HydrophobicContact CG-CD1 4.04Å; L118-I122 VanDerWaalsContact O-CG1 3.28Å; L118-I122 WeakPolarHBondContact O-CG1 3.2Å; L118-I122 PolarHBondContact O-N 3.35Å
119	L	92.9	Very high	91.7	Very high	40 Å²	40	55.4 Å²	55.4	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-38.5	178.8	-68	171.6	0	0	0	112.1	L32 A33 L36 E115 E116 I122 S123	L32-L119 HydrophobicContact CD2-CD2 4.42Å; L32-L119 HydrophobicContact CG-CD2 4.31Å; A33-L119 HydrophobicContact CB-CD1 4.07Å; A33-L119 HydrophobicContact CB-CD2 4.2Å; L36-L119 HydrophobicContact CD1-CD2 4.04Å; E115-L119 HydrophobicContact CG-CD1 4.16Å; E115-L119 HydrophobicContact CG-CG 4.4Å; E115-L119 WeakPolarHBondContact O-CG 3.44Å; E115-L119 PolarHBondContact O-N 3.2Å; E116-L119 PolarHBondContact O-N 3.25Å; L119-I122 HydrophobicContact CD2-CD1 4.45Å; L119-I122 PolarHBondContact O-N 3.38Å; L119-S123 WeakPolarHBondContact O-CB 3.23Å; L119-S123 PolarHBondContact O-N 3.39Å
120	E	90.8	Very high	91.9	Very high	140 Å²	140	53.7 Å²	53.7	65%	0.654	28%	0.281	S	S	*	.	H	α-helix	trans	-64.1	-42.2	173.3	-171.8	176.6	-172.5	0	0	111.5	E116 L118 S123 S124	E116-E120 PolarHBondContact O-N 2.96Å; L118-E120 VanDerWaalsContact C-N 3.33Å; L118-E120 PolarHBondContact O-N 3.37Å; E120-S123 PolarHBondContact O-N 3.04Å; E120-S124 WeakPolarHBondContact O-CB 3.45Å; E120-S124 PolarHBondContact O-N 2.9Å
121	S	92.4	Very high	92.1	Very high	14 Å²	14	52 Å²	52	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-47.2	174.1	-176.5	0	0	0	0	111.8	G107 H112 A117 L118 S123 S124 N125	G107-S121 PolarHBondContact O-OG 3.49Å; H112-S121 WeakPolarHBondContact NE2-CB 3.4Å; H112-S121 PolarHBondContact NE2-OG 2.9Å; A117-S121 VanDerWaalsContact O-CB 3.32Å; A117-S121 WeakPolarHBondContact O-CB 3.34Å; A117-S121 PolarHBondContact O-N 3.48Å; L118-S121 WeakPolarHBondContact O-CB 3.18Å; L118-S121 PolarHBondContact O-N 3.15Å; S121-S123 VanDerWaalsContact C-N 3.32Å; S121-S123 PolarHBondContact O-N 3.02Å; S121-S124 PolarHBondContact O-N 3.37Å; S121-N125 VanDerWaalsContact O-CB 3.24Å; S121-N125 WeakPolarHBondContact O-CB 3.42Å; S121-N125 PolarHBondContact O-N 3.27Å; S121-N125 PolarHBondContact O-ND2 2.66Å; S121-N125 PolarHBondContact O-OD1 2.9Å; S121-N125 PolarHBondContact OG-ND2 2.87Å
122	I	95.1	Very high	92.5	Very high	14 Å²	14	49.7 Å²	49.7	7%	0.072	26%	0.263	C	S	.	.	H	α-helix	trans	-56.1	-48.6	175.7	-69.5	169.1	0	0	0	110.3	L36 L105 L118 L119 N125 A126 T189	L36-I122 HydrophobicContact CD1-CD1 4Å; L36-I122 HydrophobicContact CD1-CG2 3.93Å; L105-I122 WeakPolarHBondContact O-CG2 3.27Å; L118-I122 HydrophobicContact CD1-CD1 4.31Å; L118-I122 HydrophobicContact CD1-CG1 4.37Å; L118-I122 HydrophobicContact CG-CD1 4.04Å; L118-I122 VanDerWaalsContact O-CG1 3.28Å; L118-I122 WeakPolarHBondContact O-CG1 3.2Å; L118-I122 PolarHBondContact O-N 3.35Å; L119-I122 HydrophobicContact CD2-CD1 4.45Å; L119-I122 PolarHBondContact O-N 3.38Å; I122-N125 PolarHBondContact O-N 3.18Å; I122-A126 WeakPolarHBondContact O-CB 3.37Å; I122-A126 PolarHBondContact O-N 3.28Å; I122-T189 HydrophobicContact CG2-CG2 3.7Å
123	S	93.1	Very high	92.7	Very high	26 Å²	26	49.1 Å²	49.1	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-51.2	178.5	-177.1	0	0	0	0	111.3	L119 E120 S121 N125 A126 F127	L119-S123 WeakPolarHBondContact O-CB 3.23Å; L119-S123 PolarHBondContact O-N 3.39Å; E120-S123 PolarHBondContact O-N 3.04Å; S121-S123 VanDerWaalsContact C-N 3.32Å; S121-S123 PolarHBondContact O-N 3.02Å; S123-N125 VanDerWaalsContact C-N 3.34Å; S123-N125 PolarHBondContact O-N 3.48Å; S123-A126 WeakPolarHBondContact O-CB 3.43Å; S123-A126 PolarHBondContact O-N 2.98Å; S123-F127 WeakPolarHBondContact O-CD2 3.34Å; S123-F127 PolarHBondContact O-N 3.46Å
124	S	91.8	Very high	93.1	Very high	28 Å²	28	40.8 Å²	40.8	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-43.7	179.6	-170.6	0	0	0	0	112.4	E120 S121 A126 F127 L128	E120-S124 WeakPolarHBondContact O-CB 3.45Å; E120-S124 PolarHBondContact O-N 2.9Å; S121-S124 PolarHBondContact O-N 3.37Å; S124-A126 PolarHBondContact O-N 3.47Å; S124-F127 PolarHBondContact O-N 3.48Å; S124-L128 PolarHBondContact O-N 2.82Å
125	N	94.1	Very high	93.3	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.011	20%	0.2	C	C	.	.	H	α-helix	trans	-67.1	-36	179.2	-65.3	-14.5	0	0	0	111.7	W67 I104 S121 I122 S123 L128 C129	W67-N125 WeakPolarHBondContact CZ2-OD1 3.44Å; W67-N125 PolarHBondContact NE1-OD1 3.26Å; W67-N125 VanDerWaalsContact NE1-OD1 3.16Å; I104-N125 HydrophobicContact CG2-CB 4Å; I104-N125 PolarHBondContact O-ND2 3.46Å; S121-N125 VanDerWaalsContact O-CB 3.24Å; S121-N125 WeakPolarHBondContact O-CB 3.42Å; S121-N125 PolarHBondContact O-N 3.27Å; S121-N125 PolarHBondContact O-ND2 2.66Å; S121-N125 PolarHBondContact O-OD1 2.9Å; S121-N125 PolarHBondContact OG-ND2 2.87Å; I122-N125 PolarHBondContact O-N 3.18Å; S123-N125 VanDerWaalsContact C-N 3.34Å; S123-N125 PolarHBondContact O-N 3.48Å; N125-L128 PolarHBondContact O-N 3.35Å; N125-C129 WeakPolarHBondContact O-CB 3.33Å; N125-C129 PolarHBondContact O-N 2.99Å; N125-C129 PolarHBondContact O-SG 3.3Å
126	A	95.7	Very high	93.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-44.4	175.6	0	0	0	0	0	112.2	L105 I122 S123 S124 Y130 C193	L105-A126 HydrophobicContact CD2-CB 4.33Å; I122-A126 WeakPolarHBondContact O-CB 3.37Å; I122-A126 PolarHBondContact O-N 3.28Å; S123-A126 WeakPolarHBondContact O-CB 3.43Å; S123-A126 PolarHBondContact O-N 2.98Å; S124-A126 PolarHBondContact O-N 3.47Å; A126-Y130 PolarHBondContact O-N 3.13Å; A126-Y130 VanDerWaalsContact O-N 3.09Å; A126-C193 HydrophobicContact CB-CB 3.61Å
127	F	94.9	Very high	93.6	Very high	3 Å²	3	27 Å²	27	1%	0.013	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-46.8	174.1	-77.4	-78.5	0	0	0	111.8	S123 S124 C129 Y130 D131 V194 F197 R218 V221	S123-F127 WeakPolarHBondContact O-CD2 3.34Å; S123-F127 PolarHBondContact O-N 3.46Å; S124-F127 PolarHBondContact O-N 3.48Å; F127-C129 VanDerWaalsContact C-N 3.34Å; F127-C129 PolarHBondContact O-N 3.09Å; F127-Y130 PolarHBondContact O-N 2.86Å; F127-D131 PolarHBondContact O-N 2.79Å; F127-V194 HydrophobicContact CD1-CG2 4.23Å; F127-V194 HydrophobicContact CE1-CB 4.44Å; F127-V194 HydrophobicContact CE1-CG1 4.27Å; F127-V194 HydrophobicContact CE1-CG2 4.01Å; F127-V194 HydrophobicContact CZ-CB 4.48Å; F127-V194 HydrophobicContact CZ-CG2 4.25Å; F127-F197 HydrophobicContact CE2-CB 4.36Å; F127-F197 HydrophobicContact CZ-CB 3.67Å; F127-F197 HydrophobicContact CZ-CD1 4.45Å; F127-F197 HydrophobicContact CZ-CD2 4.31Å; F127-F197 AromaticContact CZ-CG 3.9Å; F127-F197 HydrophobicContact CZ-CG 3.9Å; F127-R218 HydrophobicContact CD1-CB 4.03Å; F127-R218 HydrophobicContact CD1-CG 3.76Å; F127-R218 HydrophobicContact CD2-CG 4.21Å; F127-R218 HydrophobicContact CE1-CB 3.69Å; F127-R218 HydrophobicContact CE1-CG 3.85Å; F127-R218 HydrophobicContact CE2-CG 4.33Å; F127-R218 HydrophobicContact CG-CG 3.97Å; F127-R218 HydrophobicContact CZ-CB 4.09Å; F127-R218 HydrophobicContact CZ-CG 4.16Å; F127-V221 HydrophobicContact CD1-CB 3.96Å; F127-V221 HydrophobicContact CD1-CG1 3.6Å; F127-V221 HydrophobicContact CD1-CG2 4.41Å; F127-V221 HydrophobicContact CE1-CB 4.2Å; F127-V221 HydrophobicContact CE1-CG1 3.9Å
128	L	93.8	Very high	93.9	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-59.8	-43.9	178.7	-174.8	151.2	0	0	0	112.1	W67 R72 R75 V79 S124 N125 Y130 D131 C132	W67-L128 HydrophobicContact CH2-CD2 4.42Å; R72-L128 HydrophobicContact CG-CD1 4.2Å; R75-L128 HydrophobicContact CB-CD1 3.7Å; V79-L128 HydrophobicContact CB-CD2 4.22Å; V79-L128 HydrophobicContact CG2-CD2 3.63Å; S124-L128 PolarHBondContact O-N 2.82Å; N125-L128 PolarHBondContact O-N 3.35Å; L128-Y130 VanDerWaalsContact C-N 3.33Å; L128-Y130 PolarHBondContact O-N 3.48Å; L128-D131 PolarHBondContact O-N 2.88Å; L128-C132 PolarHBondContact O-N 3.31Å; L128-C132 PolarHBondContact O-SG 3.37Å; L128-C132 VanDerWaalsContact O-SG 3.37Å
129	C	95.9	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-40.1	178.1	-68.2	0	0	0	0	111.4	L105 N125 F127 C132 G133 A134	L105-C129 HydrophobicContact CD2-CB 3.99Å; N125-C129 WeakPolarHBondContact O-CB 3.33Å; N125-C129 PolarHBondContact O-N 2.99Å; N125-C129 PolarHBondContact O-SG 3.3Å; F127-C129 VanDerWaalsContact C-N 3.34Å; F127-C129 PolarHBondContact O-N 3.09Å; C129-C132 PolarHBondContact O-N 3.03Å; C129-G133 PolarHBondContact O-N 3.15Å; C129-A134 HydrophobicContact CB-CB 4.01Å; C129-A134 WeakPolarHBondContact O-CB 3.31Å; C129-A134 PolarHBondContact O-N 2.7Å
130	Y	94.8	Very high	94	Very high	20 Å²	20	26.6 Å²	26.6	8%	0.078	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-45.6	175	-173.9	-87.4	0	0	0	111.4	A126 F127 L128 C132 G133 W135 I190 V221 S224 L225 E228	A126-Y130 PolarHBondContact O-N 3.13Å; A126-Y130 VanDerWaalsContact O-N 3.09Å; F127-Y130 PolarHBondContact O-N 2.86Å; L128-Y130 VanDerWaalsContact C-N 3.33Å; L128-Y130 PolarHBondContact O-N 3.48Å; Y130-C132 VanDerWaalsContact C-N 3.27Å; Y130-C132 PolarHBondContact O-N 2.85Å; Y130-G133 PolarHBondContact O-N 3.25Å; Y130-W135 HydrophobicContact CD2-CB 3.66Å; Y130-W135 HydrophobicContact CD2-CG 4.17Å; Y130-W135 HydrophobicContact CE2-CB 3.72Å; Y130-W135 AromaticContact CE2-CG 3.87Å; Y130-W135 HydrophobicContact CE2-CG 3.87Å; Y130-I190 HydrophobicContact CD2-CG2 4.15Å; Y130-V221 HydrophobicContact CD1-CB 4.13Å; Y130-V221 HydrophobicContact CD1-CG1 3.32Å; Y130-V221 HydrophobicContact CD1-CG2 4.07Å; Y130-V221 HydrophobicContact CE1-CB 4.39Å; Y130-V221 HydrophobicContact CE1-CG1 3.82Å; Y130-V221 HydrophobicContact CG-CG1 3.83Å; Y130-S224 VanDerWaalsContact OH-C 3.31Å; Y130-S224 VanDerWaalsContact OH-CB 3.27Å; Y130-S224 WeakPolarHBondContact OH-CB 3.42Å; Y130-S224 PolarHBondContact OH-OG 3.43Å; Y130-L225 HydrophobicContact CD2-CD1 4.25Å; Y130-L225 HydrophobicContact CE2-CB 3.86Å; Y130-L225 HydrophobicContact CE2-CD1 3.67Å; Y130-L225 HydrophobicContact CE2-CG 4.31Å; Y130-L225 WeakPolarHBondContact OH-CA 3.16Å; Y130-L225 PolarHBondContact OH-N 3.08Å; Y130-L225 VanDerWaalsContact OH-N 3.09Å; Y130-E228 PolarHBondContact OH-OE1 3.3Å
131	D	92.3	Very high	94	Very high	73 Å²	73	20.5 Å²	20.5	39%	0.39	12%	0.123	S	C	.	.	H	α-helix	trans	-59.7	-35.9	177.7	-70.7	-31	0	0	0	112.9	R72 F127 L128 G133 V221	R72-D131 IonicContact CZ-OD2 3.08Å; R72-D131 IonicContact NH2-OD2 2.75Å; R72-D131 PolarHBondContact NH2-OD2 3.18Å; F127-D131 PolarHBondContact O-N 2.79Å; L128-D131 PolarHBondContact O-N 2.88Å; D131-G133 PolarHBondContact O-N 3.39Å; D131-V221 WeakPolarHBondContact OD1-CG2 3.25Å
132	C	94.6	Very high	94.1	Very high	20 Å²	20	19.9 Å²	19.9	14%	0.135	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-0.3	175.1	-68.8	0	0	0	0	113.9	C76 V79 E80 L83 L128 C129 Y130	C76-C132 VanDerWaalsContact CA-SG 3.58Å; V79-C132 HydrophobicContact CB-CB 4.31Å; V79-C132 HydrophobicContact CG1-CB 3.71Å; E80-C132 HydrophobicContact CG-CB 4.16Å; L83-C132 HydrophobicContact CD1-CB 4.04Å; L83-C132 WeakPolarHBondContact CD1-O 3.38Å; L128-C132 PolarHBondContact O-N 3.31Å; L128-C132 PolarHBondContact O-SG 3.37Å; L128-C132 VanDerWaalsContact O-SG 3.37Å; C129-C132 PolarHBondContact O-N 3.03Å; Y130-C132 VanDerWaalsContact C-N 3.27Å; Y130-C132 PolarHBondContact O-N 2.85Å
133	G	93.6	Very high	93.9	Very high	27 Å²	27	21.9 Å²	21.9	28%	0.278	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	19.8	-178.9	0	0	0	0	0	114.3	C129 Y130 D131 W135 S136	C129-G133 PolarHBondContact O-N 3.15Å; Y130-G133 PolarHBondContact O-N 3.25Å; D131-G133 PolarHBondContact O-N 3.39Å; G133-W135 PolarHBondContact O-N 3.17Å; G133-S136 PolarHBondContact O-OG 3.02Å
134	A	95.4	Very high	93.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-32.3	179.7	0	0	0	0	0	112.7	L83 C129 L137 L138	L83-A134 HydrophobicContact CD1-CB 4.12Å; L83-A134 HydrophobicContact CD2-CB 3.8Å; C129-A134 HydrophobicContact CB-CB 4.01Å; C129-A134 WeakPolarHBondContact O-CB 3.31Å; C129-A134 PolarHBondContact O-N 2.7Å; A134-L137 PolarHBondContact O-N 3.42Å; A134-L138 WeakPolarHBondContact O-CB 3.49Å; A134-L138 WeakPolarHBondContact O-CG 3.41Å; A134-L138 PolarHBondContact O-N 2.99Å
135	W	94.9	Very high	93.5	Very high	10 Å²	10	22.9 Å²	22.9	4%	0.038	13%	0.127	C	C	.	.	H	α-helix	trans	-64.2	-48.3	-175.7	178.4	-99.1	0	0	0	113.2	Y130 G133 L137 L138 C139 M187 I190 V191 L225 E228 L229 V238	Y130-W135 HydrophobicContact CD2-CB 3.66Å; Y130-W135 HydrophobicContact CD2-CG 4.17Å; Y130-W135 HydrophobicContact CE2-CB 3.72Å; Y130-W135 AromaticContact CE2-CG 3.87Å; Y130-W135 HydrophobicContact CE2-CG 3.87Å; G133-W135 PolarHBondContact O-N 3.17Å; W135-L137 VanDerWaalsContact C-N 3.31Å; W135-L137 PolarHBondContact O-N 3.42Å; W135-L138 PolarHBondContact O-N 2.87Å; W135-C139 PolarHBondContact O-N 3.16Å; W135-C139 PolarHBondContact O-SG 3.35Å; W135-C139 VanDerWaalsContact O-SG 3.4Å; W135-M187 HydrophobicContact CE3-CE 4.4Å; W135-M187 HydrophobicContact CH2-CE 3.78Å; W135-M187 HydrophobicContact CZ2-CE 4.17Å; W135-M187 HydrophobicContact CZ3-CB 3.92Å; W135-M187 HydrophobicContact CZ3-CE 3.9Å; W135-M187 HydrophobicContact CZ3-CG 4.16Å; W135-I190 HydrophobicContact CE3-CB 4.46Å; W135-I190 HydrophobicContact CE3-CG2 4.07Å; W135-V191 HydrophobicContact CH2-CG2 3.4Å; W135-V191 VanDerWaalsContact CH2-CG2 3.4Å; W135-V191 HydrophobicContact CZ2-CG2 4.47Å; W135-V191 HydrophobicContact CZ3-CG2 3.46Å; W135-V191 VanDerWaalsContact CZ3-CG2 3.46Å; W135-L225 HydrophobicContact CD2-CD1 3.75Å; W135-L225 HydrophobicContact CE3-CD1 4.13Å; W135-L225 HydrophobicContact CG-CD1 4.22Å; W135-L225 HydrophobicContact CH2-CD1 4.25Å; W135-L225 HydrophobicContact CZ2-CD1 3.87Å; W135-L225 HydrophobicContact CZ3-CD1 4.37Å; W135-E228 PolarHBondContact NE1-OE2 3.17Å; W135-E228 VanDerWaalsContact NE1-OE2 3.12Å; W135-L229 HydrophobicContact CH2-CD2 4.18Å; W135-L229 HydrophobicContact CZ2-CD2 3.7Å; W135-L229 HydrophobicContact CZ2-CG 4.49Å; W135-V238 HydrophobicContact CH2-CG1 4.18Å; W135-V238 HydrophobicContact CZ2-CB 4.49Å; W135-V238 HydrophobicContact CZ2-CG1 4Å
136	S	92.7	Very high	93.2	Very high	53 Å²	53	23.1 Å²	23.1	37%	0.371	13%	0.129	S	C	.	.	H	α-helix	trans	-61.6	-41	179	53.9	0	0	0	0	111.5	G133 C139 M140	G133-S136 PolarHBondContact O-OG 3.02Å; S136-C139 WeakPolarHBondContact O-CB 3.35Å; S136-C139 PolarHBondContact O-N 2.91Å; S136-M140 WeakPolarHBondContact O-CG 3.43Å; S136-M140 PolarHBondContact O-N 3.13Å; S136-M140 VanDerWaalsContact O-N 3.13Å
137	L	93.9	Very high	92.7	Very high	23 Å²	23	27.3 Å²	27.3	12%	0.12	15%	0.151	C	C	.	.	H	α-helix	trans	-68.4	-40.8	176.6	-69.9	173	0	0	0	112.8	L83 E87 A134 W135 C139 M140 V141	L83-L137 HydrophobicContact CB-CD1 3.53Å; L83-L137 HydrophobicContact CD1-CD1 4.14Å; L83-L137 HydrophobicContact CD2-CD1 3.89Å; L83-L137 HydrophobicContact CG-CD1 4.02Å; E87-L137 HydrophobicContact CG-CD2 3.79Å; E87-L137 WeakPolarHBondContact OE1-CD2 3.07Å; A134-L137 PolarHBondContact O-N 3.42Å; W135-L137 VanDerWaalsContact C-N 3.31Å; W135-L137 PolarHBondContact O-N 3.42Å; L137-C139 VanDerWaalsContact C-N 3.29Å; L137-C139 PolarHBondContact O-N 2.92Å; L137-M140 HydrophobicContact CD2-SD 4.3Å; L137-M140 PolarHBondContact O-N 3.3Å; L137-M140 VanDerWaalsContact O-N 3.15Å; L137-V141 WeakPolarHBondContact O-CG2 3.29Å; L137-V141 PolarHBondContact O-N 3.42Å
138	L	96	Very high	92.2	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-37.9	174.1	-73.3	168.4	0	0	0	111.6	L98 L101 A134 W135 V141 L142 T183 C186 M187 I190	L98-L138 HydrophobicContact CD1-CD2 3.93Å; L101-L138 HydrophobicContact CD2-CD2 4.32Å; A134-L138 WeakPolarHBondContact O-CB 3.49Å; A134-L138 WeakPolarHBondContact O-CG 3.41Å; A134-L138 PolarHBondContact O-N 2.99Å; W135-L138 PolarHBondContact O-N 2.87Å; L138-V141 PolarHBondContact O-N 3.15Å; L138-L142 VanDerWaalsContact O-CB 3.29Å; L138-L142 WeakPolarHBondContact O-CB 3.49Å; L138-L142 PolarHBondContact O-N 2.84Å; L138-T183 HydrophobicContact CD2-CG2 4.09Å; L138-C186 HydrophobicContact CD1-CB 3.93Å; L138-C186 HydrophobicContact CD2-CB 4Å; L138-M187 HydrophobicContact CB-CG 3.8Å; L138-M187 HydrophobicContact CB-SD 4.27Å; L138-M187 HydrophobicContact CD1-CG 4.06Å; L138-M187 HydrophobicContact CG-CG 4.42Å; L138-I190 HydrophobicContact CD1-CD1 3.7Å
139	C	94.5	Very high	91.4	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-43.2	172.8	-71.8	0	0	0	0	112.1	W135 S136 L137 L142 Q143 M187 L236	W135-C139 PolarHBondContact O-N 3.16Å; W135-C139 PolarHBondContact O-SG 3.35Å; W135-C139 VanDerWaalsContact O-SG 3.4Å; S136-C139 WeakPolarHBondContact O-CB 3.35Å; S136-C139 PolarHBondContact O-N 2.91Å; L137-C139 VanDerWaalsContact C-N 3.29Å; L137-C139 PolarHBondContact O-N 2.92Å; C139-L142 PolarHBondContact O-N 3.27Å; C139-Q143 PolarHBondContact O-N 2.88Å; C139-M187 VanDerWaalsContact SG-CE 3.55Å; C139-L236 HydrophobicContact CB-CD2 4.08Å
140	M	92.8	Very high	90.5	Very high	96 Å²	96	34.7 Å²	34.7	47%	0.473	18%	0.183	S	C	.	.	H	α-helix	trans	-65.1	-45	176.9	-67.3	179.4	-171	0	0	112	S136 L137 L142 Q143 M144 L236	S136-M140 WeakPolarHBondContact O-CG 3.43Å; S136-M140 PolarHBondContact O-N 3.13Å; S136-M140 VanDerWaalsContact O-N 3.13Å; L137-M140 HydrophobicContact CD2-SD 4.3Å; L137-M140 PolarHBondContact O-N 3.3Å; L137-M140 VanDerWaalsContact O-N 3.15Å; M140-L142 VanDerWaalsContact C-N 3.34Å; M140-L142 PolarHBondContact O-N 3.27Å; M140-Q143 PolarHBondContact O-N 2.84Å; M140-M144 WeakPolarHBondContact O-CB 3.17Å; M140-M144 PolarHBondContact O-N 3.45Å; M140-L236 HydrophobicContact CE-CD1 4.49Å; M140-L236 HydrophobicContact CG-CD2 3.98Å
141	V	92.5	Very high	89.7	Confident	11 Å²	11	39 Å²	39	7%	0.067	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-44.5	176.1	173.1	0	0	0	0	110.2	L86 L137 L138 Q143 M144 E145 V179 T183	L86-V141 HydrophobicContact CD2-CG2 4.27Å; L137-V141 WeakPolarHBondContact O-CG2 3.29Å; L137-V141 PolarHBondContact O-N 3.42Å; L138-V141 PolarHBondContact O-N 3.15Å; V141-Q143 PolarHBondContact O-N 3.16Å; V141-M144 PolarHBondContact O-N 3.05Å; V141-E145 HydrophobicContact CG1-CG 4.28Å; V141-E145 VanDerWaalsContact O-CG 3.27Å; V141-E145 WeakPolarHBondContact O-CG 3.4Å; V141-E145 PolarHBondContact O-N 3.41Å; V141-V179 HydrophobicContact CG1-CG1 4.41Å; V141-T183 HydrophobicContact CG1-CG2 4.39Å
142	L	93.4	Very high	88.7	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-58.8	-46.8	177.1	-179.4	64.6	0	0	0	111.6	L138 C139 M140 E145 I146 L180 T183 L184 M187 V238 V241 M245	L138-L142 VanDerWaalsContact O-CB 3.29Å; L138-L142 WeakPolarHBondContact O-CB 3.49Å; L138-L142 PolarHBondContact O-N 2.84Å; C139-L142 PolarHBondContact O-N 3.27Å; M140-L142 VanDerWaalsContact C-N 3.34Å; M140-L142 PolarHBondContact O-N 3.27Å; L142-E145 PolarHBondContact O-N 3.46Å; L142-I146 HydrophobicContact CD1-CD1 4Å; L142-I146 HydrophobicContact CD1-CG1 4.39Å; L142-I146 HydrophobicContact CD2-CD1 4.49Å; L142-I146 HydrophobicContact CG-CD1 3.79Å; L142-I146 WeakPolarHBondContact O-CB 3.46Å; L142-I146 WeakPolarHBondContact O-CD1 3.49Å; L142-I146 WeakPolarHBondContact O-CG1 3.3Å; L142-I146 PolarHBondContact O-N 2.96Å; L142-L180 HydrophobicContact CD1-CD2 3.91Å; L142-T183 HydrophobicContact CB-CG2 3.94Å; L142-T183 HydrophobicContact CD1-CG2 4.48Å; L142-L184 HydrophobicContact CD1-CD2 3.96Å; L142-L184 HydrophobicContact CD1-CG 4.22Å; L142-L184 HydrophobicContact CD2-CD2 4.27Å; L142-M187 HydrophobicContact CB-SD 4.37Å; L142-M187 HydrophobicContact CD2-CE 4.34Å; L142-M187 HydrophobicContact CD2-SD 3.88Å; L142-V238 HydrophobicContact CD2-CG2 3.87Å; L142-V241 HydrophobicContact CD2-CG1 4.34Å; L142-M245 HydrophobicContact CD1-SD 4.37Å
143	Q	91.2	Very high	87.6	Confident	55 Å²	55	38.9 Å²	38.9	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-45.4	178.1	-78.1	-178.5	-17.4	0	0	112.1	C139 M140 V141 E145 I146 D147 S235	C139-Q143 PolarHBondContact O-N 2.88Å; M140-Q143 PolarHBondContact O-N 2.84Å; V141-Q143 PolarHBondContact O-N 3.16Å; Q143-E145 VanDerWaalsContact C-N 3.34Å; Q143-E145 PolarHBondContact O-N 3.16Å; Q143-I146 PolarHBondContact O-N 3.37Å; Q143-D147 PolarHBondContact O-N 3.48Å; Q143-S235 PolarHBondContact NE2-O 3.2Å
144	M	88.9	Confident	86.5	Confident	62 Å²	62	41.2 Å²	41.2	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-58.1	-44.8	177.6	178.3	-173.7	69.5	0	0	112.1	M140 V141 D147 Q148	M140-M144 WeakPolarHBondContact O-CB 3.17Å; M140-M144 PolarHBondContact O-N 3.45Å; V141-M144 PolarHBondContact O-N 3.05Å; M144-D147 PolarHBondContact O-N 2.75Å; M144-Q148 VanDerWaalsContact O-CG 3.3Å; M144-Q148 WeakPolarHBondContact O-CG 3.25Å; M144-Q148 PolarHBondContact O-N 2.83Å
145	E	87.2	Confident	85.2	Confident	13 Å²	13	45.7 Å²	45.7	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-71.2	-31.6	179.7	-64.9	-63	149	0	0	112.4	R94 V141 L142 Q143 S149 V179 L180	R94-E145 IonicContact NH2-OE1 3.29Å; V141-E145 HydrophobicContact CG1-CG 4.28Å; V141-E145 VanDerWaalsContact O-CG 3.27Å; V141-E145 WeakPolarHBondContact O-CG 3.4Å; V141-E145 PolarHBondContact O-N 3.41Å; L142-E145 PolarHBondContact O-N 3.46Å; Q143-E145 VanDerWaalsContact C-N 3.34Å; Q143-E145 PolarHBondContact O-N 3.16Å; E145-S149 VanDerWaalsContact O-CB 3.27Å; E145-S149 WeakPolarHBondContact O-CB 3.47Å; E145-S149 PolarHBondContact O-N 3.02Å; E145-S149 PolarHBondContact O-OG 2.96Å; E145-V179 HydrophobicContact CG-CB 4.29Å; E145-V179 HydrophobicContact CG-CG1 3.7Å; E145-L180 HydrophobicContact CB-CD2 3.54Å; E145-L180 HydrophobicContact CB-CG 4.02Å
146	I	88.2	Confident	83.6	Confident	8 Å²	8	47.8 Å²	47.8	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-45.6	172.3	-73.5	166	0	0	0	110.9	L142 Q143 S149 W150 L180 V241 M245	L142-I146 HydrophobicContact CD1-CD1 4Å; L142-I146 HydrophobicContact CD1-CG1 4.39Å; L142-I146 HydrophobicContact CD2-CD1 4.49Å; L142-I146 HydrophobicContact CG-CD1 3.79Å; L142-I146 WeakPolarHBondContact O-CB 3.46Å; L142-I146 WeakPolarHBondContact O-CD1 3.49Å; L142-I146 WeakPolarHBondContact O-CG1 3.3Å; L142-I146 PolarHBondContact O-N 2.96Å; Q143-I146 PolarHBondContact O-N 3.37Å; I146-S149 WeakPolarHBondContact O-CB 3.38Å; I146-S149 PolarHBondContact O-N 3.23Å; I146-W150 WeakPolarHBondContact O-CB 3.48Å; I146-W150 PolarHBondContact O-N 3.2Å; I146-L180 HydrophobicContact CG1-CD2 4.3Å; I146-V241 HydrophobicContact CD1-CG1 3.33Å; I146-M245 HydrophobicContact CD1-CE 4.2Å; I146-M245 HydrophobicContact CD1-CG 3.67Å; I146-M245 HydrophobicContact CD1-SD 3.46Å; I146-M245 WeakPolarHBondContact CD1-SD 3.3Å; I146-M245 HydrophobicContact CG1-CE 4.09Å; I146-M245 HydrophobicContact CG1-CG 4.15Å; I146-M245 HydrophobicContact CG1-SD 4.01Å
147	D	86.2	Confident	81.8	Confident	88 Å²	88	49 Å²	49	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-66.6	-43.4	-178.9	-72.5	-19.7	0	0	0	111	Q143 M144 S149 W150 D151	Q143-D147 PolarHBondContact O-N 3.48Å; M144-D147 PolarHBondContact O-N 2.75Å; D147-S149 PolarHBondContact O-N 3.1Å; D147-W150 WeakPolarHBondContact O-CB 3.5Å; D147-W150 PolarHBondContact O-N 3.16Å; D147-W150 VanDerWaalsContact O-N 3.13Å; D147-D151 PolarHBondContact O-N 2.98Å
148	Q	82.7	Confident	79.9	Confident	81 Å²	81	53 Å²	53	38%	0.379	29%	0.294	S	S	.	.	H	α-helix	trans	-59.5	-47.7	173.2	-72.7	176.4	25.4	0	0	111.9	M144 W150 D151 I152	M144-Q148 VanDerWaalsContact O-CG 3.3Å; M144-Q148 WeakPolarHBondContact O-CG 3.25Å; M144-Q148 PolarHBondContact O-N 2.83Å; Q148-W150 PolarHBondContact O-N 3.28Å; Q148-D151 PolarHBondContact O-N 3.46Å; Q148-I152 WeakPolarHBondContact O-CD1 3.43Å; Q148-I152 VanDerWaalsContact O-CG1 3.27Å; Q148-I152 WeakPolarHBondContact O-CG1 3.47Å; Q148-I152 PolarHBondContact O-N 3.4Å; Q148-I152 VanDerWaalsContact O-N 3.15Å
149	S	78.5	Confident	77.6	Confident	4 Å²	4	63.7 Å²	63.7	3%	0.028	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-35.8	175.8	-71.9	0	0	0	0	112.5	E145 I146 D147 A153 H256	E145-S149 VanDerWaalsContact O-CB 3.27Å; E145-S149 WeakPolarHBondContact O-CB 3.47Å; E145-S149 PolarHBondContact O-N 3.02Å; E145-S149 PolarHBondContact O-OG 2.96Å; I146-S149 WeakPolarHBondContact O-CB 3.38Å; I146-S149 PolarHBondContact O-N 3.23Å; D147-S149 PolarHBondContact O-N 3.1Å; S149-A153 PolarHBondContact O-N 3.23Å; S149-H256 WeakPolarHBondContact CB-NE2 3.32Å; S149-H256 PolarHBondContact OG-NE2 2.85Å
150	W	77	Confident	75.3	Confident	76 Å²	76	65.7 Å²	65.7	29%	0.288	35%	0.348	S	S	.	.	H	α-helix	trans	-75.5	-43.5	-179.5	179.5	-107.6	0	0	0	112.7	I146 D147 Q148 I152 A153 C154 L253 V254	I146-W150 WeakPolarHBondContact O-CB 3.48Å; I146-W150 PolarHBondContact O-N 3.2Å; D147-W150 WeakPolarHBondContact O-CB 3.5Å; D147-W150 PolarHBondContact O-N 3.16Å; D147-W150 VanDerWaalsContact O-N 3.13Å; Q148-W150 PolarHBondContact O-N 3.28Å; W150-I152 VanDerWaalsContact C-N 3.27Å; W150-I152 PolarHBondContact O-N 3.25Å; W150-A153 HydrophobicContact CE3-CB 4.48Å; W150-A153 WeakPolarHBondContact O-CA 3.24Å; W150-A153 WeakPolarHBondContact O-CB 3.48Å; W150-A153 PolarHBondContact O-N 3.09Å; W150-C154 VanDerWaalsContact CZ2-SG 3.52Å; W150-C154 PolarHBondContact NE1-SG 3.16Å; W150-C154 PolarHBondContact O-N 2.99Å; W150-L253 HydrophobicContact CH2-CD1 3.99Å; W150-L253 HydrophobicContact CZ3-CB 4.07Å; W150-L253 HydrophobicContact CZ3-CD1 3.93Å; W150-V254 HydrophobicContact CE3-CG2 4.04Å; W150-V254 HydrophobicContact CZ3-CG2 4.31Å
151	D	76.3	Confident	73	Confident	109 Å²	109	63.2 Å²	63.2	58%	0.583	34%	0.337	S	S	*	.	H	α-helix	trans	-60	-40.6	177.5	-75.9	-17.7	0	0	0	111.2	D147 Q148 C154 S155	D147-D151 PolarHBondContact O-N 2.98Å; Q148-D151 PolarHBondContact O-N 3.46Å; D151-C154 PolarHBondContact O-N 2.92Å; D151-S155 WeakPolarHBondContact O-CB 3.38Å; D151-S155 PolarHBondContact O-N 3.16Å
152	I	73.2	Confident	70.4	Confident	80 Å²	80	73 Å²	73	41%	0.41	37%	0.373	S	S	.	.	H	α-helix	trans	-59.1	-50.3	172.3	-64.9	165	0	0	0	109.8	Q148 W150 C154 S155 L156	Q148-I152 WeakPolarHBondContact O-CD1 3.43Å; Q148-I152 VanDerWaalsContact O-CG1 3.27Å; Q148-I152 WeakPolarHBondContact O-CG1 3.47Å; Q148-I152 PolarHBondContact O-N 3.4Å; Q148-I152 VanDerWaalsContact O-N 3.15Å; W150-I152 VanDerWaalsContact C-N 3.27Å; W150-I152 PolarHBondContact O-N 3.25Å; I152-C154 VanDerWaalsContact C-N 3.31Å; I152-C154 PolarHBondContact O-N 3.05Å; I152-S155 PolarHBondContact O-N 3.17Å; I152-S155 PolarHBondContact O-OG 3.36Å; I152-L156 HydrophobicContact CG2-CD1 4.34Å; I152-L156 WeakPolarHBondContact O-CD1 3.49Å; I152-L156 PolarHBondContact O-N 3.4Å
153	A	69.8	Low	67.9	Low	11 Å²	11	76.5 Å²	76.5	9%	0.091	39%	0.394	C	S	.	.	H	α-helix	trans	-59.5	-38.1	179.4	0	0	0	0	0	113.2	S149 W150	S149-A153 PolarHBondContact O-N 3.23Å; W150-A153 HydrophobicContact CE3-CB 4.48Å; W150-A153 WeakPolarHBondContact O-CA 3.24Å; W150-A153 WeakPolarHBondContact O-CB 3.48Å; W150-A153 PolarHBondContact O-N 3.09Å
154	C	71.9	Confident	65.4	Low	76 Å²	76	77.2 Å²	77.2	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-74.4	-28.9	177.4	-79.1	0	0	0	0	113.9	W150 D151 I152 L156	W150-C154 VanDerWaalsContact CZ2-SG 3.52Å; W150-C154 PolarHBondContact NE1-SG 3.16Å; W150-C154 PolarHBondContact O-N 2.99Å; D151-C154 PolarHBondContact O-N 2.92Å; I152-C154 VanDerWaalsContact C-N 3.31Å; I152-C154 PolarHBondContact O-N 3.05Å; C154-L156 PolarHBondContact O-N 3.49Å
155	S	67.6	Low	63	Low	95 Å²	95	78.5 Å²	78.5	66%	0.664	41%	0.411	S	S	*	.	H	α-helix	trans	-70.7	-17.9	177.8	74.6	0	0	0	0	113.3	D151 I152	D151-S155 WeakPolarHBondContact O-CB 3.38Å; D151-S155 PolarHBondContact O-N 3.16Å; I152-S155 PolarHBondContact O-N 3.17Å; I152-S155 PolarHBondContact O-OG 3.36Å
156	L	62	Low	60.6	Low	53 Å²	53	81.3 Å²	81.3	28%	0.277	44%	0.444	S	S	.	.	S	Bend	trans	-80.8	136.6	-179.5	-76.6	142.9	0	0	0	111.7	I152 C154 F164	I152-L156 HydrophobicContact CG2-CD1 4.34Å; I152-L156 WeakPolarHBondContact O-CD1 3.49Å; I152-L156 PolarHBondContact O-N 3.4Å; C154-L156 PolarHBondContact O-N 3.49Å; L156-F164 HydrophobicContact CD1-CE2 4.19Å; L156-F164 HydrophobicContact CD2-CE2 4.32Å
157	P	54.7	Low	57.9	Low	78 Å²	78	84.2 Å²	84.2	51%	0.506	47%	0.465	S	S	.	.			trans	-62.2	144.9	176.4	22.1	-30.2	0	0	0	111.3	R159 S160	P157-R159 PolarHBondContact O-N 3.5Å; P157-S160 PolarHBondContact O-N 3.05Å
158	P	54.1	Low	55.5	Low	108 Å²	108	88.4 Å²	88.4	70%	0.701	48%	0.479	S	S	*	.	H	α-helix	trans	-61.1	-18.3	-169.9	19.2	-31.3	0	0	0	115.1
159	R	46	Very low	53.5	Low	226 Å²	226	87.6 Å²	87.6	85%	0.853	48%	0.479	S	S	*	.	H	α-helix	trans	-75.6	-32.7	171.5	-88	-176.8	167.9	142	-2.8	113	P157 V163	P157-R159 PolarHBondContact O-N 3.5Å; R159-V163 WeakPolarHBondContact O-CG2 3.23Å
160	S	47.3	Very low	51.6	Low	47 Å²	47	90.5 Å²	90.5	33%	0.329	50%	0.497	S	S	.	.	H	α-helix	trans	-75	-28.9	178.7	-66.6	0	0	0	0	112.7	P157 R162 V163 F164	P157-S160 PolarHBondContact O-N 3.05Å; S160-R162 VanDerWaalsContact C-N 3.29Å; S160-R162 PolarHBondContact O-N 2.79Å; S160-V163 PolarHBondContact O-N 3.27Å; S160-F164 PolarHBondContact O-N 2.94Å
161	L	43.6	Very low	49.8	Very low	45 Å²	45	89.2 Å²	89.2	24%	0.236	50%	0.499	C	S	.	.	H	α-helix	trans	-57.7	-36.1	175.9	-93.3	152.3	0	0	0	113.4
162	R	39.7	Very low	48.2	Very low	217 Å²	217	88.7 Å²	88.7	82%	0.819	50%	0.497	S	S	*	.	H	α-helix	trans	-78.3	-26.3	174.9	-69.7	-169	-151.4	-153.9	4.4	113.4	S160 F164 S165	S160-R162 VanDerWaalsContact C-N 3.29Å; S160-R162 PolarHBondContact O-N 2.79Å; R162-F164 PolarHBondContact O-N 3.16Å; R162-S165 PolarHBondContact O-N 3.39Å
163	V	39.2	Very low	47.3	Very low	75 Å²	75	85.5 Å²	85.5	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-68.9	-27.7	179.9	178.8	0	0	0	0	110.7	R159 S160 S165 G166 S167	R159-V163 WeakPolarHBondContact O-CG2 3.23Å; S160-V163 PolarHBondContact O-N 3.27Å; V163-S165 PolarHBondContact O-N 2.84Å; V163-S165 VanDerWaalsContact O-N 3.16Å; V163-G166 PolarHBondContact O-N 3.38Å; V163-S167 PolarHBondContact O-N 3.28Å
164	F	38.4	Very low	46.4	Very low	70 Å²	70	85.7 Å²	85.7	31%	0.307	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.2	172.2	-94.7	-81.2	0	0	0	114	L156 S160 R162 G166 P255	L156-F164 HydrophobicContact CD1-CE2 4.19Å; L156-F164 HydrophobicContact CD2-CE2 4.32Å; S160-F164 PolarHBondContact O-N 2.94Å; R162-F164 PolarHBondContact O-N 3.16Å; F164-G166 VanDerWaalsContact C-N 3.28Å; F164-G166 PolarHBondContact O-N 3.09Å; F164-P255 HydrophobicContact CB-CG 4.39Å
165	S	40.3	Very low	45.5	Very low	88 Å²	88	88.6 Å²	88.6	62%	0.615	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-15.6	173.8	-74.6	0	0	0	0	114.1	R162 V163	R162-S165 PolarHBondContact O-N 3.39Å; V163-S165 PolarHBondContact O-N 2.84Å; V163-S165 VanDerWaalsContact O-N 3.16Å
166	G	36.7	Very low	45	Very low	73 Å²	73	87 Å²	87	75%	0.753	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.1	-20.1	-169.8	0	0	0	0	0	117.8	V163 F164	V163-G166 PolarHBondContact O-N 3.38Å; F164-G166 VanDerWaalsContact C-N 3.28Å; F164-G166 PolarHBondContact O-N 3.09Å
167	S	31.3	Very low	45.6	Very low	69 Å²	69	84.6 Å²	84.6	48%	0.483	46%	0.456	S	S	.	.	S	Bend	trans	-151	121.5	-170.6	172.8	0	0	0	0	112.8	V163	V163-S167 PolarHBondContact O-N 3.28Å
168	K	35.6	Very low	47	Very low	176 Å²	176	81.5 Å²	81.5	77%	0.765	44%	0.435	S	S	*	.			trans	70.5	84.3	173.2	-65.8	-177.7	175.2	-175	0	114.9	T170	K168-T170 PolarHBondContact O-N 3.13Å; K168-T170 VanDerWaalsContact O-N 3.1Å
169	V	40	Very low	48.7	Very low	64 Å²	64	77.6 Å²	77.6	39%	0.388	41%	0.409	S	S	.	.			trans	-51.7	108.4	152.9	179.3	0	0	0	0	107.2	L174	V169-L174 HydrophobicContact CG1-CD1 3.37Å
170	T	38.5	Very low	50.8	Low	65 Å²	65	66.9 Å²	66.9	40%	0.399	37%	0.369	S	S	.	.			trans	-79.5	127.9	168.8	48.9	0	0	0	0	107.5	K168 D172 S173	K168-T170 PolarHBondContact O-N 3.13Å; K168-T170 VanDerWaalsContact O-N 3.1Å; T170-D172 PolarHBondContact O-N 2.92Å; T170-S173 PolarHBondContact O-N 2.76Å
171	S	40.1	Very low	52.9	Low	48 Å²	48	65.2 Å²	65.2	34%	0.336	36%	0.355	S	S	.	.	H	α-helix	trans	-41.7	-34.5	175	53.3	0	0	0	0	113.7	S173 L174	S171-S173 PolarHBondContact O-N 3.12Å; S171-L174 PolarHBondContact O-N 3.49Å
172	D	43.2	Very low	55.2	Low	99 Å²	99	63.4 Å²	63.4	53%	0.529	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-35.4	-177.5	-62.8	-18.5	0	0	0	112.8	T170 L174 K175 D176	T170-D172 PolarHBondContact O-N 2.92Å; D172-L174 VanDerWaalsContact C-N 3.28Å; D172-L174 PolarHBondContact O-N 2.85Å; D172-K175 PolarHBondContact O-N 2.92Å; D172-D176 PolarHBondContact O-N 3.32Å
173	S	53.5	Low	57.8	Low	12 Å²	12	53.1 Å²	53.1	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-72.3	-20.4	-178.6	-176.3	0	0	0	0	113.2	T170 S171 S177 H256 Y515	T170-S173 PolarHBondContact O-N 2.76Å; S171-S173 PolarHBondContact O-N 3.12Å; S173-S177 PolarHBondContact O-N 3.32Å; S173-H256 WeakPolarHBondContact OG-CB 3.46Å; S173-Y515 VanDerWaalsContact CB-OH 3.3Å; S173-Y515 WeakPolarHBondContact CB-OH 3.14Å; S173-Y515 PolarHBondContact OG-OH 3.32Å
174	L	50.9	Low	60.5	Low	16 Å²	16	49.5 Å²	49.5	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-78.8	-37.1	173	-93.1	124.9	0	0	0	112.2	V169 S171 D172 D176 S177 H178 Y515 Y520	V169-L174 HydrophobicContact CG1-CD1 3.37Å; S171-L174 PolarHBondContact O-N 3.49Å; D172-L174 VanDerWaalsContact C-N 3.28Å; D172-L174 PolarHBondContact O-N 2.85Å; L174-D176 VanDerWaalsContact C-N 3.3Å; L174-D176 PolarHBondContact O-N 3.08Å; L174-S177 WeakPolarHBondContact O-CB 3.28Å; L174-S177 PolarHBondContact O-N 2.92Å; L174-S177 VanDerWaalsContact O-N 3.09Å; L174-H178 PolarHBondContact O-N 2.84Å; L174-Y515 HydrophobicContact CG-CE1 4.19Å; L174-Y520 HydrophobicContact CB-CD1 4.34Å; L174-Y520 HydrophobicContact CB-CE1 3.78Å; L174-Y520 HydrophobicContact CD2-CE1 4.37Å
175	K	53.1	Low	63.3	Low	137 Å²	137	46.3 Å²	46.3	60%	0.596	27%	0.272	S	S	*	.	H	α-helix	trans	-61.2	-42.3	174	-70.1	-177.5	179	174.1	0	110.8	D172 S177 H178	D172-K175 PolarHBondContact O-N 2.92Å; K175-S177 PolarHBondContact O-N 3.38Å; K175-H178 WeakPolarHBondContact O-CB 3.33Å; K175-H178 PolarHBondContact O-N 3.45Å
176	D	57	Low	66	Low	60 Å²	60	42.3 Å²	42.3	32%	0.321	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-28.2	175.3	-63.7	-14.5	0	0	0	112.5	D172 L174	D172-D176 PolarHBondContact O-N 3.32Å; L174-D176 VanDerWaalsContact C-N 3.3Å; L174-D176 PolarHBondContact O-N 3.08Å
177	S	75	Confident	68.8	Low	3 Å²	3	38.8 Å²	38.8	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-76.7	-22.3	177	-161.5	0	0	0	0	112.9	S173 L174 K175 L180 R181 H256	S173-S177 PolarHBondContact O-N 3.32Å; L174-S177 WeakPolarHBondContact O-CB 3.28Å; L174-S177 PolarHBondContact O-N 2.92Å; L174-S177 VanDerWaalsContact O-N 3.09Å; K175-S177 PolarHBondContact O-N 3.38Å; S177-L180 PolarHBondContact O-N 3.47Å; S177-R181 WeakPolarHBondContact O-CB 3.32Å; S177-R181 VanDerWaalsContact O-CG 3.26Å; S177-R181 WeakPolarHBondContact O-CG 3.29Å; S177-R181 PolarHBondContact O-N 3.45Å; S177-H256 WeakPolarHBondContact CB-O 3.37Å; S177-H256 PolarHBondContact OG-O 3.19Å
178	H	83.2	Confident	72	Confident	14 Å²	14	35.5 Å²	35.5	7%	0.065	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-45.6	-174.8	-177.3	-130.9	0	0	0	112.9	E47 L174 K175 L180 R181 L182	E47-H178 IonicContact OE1-CD2 3.49Å; E47-H178 IonicContact OE2-CD2 3.12Å; E47-H178 IonicContact OE2-NE2 2.96Å; L174-H178 PolarHBondContact O-N 2.84Å; K175-H178 WeakPolarHBondContact O-CB 3.33Å; K175-H178 PolarHBondContact O-N 3.45Å; H178-L180 PolarHBondContact O-N 3.24Å; H178-R181 PolarHBondContact CD2-NH2 3.42Å; H178-R181 PolarHBondContact O-N 2.82Å; H178-L182 WeakPolarHBondContact NE2-CD1 3.23Å; H178-L182 PolarHBondContact O-N 3.29Å
179	V	89.4	Confident	74.9	Confident	26 Å²	26	27.3 Å²	27.3	16%	0.158	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-46.3	176.7	-174.7	0	0	0	0	110.1	L95 L98 V141 E145 R181 L182 T183	L95-V179 HydrophobicContact CD1-CG2 4.15Å; L98-V179 HydrophobicContact CD2-CG1 3.82Å; V141-V179 HydrophobicContact CG1-CG1 4.41Å; E145-V179 HydrophobicContact CG-CB 4.29Å; E145-V179 HydrophobicContact CG-CG1 3.7Å; V179-R181 VanDerWaalsContact C-N 3.32Å; V179-R181 PolarHBondContact O-N 3.4Å; V179-L182 PolarHBondContact O-N 3.41Å; V179-T183 WeakPolarHBondContact O-CB 3.4Å; V179-T183 PolarHBondContact O-N 2.99Å; V179-T183 PolarHBondContact O-OG1 3.02Å
180	L	90.2	Very high	77.6	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.6	-43.2	175.3	-73.4	172.6	0	0	0	112.1	L142 E145 I146 S177 H178 L184 Y257 P258	L142-L180 HydrophobicContact CD1-CD2 3.91Å; E145-L180 HydrophobicContact CB-CD2 3.54Å; E145-L180 HydrophobicContact CB-CG 4.02Å; I146-L180 HydrophobicContact CG1-CD2 4.3Å; S177-L180 PolarHBondContact O-N 3.47Å; H178-L180 PolarHBondContact O-N 3.24Å; L180-L184 WeakPolarHBondContact O-CB 3.39Å; L180-L184 WeakPolarHBondContact O-CD1 3.14Å; L180-L184 WeakPolarHBondContact O-CG 3.21Å; L180-L184 PolarHBondContact O-N 3.37Å; L180-Y257 HydrophobicContact CD1-CD1 3.87Å; L180-Y257 HydrophobicContact CD1-CE1 3.94Å; L180-P258 HydrophobicContact CB-CG 4.44Å
181	R	91.2	Very high	80.3	Confident	12 Å²	12	21.2 Å²	21.2	5%	0.045	11%	0.112	C	C	.	.	H	α-helix	trans	-62.2	-47.2	178.5	-79.4	-173.2	-58.7	116.4	-6	112.1	E44 E47 S177 H178 V179 A185 P258 K261 Y520	E44-R181 IonicContact OE1-NH1 3.91Å; E44-R181 PolarHBondContact OE1-NH1 3.29Å; E47-R181 VanDerWaalsContact CD-NH1 3.25Å; E47-R181 IonicContact OE1-CZ 3.31Å; E47-R181 VanDerWaalsContact OE1-CZ 3.29Å; E47-R181 IonicContact OE1-NH1 3.33Å; E47-R181 PolarHBondContact OE1-NH1 3.23Å; E47-R181 IonicContact OE1-NH2 2.67Å; E47-R181 PolarHBondContact OE1-NH2 3.05Å; E47-R181 IonicContact OE2-CZ 2.74Å; E47-R181 IonicContact OE2-NH1 3.75Å; E47-R181 PolarHBondContact OE2-NH1 2.9Å; E47-R181 IonicContact OE2-NH2 2.91Å; S177-R181 WeakPolarHBondContact O-CB 3.32Å; S177-R181 VanDerWaalsContact O-CG 3.26Å; S177-R181 WeakPolarHBondContact O-CG 3.29Å; S177-R181 PolarHBondContact O-N 3.45Å; H178-R181 PolarHBondContact CD2-NH2 3.42Å; H178-R181 PolarHBondContact O-N 2.82Å; V179-R181 VanDerWaalsContact C-N 3.32Å; V179-R181 PolarHBondContact O-N 3.4Å; R181-A185 WeakPolarHBondContact O-CB 3.22Å; R181-A185 PolarHBondContact O-N 3.21Å; R181-P258 HydrophobicContact CG-CB 3.48Å; R181-P258 VanDerWaalsContact CG-CB 3.48Å; R181-P258 HydrophobicContact CG-CG 3.73Å; R181-K261 HydrophobicContact CB-CD 4.18Å; R181-K261 HydrophobicContact CG-CD 4.21Å; R181-K261 WeakPolarHBondContact O-CD 3.18Å; R181-Y520 PolarHBondContact NH2-OH 2.82Å
182	L	93	Very high	83	Confident	8 Å²	8	18.9 Å²	18.9	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-65.9	-46.6	178.2	-74.1	173.7	0	0	0	111.6	L95 L98 Q99 A102 H178 V179 L184 A185 C186	L95-L182 HydrophobicContact CD1-CD1 3.91Å; L98-L182 HydrophobicContact CD2-CB 3.63Å; L98-L182 HydrophobicContact CD2-CD1 4.38Å; L98-L182 HydrophobicContact CG-CB 3.89Å; L98-L182 HydrophobicContact CG-CD1 4.46Å; Q99-L182 HydrophobicContact CG-CD1 3.73Å; A102-L182 HydrophobicContact CB-CD2 4.09Å; H178-L182 WeakPolarHBondContact NE2-CD1 3.23Å; H178-L182 PolarHBondContact O-N 3.29Å; V179-L182 PolarHBondContact O-N 3.41Å; L182-L184 PolarHBondContact O-N 3.2Å; L182-A185 PolarHBondContact O-N 2.99Å; L182-C186 PolarHBondContact O-N 3Å; L182-C186 PolarHBondContact O-SG 3.48Å
183	T	95	Very high	85.4	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.1	-48.3	178.3	-60.4	0	0	0	0	111	L98 L138 V141 L142 V179 A185 C186 M187	L98-T183 WeakPolarHBondContact CD2-OG1 3.33Å; L138-T183 HydrophobicContact CD2-CG2 4.09Å; V141-T183 HydrophobicContact CG1-CG2 4.39Å; L142-T183 HydrophobicContact CB-CG2 3.94Å; L142-T183 HydrophobicContact CD1-CG2 4.48Å; V179-T183 WeakPolarHBondContact O-CB 3.4Å; V179-T183 PolarHBondContact O-N 2.99Å; V179-T183 PolarHBondContact O-OG1 3.02Å; T183-A185 VanDerWaalsContact C-N 3.33Å; T183-A185 PolarHBondContact O-N 2.81Å; T183-C186 PolarHBondContact O-N 2.96Å; T183-M187 HydrophobicContact CG2-SD 4.09Å; T183-M187 VanDerWaalsContact O-CG 3.26Å; T183-M187 WeakPolarHBondContact O-CG 3.48Å; T183-M187 PolarHBondContact O-N 3.04Å
184	L	95.9	Very high	87.3	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.8	-35.5	178.2	-70	168	0	0	0	112.7	L142 L180 L182 Y188 L242 P258 K261 V262 L265	L142-L184 HydrophobicContact CD1-CD2 3.96Å; L142-L184 HydrophobicContact CD1-CG 4.22Å; L142-L184 HydrophobicContact CD2-CD2 4.27Å; L180-L184 WeakPolarHBondContact O-CB 3.39Å; L180-L184 WeakPolarHBondContact O-CD1 3.14Å; L180-L184 WeakPolarHBondContact O-CG 3.21Å; L180-L184 PolarHBondContact O-N 3.37Å; L182-L184 PolarHBondContact O-N 3.2Å; L184-Y188 WeakPolarHBondContact O-CB 3.48Å; L184-Y188 PolarHBondContact O-N 2.94Å; L184-L242 HydrophobicContact CD2-CD2 3.84Å; L184-P258 HydrophobicContact CD1-CG 3.61Å; L184-K261 HydrophobicContact CB-CB 4.03Å; L184-K261 HydrophobicContact CD1-CB 4.22Å; L184-V262 HydrophobicContact CD1-CG2 3.69Å; L184-L265 HydrophobicContact CD2-CD2 3.7Å
185	A	95.6	Very high	89.2	Confident	3 Å²	3	15.2 Å²	15.2	3%	0.025	7%	0.072	C	C	.	.	H	α-helix	trans	-65.7	-45.5	175.6	0	0	0	0	0	111.5	M39 Y40 R181 L182 T183 M187 Y188 T189	M39-A185 HydrophobicContact CG-CB 4.02Å; M39-A185 HydrophobicContact SD-CB 4.2Å; Y40-A185 HydrophobicContact CE1-CB 4.34Å; R181-A185 WeakPolarHBondContact O-CB 3.22Å; R181-A185 PolarHBondContact O-N 3.21Å; L182-A185 PolarHBondContact O-N 2.99Å; T183-A185 VanDerWaalsContact C-N 3.33Å; T183-A185 PolarHBondContact O-N 2.81Å; A185-M187 PolarHBondContact O-N 3.34Å; A185-Y188 PolarHBondContact O-N 3.44Å; A185-T189 PolarHBondContact O-N 3.38Å; A185-T189 PolarHBondContact O-OG1 3.48Å; A185-T189 VanDerWaalsContact O-OG1 3.08Å
186	C	97	Very high	90.9	Very high	3 Å²	3	12 Å²	12	2%	0.02	6%	0.056	C	C	.	.	H	α-helix	trans	-58.2	-49.3	174.6	-68.1	0	0	0	0	111.4	L105 L138 L182 T183 Y188 T189 I190	L105-C186 HydrophobicContact CD1-CB 3.54Å; L138-C186 HydrophobicContact CD1-CB 3.93Å; L138-C186 HydrophobicContact CD2-CB 4Å; L182-C186 PolarHBondContact O-N 3Å; L182-C186 PolarHBondContact O-SG 3.48Å; T183-C186 PolarHBondContact O-N 2.96Å; C186-Y188 VanDerWaalsContact C-N 3.35Å; C186-Y188 PolarHBondContact O-N 3.15Å; C186-T189 PolarHBondContact O-N 2.77Å; C186-I190 WeakPolarHBondContact O-CG1 3.18Å; C186-I190 PolarHBondContact O-N 2.88Å; C186-I190 VanDerWaalsContact O-N 3.13Å
187	M	97.3	Very high	92.3	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-61.1	-41.9	178.7	-68.6	-179.9	88.3	0	0	112.3	W135 L138 C139 L142 T183 A185 I190 V191 V238 L265	W135-M187 HydrophobicContact CE3-CE 4.4Å; W135-M187 HydrophobicContact CH2-CE 3.78Å; W135-M187 HydrophobicContact CZ2-CE 4.17Å; W135-M187 HydrophobicContact CZ3-CB 3.92Å; W135-M187 HydrophobicContact CZ3-CE 3.9Å; W135-M187 HydrophobicContact CZ3-CG 4.16Å; L138-M187 HydrophobicContact CB-CG 3.8Å; L138-M187 HydrophobicContact CB-SD 4.27Å; L138-M187 HydrophobicContact CD1-CG 4.06Å; L138-M187 HydrophobicContact CG-CG 4.42Å; C139-M187 VanDerWaalsContact SG-CE 3.55Å; L142-M187 HydrophobicContact CB-SD 4.37Å; L142-M187 HydrophobicContact CD2-CE 4.34Å; L142-M187 HydrophobicContact CD2-SD 3.88Å; T183-M187 HydrophobicContact CG2-SD 4.09Å; T183-M187 VanDerWaalsContact O-CG 3.26Å; T183-M187 WeakPolarHBondContact O-CG 3.48Å; T183-M187 PolarHBondContact O-N 3.04Å; A185-M187 PolarHBondContact O-N 3.34Å; M187-I190 PolarHBondContact O-N 3.05Å; M187-V191 WeakPolarHBondContact O-CG2 3.41Å; M187-V191 PolarHBondContact O-N 2.93Å; M187-V238 HydrophobicContact CE-CB 4.13Å; M187-V238 HydrophobicContact CE-CG2 3.49Å; M187-V238 VanDerWaalsContact CE-CG2 3.49Å; M187-V238 HydrophobicContact SD-CG2 4.46Å; M187-L265 HydrophobicContact CB-CD1 4.26Å; M187-L265 HydrophobicContact CB-CD2 3.88Å; M187-L265 HydrophobicContact SD-CD2 4.42Å
188	Y	97.5	Very high	92.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63	-45.3	177.7	175.1	-92.1	0	0	0	112.6	E35 L36 M39 L184 A185 C186 I190 V191 E192 L264 K268	E35-Y188 PolarHBondContact O-OH 2.87Å; L36-Y188 HydrophobicContact CD2-CE1 4.27Å; M39-Y188 HydrophobicContact CB-CD1 4.33Å; M39-Y188 HydrophobicContact CB-CE1 4.27Å; M39-Y188 HydrophobicContact CE-CD1 3.29Å; M39-Y188 HydrophobicContact CE-CD2 3.38Å; M39-Y188 HydrophobicContact CE-CE1 3.85Å; M39-Y188 HydrophobicContact CE-CE2 3.94Å; M39-Y188 HydrophobicContact CE-CG 3.01Å; M39-Y188 HydrophobicContact CG-CD1 4.45Å; L184-Y188 WeakPolarHBondContact O-CB 3.48Å; L184-Y188 PolarHBondContact O-N 2.94Å; A185-Y188 PolarHBondContact O-N 3.44Å; C186-Y188 VanDerWaalsContact C-N 3.35Å; C186-Y188 PolarHBondContact O-N 3.15Å; Y188-I190 VanDerWaalsContact C-N 3.3Å; Y188-I190 PolarHBondContact O-N 2.86Å; Y188-V191 PolarHBondContact O-N 3.13Å; Y188-E192 HydrophobicContact CE1-CB 4.35Å; Y188-E192 VanDerWaalsContact O-CB 3.31Å; Y188-E192 WeakPolarHBondContact O-CB 3.49Å; Y188-E192 PolarHBondContact O-N 2.8Å; Y188-L264 HydrophobicContact CD2-CB 4.04Å; Y188-L264 HydrophobicContact CE2-CB 3.74Å; Y188-L264 HydrophobicContact CE2-CD2 4.34Å; Y188-K268 HydrophobicContact CD2-CG 3.97Å; Y188-K268 HydrophobicContact CE2-CD 4.3Å; Y188-K268 HydrophobicContact CE2-CG 3.41Å; Y188-K268 VanDerWaalsContact CE2-CG 3.41Å; Y188-K268 WeakPolarHBondContact OH-CE 3.49Å
189	T	96.8	Very high	91.2	Very high	4 Å²	4	18.8 Å²	18.8	3%	0.025	9%	0.09	C	C	.	.	H	α-helix	trans	-60.5	-43.7	178.8	-56.6	0	0	0	0	110.8	L36 L105 I122 A185 C186 C193	L36-T189 HydrophobicContact CD2-CG2 4.24Å; L105-T189 HydrophobicContact CB-CG2 4.3Å; L105-T189 WeakPolarHBondContact O-CG2 3.12Å; I122-T189 HydrophobicContact CG2-CG2 3.7Å; A185-T189 PolarHBondContact O-N 3.38Å; A185-T189 PolarHBondContact O-OG1 3.48Å; A185-T189 VanDerWaalsContact O-OG1 3.08Å; C186-T189 PolarHBondContact O-N 2.77Å; T189-C193 VanDerWaalsContact O-CB 3.31Å; T189-C193 WeakPolarHBondContact O-CB 3.39Å; T189-C193 PolarHBondContact O-N 2.76Å; T189-C193 PolarHBondContact O-SG 3.49Å; T189-C193 VanDerWaalsContact O-SG 3.34Å
190	I	96.5	Very high	89.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.5	-52.7	175.6	-65.8	168.8	0	0	0	110.6	L105 Y130 W135 L138 C186 M187 Y188 E192 V194	L105-I190 HydrophobicContact CD1-CD1 4.16Å; L105-I190 HydrophobicContact CD1-CG1 4.2Å; L105-I190 HydrophobicContact CD2-CD1 4.44Å; L105-I190 HydrophobicContact CD2-CG1 3.86Å; Y130-I190 HydrophobicContact CD2-CG2 4.15Å; W135-I190 HydrophobicContact CE3-CB 4.46Å; W135-I190 HydrophobicContact CE3-CG2 4.07Å; L138-I190 HydrophobicContact CD1-CD1 3.7Å; C186-I190 WeakPolarHBondContact O-CG1 3.18Å; C186-I190 PolarHBondContact O-N 2.88Å; C186-I190 VanDerWaalsContact O-N 3.13Å; M187-I190 PolarHBondContact O-N 3.05Å; Y188-I190 VanDerWaalsContact C-N 3.3Å; Y188-I190 PolarHBondContact O-N 2.86Å; I190-E192 PolarHBondContact O-N 3.41Å; I190-V194 HydrophobicContact CG2-CG2 4.3Å; I190-V194 VanDerWaalsContact O-CB 3.29Å; I190-V194 WeakPolarHBondContact O-CB 3.2Å; I190-V194 WeakPolarHBondContact O-CG2 3.46Å; I190-V194 PolarHBondContact O-N 3.29Å
191	V	96	Very high	87.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-45.3	-178.4	171.8	0	0	0	0	111.7	W135 M187 Y188 R195 L225 L265 K268	W135-V191 HydrophobicContact CH2-CG2 3.4Å; W135-V191 VanDerWaalsContact CH2-CG2 3.4Å; W135-V191 HydrophobicContact CZ2-CG2 4.47Å; W135-V191 HydrophobicContact CZ3-CG2 3.46Å; W135-V191 VanDerWaalsContact CZ3-CG2 3.46Å; M187-V191 WeakPolarHBondContact O-CG2 3.41Å; M187-V191 PolarHBondContact O-N 2.93Å; Y188-V191 PolarHBondContact O-N 3.13Å; V191-R195 WeakPolarHBondContact O-CB 3.45Å; V191-R195 PolarHBondContact O-N 3Å; V191-L225 HydrophobicContact CG2-CD2 4.46Å; V191-L265 HydrophobicContact CB-CD1 4.29Å; V191-L265 HydrophobicContact CG2-CD1 4.01Å; V191-K268 HydrophobicContact CG1-CB 3.93Å
192	E	95.1	Very high	85.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-70.7	-39.3	-174.7	-174.4	62.7	177.5	0	0	112.3	L32 Y188 I190 R195 R196 K268	L32-E192 HydrophobicContact CD1-CG 4.14Å; Y188-E192 HydrophobicContact CE1-CB 4.35Å; Y188-E192 VanDerWaalsContact O-CB 3.31Å; Y188-E192 WeakPolarHBondContact O-CB 3.49Å; Y188-E192 PolarHBondContact O-N 2.8Å; I190-E192 PolarHBondContact O-N 3.41Å; E192-R195 IonicContact OE1-NH2 3.22Å; E192-R195 PolarHBondContact OE1-NH2 3.46Å; E192-R195 VanDerWaalsContact OE1-NH2 3.13Å; E192-R195 IonicContact OE2-CZ 3.76Å; E192-R195 IonicContact OE2-NE 2.69Å; E192-R195 PolarHBondContact OE2-NE 3.13Å; E192-R195 IonicContact OE2-NH2 3.37Å; E192-R195 PolarHBondContact OE2-NH2 2.91Å; E192-R196 WeakPolarHBondContact O-CB 3.29Å; E192-R196 VanDerWaalsContact O-CG 3.29Å; E192-R196 WeakPolarHBondContact O-CG 3.34Å; E192-R196 PolarHBondContact O-N 2.91Å; E192-R196 IonicContact OE1-CZ 2.92Å; E192-R196 IonicContact OE1-NE 3.08Å; E192-R196 PolarHBondContact OE1-NE 2.99Å; E192-R196 IonicContact OE1-NH2 3.46Å; E192-R196 PolarHBondContact OE1-NH2 3.44Å; E192-K268 IonicContact OE1-NZ 3.77Å; E192-K268 VanDerWaalsContact OE2-CD 3.24Å; E192-K268 WeakPolarHBondContact OE2-CD 3.44Å; E192-K268 WeakPolarHBondContact OE2-CG 3.48Å
193	C	94.3	Very high	83	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.027	23%	0.228	C	C	.	.	H	α-helix	trans	-68.6	-48.9	175.3	-70.3	0	0	0	0	112	A126 T189 R195 R196 F197	A126-C193 HydrophobicContact CB-CB 3.61Å; T189-C193 VanDerWaalsContact O-CB 3.31Å; T189-C193 WeakPolarHBondContact O-CB 3.39Å; T189-C193 PolarHBondContact O-N 2.76Å; T189-C193 PolarHBondContact O-SG 3.49Å; T189-C193 VanDerWaalsContact O-SG 3.34Å; C193-R195 PolarHBondContact O-N 3.01Å; C193-R196 PolarHBondContact O-N 3.34Å; C193-F197 PolarHBondContact O-N 3.28Å
194	V	93	Very high	80.5	Confident	1 Å²	1	53 Å²	53	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-39.6	-177.6	174.6	0	0	0	0	111.5	F127 I190 R196 F197 V221 K222 L225	F127-V194 HydrophobicContact CD1-CG2 4.23Å; F127-V194 HydrophobicContact CE1-CB 4.44Å; F127-V194 HydrophobicContact CE1-CG1 4.27Å; F127-V194 HydrophobicContact CE1-CG2 4.01Å; F127-V194 HydrophobicContact CZ-CB 4.48Å; F127-V194 HydrophobicContact CZ-CG2 4.25Å; I190-V194 HydrophobicContact CG2-CG2 4.3Å; I190-V194 VanDerWaalsContact O-CB 3.29Å; I190-V194 WeakPolarHBondContact O-CB 3.2Å; I190-V194 WeakPolarHBondContact O-CG2 3.46Å; I190-V194 PolarHBondContact O-N 3.29Å; V194-R196 PolarHBondContact O-N 2.91Å; V194-F197 PolarHBondContact O-N 3.22Å; V194-V221 HydrophobicContact CG1-CG1 4.07Å; V194-V221 HydrophobicContact CG2-CG1 4.18Å; V194-K222 HydrophobicContact CG1-CB 3.97Å; V194-K222 HydrophobicContact CG1-CG 4.3Å; V194-L225 HydrophobicContact CB-CD2 3.71Å; V194-L225 HydrophobicContact CG1-CB 4.26Å; V194-L225 HydrophobicContact CG1-CD2 3.56Å; V194-L225 HydrophobicContact CG2-CD2 4.35Å
195	R	91.5	Very high	78.1	Confident	45 Å²	45	60.7 Å²	60.7	17%	0.17	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-40.9	179.2	-177.4	-169.5	68.4	77	-0.9	112.4	V191 E192 C193 F197 K222 A272	V191-R195 WeakPolarHBondContact O-CB 3.45Å; V191-R195 PolarHBondContact O-N 3Å; E192-R195 IonicContact OE1-NH2 3.22Å; E192-R195 PolarHBondContact OE1-NH2 3.46Å; E192-R195 VanDerWaalsContact OE1-NH2 3.13Å; E192-R195 IonicContact OE2-CZ 3.76Å; E192-R195 IonicContact OE2-NE 2.69Å; E192-R195 PolarHBondContact OE2-NE 3.13Å; E192-R195 IonicContact OE2-NH2 3.37Å; E192-R195 PolarHBondContact OE2-NH2 2.91Å; C193-R195 PolarHBondContact O-N 3.01Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 3.31Å; R195-K222 WeakPolarHBondContact O-CE 3.36Å; R195-K222 PolarHBondContact O-NZ 3.39Å; R195-A272 HydrophobicContact CB-CB 4.41Å; R195-A272 HydrophobicContact CG-CB 3.87Å
196	R	89.1	Confident	75.6	Confident	69 Å²	69	66.7 Å²	66.7	26%	0.26	32%	0.319	S	S	.	.	H	α-helix	trans	-72.6	-18.6	-176.7	-79.1	-178.8	-176.6	-125.3	1.4	114.4	D30 L32 E192 C193 V194 E198	D30-R196 PolarHBondContact O-NH1 3.23Å; D30-R196 PolarHBondContact O-NH2 3.03Å; L32-R196 VanDerWaalsContact CA-NH1 3.27Å; E192-R196 WeakPolarHBondContact O-CB 3.29Å; E192-R196 VanDerWaalsContact O-CG 3.29Å; E192-R196 WeakPolarHBondContact O-CG 3.34Å; E192-R196 PolarHBondContact O-N 2.91Å; E192-R196 IonicContact OE1-CZ 2.92Å; E192-R196 IonicContact OE1-NE 3.08Å; E192-R196 PolarHBondContact OE1-NE 2.99Å; E192-R196 IonicContact OE1-NH2 3.46Å; E192-R196 PolarHBondContact OE1-NH2 3.44Å; C193-R196 PolarHBondContact O-N 3.34Å; V194-R196 PolarHBondContact O-N 2.91Å; R196-E198 PolarHBondContact O-N 3.45Å; R196-E198 VanDerWaalsContact O-N 3.14Å
197	F	85.4	Confident	73.3	Confident	29 Å²	29	71.4 Å²	71.4	13%	0.127	35%	0.351	C	S	.	.			trans	-61.3	118.3	179.7	177.1	-103.2	0	0	0	111	F127 C193 V194 R195 D215 R218 K222	F127-F197 HydrophobicContact CE2-CB 4.36Å; F127-F197 HydrophobicContact CZ-CB 3.67Å; F127-F197 HydrophobicContact CZ-CD1 4.45Å; F127-F197 HydrophobicContact CZ-CD2 4.31Å; F127-F197 AromaticContact CZ-CG 3.9Å; F127-F197 HydrophobicContact CZ-CG 3.9Å; C193-F197 PolarHBondContact O-N 3.28Å; V194-F197 PolarHBondContact O-N 3.22Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 3.31Å; F197-D215 HydrophobicContact CZ-CB 4.31Å; F197-R218 HydrophobicContact CD1-CB 3.97Å; F197-R218 HydrophobicContact CD2-CB 4.38Å; F197-R218 HydrophobicContact CE1-CB 3.55Å; F197-R218 HydrophobicContact CE2-CB 4Å; F197-R218 HydrophobicContact CE2-CG 4.49Å; F197-R218 HydrophobicContact CG-CB 4.37Å; F197-R218 HydrophobicContact CZ-CB 3.57Å; F197-R218 HydrophobicContact CZ-CG 4.44Å; F197-K222 PolarHBondContact O-NZ 3.34Å
198	E	77.9	Confident	71.1	Confident	151 Å²	151	79.2 Å²	79.2	71%	0.706	39%	0.393	S	S	*	.			trans	-117	126	173.9	-71.7	-179.3	177.4	0	0	108.3	R196 N200	R196-E198 PolarHBondContact O-N 3.45Å; R196-E198 VanDerWaalsContact O-N 3.14Å; E198-N200 PolarHBondContact O-N 2.93Å
199	C	58.5	Low	69.1	Low	40 Å²	40	84.5 Å²	84.5	27%	0.27	42%	0.422	S	S	.	.			trans	-73.7	112.4	174.1	-174.7	0	0	0	0	108	K201 L211	C199-K201 PolarHBondContact O-N 3.48Å; C199-L211 VanDerWaalsContact SG-CD2 3.51Å
200	N	54	Low	67.4	Low	140 Å²	140	90.7 Å²	90.7	75%	0.749	46%	0.46	S	S	*	.			trans	-68.3	73.1	176.5	-78.3	-25.4	0	0	0	111	E198	E198-N200 PolarHBondContact O-N 2.93Å
201	K	49.4	Very low	65.8	Low	143 Å²	143	94.5 Å²	94.5	62%	0.622	48%	0.48	S	S	*	.			trans	-78.4	-24.6	172.1	-73.2	-174.9	176.9	178.9	0	112.6	C199	C199-K201 PolarHBondContact O-N 3.48Å
202	E	42.5	Very low	64.8	Low	190 Å²	190	97.6 Å²	97.6	89%	0.888	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-0.6	-164.5	-63.1	-171.9	171.4	0	0	115.1
203	R	44.3	Very low	63.9	Low	239 Å²	239	105.8 Å²	105.8	90%	0.902	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-9.9	-176.1	-148.5	163.6	-170.4	167.6	1.7	115.3
204	S	43.1	Very low	63.3	Low	53 Å²	53	109.4 Å²	109.4	37%	0.371	56%	0.556	S	S	.	*			trans	-116.4	83.7	174.1	49.5	0	0	0	0	111.3	N206	S204-N206 PolarHBondContact O-N 2.87Å
205	D	46.5	Very low	62.9	Low	161 Å²	161	111.9 Å²	111.9	86%	0.861	57%	0.569	S	S	*	*			trans	-66.8	10.2	161.3	-90.3	-19.4	0	0	0	112.6
206	N	42.7	Very low	62.6	Low	129 Å²	129	113.3 Å²	113.3	69%	0.69	58%	0.583	S	S	*	*	S	Bend	trans	-135.4	131.4	-178.2	-69.9	-49.7	0	0	0	110.4	S204	S204-N206 PolarHBondContact O-N 2.87Å
207	S	48.3	Very low	62.5	Low	101 Å²	101	114.9 Å²	114.9	71%	0.706	60%	0.596	S	S	*	*	S	Bend	trans	69.1	144	171.5	47	0	0	0	0	118.1	D209	S207-D209 PolarHBondContact O-N 3.44Å
208	D	50.8	Low	62.7	Low	165 Å²	165	115.7 Å²	115.7	88%	0.882	60%	0.598	S	S	*	*			trans	-56.3	61	173	-69.7	-50.5	0	0	0	113	T210	D208-T210 VanDerWaalsContact C-N 3.32Å; D208-T210 PolarHBondContact O-N 3.47Å
209	D	56.2	Low	63.2	Low	111 Å²	111	111.5 Å²	111.5	59%	0.594	58%	0.583	S	S	*	*			trans	-68.5	96.1	171.3	-81.7	-17.7	0	0	0	107.4	S207 L211	S207-D209 PolarHBondContact O-N 3.44Å; D209-L211 PolarHBondContact O-N 2.87Å; D209-L211 VanDerWaalsContact O-N 3.07Å
210	T	60.6	Low	64.7	Low	134 Å²	134	113.9 Å²	113.9	82%	0.822	59%	0.59	S	S	*	*			trans	-57.5	115.1	169.3	-22.1	0	0	0	0	105.7	D208 S212	D208-T210 VanDerWaalsContact C-N 3.32Å; D208-T210 PolarHBondContact O-N 3.47Å; T210-S212 PolarHBondContact O-N 3.29Å
211	L	63.7	Low	66.4	Low	80 Å²	80	107.6 Å²	107.6	42%	0.419	56%	0.556	S	S	.	*			trans	-44.1	127.7	176.5	-73.6	158.9	0	0	0	108.8	C199 D209 E213 V216	C199-L211 VanDerWaalsContact SG-CD2 3.51Å; D209-L211 PolarHBondContact O-N 2.87Å; D209-L211 VanDerWaalsContact O-N 3.07Å; L211-E213 PolarHBondContact O-N 2.88Å; L211-V216 HydrophobicContact CB-CG2 3.76Å; L211-V216 HydrophobicContact CD1-CG2 4.44Å
212	S	73.6	Confident	68.4	Low	65 Å²	65	103.1 Å²	103.1	46%	0.455	54%	0.537	S	S	.	.			trans	-51.1	133.2	175.4	-179.7	0	0	0	0	108.5	T210 E214 D215 V216	T210-S212 PolarHBondContact O-N 3.29Å; S212-E214 PolarHBondContact O-N 3.15Å; S212-D215 PolarHBondContact O-N 3.4Å; S212-V216 PolarHBondContact O-N 2.97Å
213	E	77.6	Confident	70.7	Confident	171 Å²	171	100.2 Å²	100.2	80%	0.799	52%	0.518	S	S	*	.	H	α-helix	trans	-51.9	-32.4	-179.9	-68.2	-177.2	167.6	0	0	111.2	L211 V216 L217	L211-E213 PolarHBondContact O-N 2.88Å; E213-V216 PolarHBondContact O-N 3.19Å; E213-L217 WeakPolarHBondContact O-CG 3.43Å; E213-L217 PolarHBondContact O-N 2.96Å; E213-L217 VanDerWaalsContact O-N 3.09Å
214	E	81.6	Confident	73	Confident	81 Å²	81	90.8 Å²	90.8	38%	0.379	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-40	175.1	-172.6	172	-174.4	0	0	113.6	S212 V216 L217 R218	S212-E214 PolarHBondContact O-N 3.15Å; E214-V216 VanDerWaalsContact C-N 3.32Å; E214-V216 PolarHBondContact O-N 3.49Å; E214-L217 PolarHBondContact O-N 3.4Å; E214-R218 HydrophobicContact CG-CG 4.5Å; E214-R218 VanDerWaalsContact O-CG 3.31Å; E214-R218 WeakPolarHBondContact O-CG 3.45Å; E214-R218 PolarHBondContact O-N 3.14Å; E214-R218 IonicContact OE1-CZ 2.85Å; E214-R218 VanDerWaalsContact OE1-CZ 3.31Å; E214-R218 IonicContact OE1-NE 3.49Å; E214-R218 PolarHBondContact OE1-NE 2.95Å; E214-R218 IonicContact OE1-NH2 2.82Å; E214-R218 PolarHBondContact OE1-NH2 3.09Å
215	D	84.3	Confident	75.3	Confident	52 Å²	52	88.4 Å²	88.4	28%	0.278	47%	0.471	S	S	.	.	H	α-helix	trans	-69.2	-34.3	178.6	-70.2	-34.6	0	0	0	111.5	F197 S212 T219	F197-D215 HydrophobicContact CZ-CB 4.31Å; S212-D215 PolarHBondContact O-N 3.4Å; D215-T219 WeakPolarHBondContact O-CB 3.41Å; D215-T219 PolarHBondContact O-N 3.32Å; D215-T219 PolarHBondContact O-OG1 3.2Å
216	V	85.3	Confident	77.3	Confident	75 Å²	75	83 Å²	83	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-63.3	-47.2	173.1	179.7	0	0	0	0	110	L211 S212 E213 E214 T219 E220	L211-V216 HydrophobicContact CB-CG2 3.76Å; L211-V216 HydrophobicContact CD1-CG2 4.44Å; S212-V216 PolarHBondContact O-N 2.97Å; E213-V216 PolarHBondContact O-N 3.19Å; E214-V216 VanDerWaalsContact C-N 3.32Å; E214-V216 PolarHBondContact O-N 3.49Å; V216-T219 PolarHBondContact O-N 2.97Å; V216-E220 PolarHBondContact O-N 2.97Å
217	L	85.6	Confident	79.6	Confident	102 Å²	102	80.8 Å²	80.8	53%	0.534	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-47	176.4	-70	171.4	0	0	0	111.9	E213 E214 T219 E220 V221	E213-L217 WeakPolarHBondContact O-CG 3.43Å; E213-L217 PolarHBondContact O-N 2.96Å; E213-L217 VanDerWaalsContact O-N 3.09Å; E214-L217 PolarHBondContact O-N 3.4Å; L217-T219 VanDerWaalsContact C-N 3.3Å; L217-T219 PolarHBondContact O-N 3.18Å; L217-E220 WeakPolarHBondContact O-CB 3.26Å; L217-E220 PolarHBondContact O-N 3.03Å; L217-E220 VanDerWaalsContact O-N 3.14Å; L217-V221 WeakPolarHBondContact O-CG2 3.23Å; L217-V221 PolarHBondContact O-N 3.34Å
218	R	89.7	Confident	81.5	Confident	46 Å²	46	79.4 Å²	79.4	17%	0.174	41%	0.413	C	S	.	.	H	α-helix	trans	-62.3	-36.3	177.6	-70.9	177.5	-177.7	-170.2	1.2	112.6	F127 F197 E214 K222	F127-R218 HydrophobicContact CD1-CB 4.03Å; F127-R218 HydrophobicContact CD1-CG 3.76Å; F127-R218 HydrophobicContact CD2-CG 4.21Å; F127-R218 HydrophobicContact CE1-CB 3.69Å; F127-R218 HydrophobicContact CE1-CG 3.85Å; F127-R218 HydrophobicContact CE2-CG 4.33Å; F127-R218 HydrophobicContact CG-CG 3.97Å; F127-R218 HydrophobicContact CZ-CB 4.09Å; F127-R218 HydrophobicContact CZ-CG 4.16Å; F197-R218 HydrophobicContact CD1-CB 3.97Å; F197-R218 HydrophobicContact CD2-CB 4.38Å; F197-R218 HydrophobicContact CE1-CB 3.55Å; F197-R218 HydrophobicContact CE2-CB 4Å; F197-R218 HydrophobicContact CE2-CG 4.49Å; F197-R218 HydrophobicContact CG-CB 4.37Å; F197-R218 HydrophobicContact CZ-CB 3.57Å; F197-R218 HydrophobicContact CZ-CG 4.44Å; E214-R218 HydrophobicContact CG-CG 4.5Å; E214-R218 VanDerWaalsContact O-CG 3.31Å; E214-R218 WeakPolarHBondContact O-CG 3.45Å; E214-R218 PolarHBondContact O-N 3.14Å; E214-R218 IonicContact OE1-CZ 2.85Å; E214-R218 VanDerWaalsContact OE1-CZ 3.31Å; E214-R218 IonicContact OE1-NE 3.49Å; E214-R218 PolarHBondContact OE1-NE 2.95Å; E214-R218 IonicContact OE1-NH2 2.82Å; E214-R218 PolarHBondContact OE1-NH2 3.09Å; R218-K222 WeakPolarHBondContact O-CB 3.36Å; R218-K222 PolarHBondContact O-N 3.43Å
219	T	88.8	Confident	83.3	Confident	63 Å²	63	71.7 Å²	71.7	39%	0.387	37%	0.372	S	S	.	.	H	α-helix	trans	-65.3	-40.8	174.8	-57.8	0	0	0	0	111.3	D215 V216 L217 K222 R223	D215-T219 WeakPolarHBondContact O-CB 3.41Å; D215-T219 PolarHBondContact O-N 3.32Å; D215-T219 PolarHBondContact O-OG1 3.2Å; V216-T219 PolarHBondContact O-N 2.97Å; L217-T219 VanDerWaalsContact C-N 3.3Å; L217-T219 PolarHBondContact O-N 3.18Å; T219-K222 PolarHBondContact O-N 2.92Å; T219-R223 PolarHBondContact O-N 3.42Å
220	E	89.4	Confident	84.7	Confident	91 Å²	91	67.8 Å²	67.8	43%	0.425	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-42.8	177.3	-179.9	57.3	-164.5	0	0	111.9	V216 L217 K222 R223 S224	V216-E220 PolarHBondContact O-N 2.97Å; L217-E220 WeakPolarHBondContact O-CB 3.26Å; L217-E220 PolarHBondContact O-N 3.03Å; L217-E220 VanDerWaalsContact O-N 3.14Å; E220-K222 VanDerWaalsContact C-N 3.34Å; E220-K222 PolarHBondContact O-N 2.95Å; E220-R223 VanDerWaalsContact CD-NH2 3.26Å; E220-R223 WeakPolarHBondContact O-CB 3.26Å; E220-R223 PolarHBondContact O-N 3.04Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NE 2.64Å; E220-R223 IonicContact OE1-NH2 2.92Å; E220-R223 PolarHBondContact OE1-NH2 3.45Å; E220-R223 IonicContact OE2-CZ 2.62Å; E220-R223 IonicContact OE2-NE 2.65Å; E220-R223 PolarHBondContact OE2-NE 3.05Å; E220-R223 IonicContact OE2-NH2 2.83Å; E220-R223 PolarHBondContact OE2-NH2 3.33Å; E220-R223 VanDerWaalsContact OE2-NH2 3.08Å; E220-S224 PolarHBondContact O-N 2.93Å
221	V	90.7	Very high	85.8	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-56.3	-48.3	172	165.4	0	0	0	0	111.4	F127 Y130 D131 V194 L217 R223 S224 L225	F127-V221 HydrophobicContact CD1-CB 3.96Å; F127-V221 HydrophobicContact CD1-CG1 3.6Å; F127-V221 HydrophobicContact CD1-CG2 4.41Å; F127-V221 HydrophobicContact CE1-CB 4.2Å; F127-V221 HydrophobicContact CE1-CG1 3.9Å; Y130-V221 HydrophobicContact CD1-CB 4.13Å; Y130-V221 HydrophobicContact CD1-CG1 3.32Å; Y130-V221 HydrophobicContact CD1-CG2 4.07Å; Y130-V221 HydrophobicContact CE1-CB 4.39Å; Y130-V221 HydrophobicContact CE1-CG1 3.82Å; Y130-V221 HydrophobicContact CG-CG1 3.83Å; D131-V221 WeakPolarHBondContact OD1-CG2 3.25Å; V194-V221 HydrophobicContact CG1-CG1 4.07Å; V194-V221 HydrophobicContact CG2-CG1 4.18Å; L217-V221 WeakPolarHBondContact O-CG2 3.23Å; L217-V221 PolarHBondContact O-N 3.34Å; V221-R223 VanDerWaalsContact C-N 3.31Å; V221-R223 PolarHBondContact O-N 2.94Å; V221-S224 PolarHBondContact O-N 3.49Å; V221-L225 PolarHBondContact O-N 3.5Å
222	K	91.4	Very high	86.2	Confident	50 Å²	50	62.6 Å²	62.6	22%	0.217	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-45	177.1	-177.8	177.9	-175.2	174	0	111.5	V194 R195 F197 R218 T219 E220 L226	V194-K222 HydrophobicContact CG1-CB 3.97Å; V194-K222 HydrophobicContact CG1-CG 4.3Å; R195-K222 WeakPolarHBondContact O-CE 3.36Å; R195-K222 PolarHBondContact O-NZ 3.39Å; F197-K222 PolarHBondContact O-NZ 3.34Å; R218-K222 WeakPolarHBondContact O-CB 3.36Å; R218-K222 PolarHBondContact O-N 3.43Å; T219-K222 PolarHBondContact O-N 2.92Å; E220-K222 VanDerWaalsContact C-N 3.34Å; E220-K222 PolarHBondContact O-N 2.95Å; K222-L226 HydrophobicContact CG-CD1 4.03Å; K222-L226 HydrophobicContact CG-CG 4.46Å; K222-L226 WeakPolarHBondContact O-CB 3.36Å; K222-L226 WeakPolarHBondContact O-CG 3.02Å; K222-L226 PolarHBondContact O-N 3.41Å
223	R	90.6	Very high	86.1	Confident	129 Å²	129	65.7 Å²	65.7	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-44.2	177.9	-170.4	-177.9	71.7	82.9	0.8	111.4	T219 E220 V221 L226 N227	T219-R223 PolarHBondContact O-N 3.42Å; E220-R223 VanDerWaalsContact CD-NH2 3.26Å; E220-R223 WeakPolarHBondContact O-CB 3.26Å; E220-R223 PolarHBondContact O-N 3.04Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NE 2.64Å; E220-R223 IonicContact OE1-NH2 2.92Å; E220-R223 PolarHBondContact OE1-NH2 3.45Å; E220-R223 IonicContact OE2-CZ 2.62Å; E220-R223 IonicContact OE2-NE 2.65Å; E220-R223 PolarHBondContact OE2-NE 3.05Å; E220-R223 IonicContact OE2-NH2 2.83Å; E220-R223 PolarHBondContact OE2-NH2 3.33Å; E220-R223 VanDerWaalsContact OE2-NH2 3.08Å; V221-R223 VanDerWaalsContact C-N 3.31Å; V221-R223 PolarHBondContact O-N 2.94Å; R223-L226 PolarHBondContact O-N 3.43Å; R223-N227 PolarHBondContact O-N 3.4Å; R223-N227 PolarHBondContact O-ND2 3.35Å; R223-N227 VanDerWaalsContact O-ND2 3.16Å
224	S	92.1	Very high	86.1	Confident	40 Å²	40	59.5 Å²	59.5	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-51.7	177.6	-169.1	0	0	0	0	111.6	Y130 E220 V221 L226 N227 E228	Y130-S224 VanDerWaalsContact OH-C 3.31Å; Y130-S224 VanDerWaalsContact OH-CB 3.27Å; Y130-S224 WeakPolarHBondContact OH-CB 3.42Å; Y130-S224 PolarHBondContact OH-OG 3.43Å; E220-S224 PolarHBondContact O-N 2.93Å; V221-S224 PolarHBondContact O-N 3.49Å; S224-L226 VanDerWaalsContact C-N 3.33Å; S224-L226 PolarHBondContact O-N 3.13Å; S224-N227 PolarHBondContact O-N 3.42Å; S224-N227 VanDerWaalsContact O-N 3.16Å; S224-E228 PolarHBondContact O-N 2.85Å; S224-E228 PolarHBondContact OG-OE1 3.48Å
225	L	91.5	Very high	85.8	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-43.4	179.2	178.9	68.9	0	0	0	111.5	Y130 W135 V191 V194 V221 N227 E228 L229	Y130-L225 HydrophobicContact CD2-CD1 4.25Å; Y130-L225 HydrophobicContact CE2-CB 3.86Å; Y130-L225 HydrophobicContact CE2-CD1 3.67Å; Y130-L225 HydrophobicContact CE2-CG 4.31Å; Y130-L225 WeakPolarHBondContact OH-CA 3.16Å; Y130-L225 PolarHBondContact OH-N 3.08Å; Y130-L225 VanDerWaalsContact OH-N 3.09Å; W135-L225 HydrophobicContact CD2-CD1 3.75Å; W135-L225 HydrophobicContact CE3-CD1 4.13Å; W135-L225 HydrophobicContact CG-CD1 4.22Å; W135-L225 HydrophobicContact CH2-CD1 4.25Å; W135-L225 HydrophobicContact CZ2-CD1 3.87Å; W135-L225 HydrophobicContact CZ3-CD1 4.37Å; V191-L225 HydrophobicContact CG2-CD2 4.46Å; V194-L225 HydrophobicContact CB-CD2 3.71Å; V194-L225 HydrophobicContact CG1-CB 4.26Å; V194-L225 HydrophobicContact CG1-CD2 3.56Å; V194-L225 HydrophobicContact CG2-CD2 4.35Å; V221-L225 PolarHBondContact O-N 3.5Å; L225-N227 VanDerWaalsContact C-N 3.34Å; L225-N227 PolarHBondContact O-N 3.13Å; L225-E228 PolarHBondContact O-N 3.04Å; L225-L229 HydrophobicContact CD1-CD1 4.39Å; L225-L229 HydrophobicContact CD1-CG 4.39Å; L225-L229 HydrophobicContact CG-CD1 4.08Å; L225-L229 HydrophobicContact CG-CG 4.45Å; L225-L229 VanDerWaalsContact O-CG 3.29Å; L225-L229 WeakPolarHBondContact O-CG 3.15Å; L225-L229 PolarHBondContact O-N 3.37Å
226	L	89.6	Confident	85.6	Confident	48 Å²	48	60.7 Å²	60.7	25%	0.251	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-41	178.3	-71.9	176.5	0	0	0	112	K222 R223 S224 L229 D230 A272	K222-L226 HydrophobicContact CG-CD1 4.03Å; K222-L226 HydrophobicContact CG-CG 4.46Å; K222-L226 WeakPolarHBondContact O-CB 3.36Å; K222-L226 WeakPolarHBondContact O-CG 3.02Å; K222-L226 PolarHBondContact O-N 3.41Å; R223-L226 PolarHBondContact O-N 3.43Å; S224-L226 VanDerWaalsContact C-N 3.33Å; S224-L226 PolarHBondContact O-N 3.13Å; L226-L229 PolarHBondContact O-N 3.09Å; L226-D230 WeakPolarHBondContact O-CB 3.33Å; L226-D230 PolarHBondContact O-N 3.4Å; L226-A272 HydrophobicContact CD2-CB 3.64Å; L226-A272 VanDerWaalsContact CD2-O 3.28Å; L226-A272 WeakPolarHBondContact CD2-O 3.37Å
227	N	89.3	Confident	85.6	Confident	82 Å²	82	57.3 Å²	57.3	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-42	176.2	-67.4	-25.1	0	0	0	111.5	R223 S224 L225 D230 D231	R223-N227 PolarHBondContact O-N 3.4Å; R223-N227 PolarHBondContact O-ND2 3.35Å; R223-N227 VanDerWaalsContact O-ND2 3.16Å; S224-N227 PolarHBondContact O-N 3.42Å; S224-N227 VanDerWaalsContact O-N 3.16Å; L225-N227 VanDerWaalsContact C-N 3.34Å; L225-N227 PolarHBondContact O-N 3.13Å; N227-D230 PolarHBondContact O-N 2.81Å; N227-D231 VanDerWaalsContact O-CB 3.31Å; N227-D231 WeakPolarHBondContact O-CB 3.49Å; N227-D231 PolarHBondContact O-N 3.16Å
228	E	89.4	Confident	85.9	Confident	72 Å²	72	52.7 Å²	52.7	34%	0.336	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-36.6	177.5	-70.8	175.9	-141	0	0	113	Y130 W135 S224 L225	Y130-E228 PolarHBondContact OH-OE1 3.3Å; W135-E228 PolarHBondContact NE1-OE2 3.17Å; W135-E228 VanDerWaalsContact NE1-OE2 3.12Å; S224-E228 PolarHBondContact O-N 2.85Å; S224-E228 PolarHBondContact OG-OE1 3.48Å; L225-E228 PolarHBondContact O-N 3.04Å
229	L	89	Confident	86	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-70.9	-32.7	175.2	-69.9	175.2	0	0	0	112.6	W135 L225 L226 N237 V238 V239 C269 A272 V273	W135-L229 HydrophobicContact CH2-CD2 4.18Å; W135-L229 HydrophobicContact CZ2-CD2 3.7Å; W135-L229 HydrophobicContact CZ2-CG 4.49Å; L225-L229 HydrophobicContact CD1-CD1 4.39Å; L225-L229 HydrophobicContact CD1-CG 4.39Å; L225-L229 HydrophobicContact CG-CD1 4.08Å; L225-L229 HydrophobicContact CG-CG 4.45Å; L225-L229 VanDerWaalsContact O-CG 3.29Å; L225-L229 WeakPolarHBondContact O-CG 3.15Å; L225-L229 PolarHBondContact O-N 3.37Å; L226-L229 PolarHBondContact O-N 3.09Å; L229-N237 PolarHBondContact O-ND2 3.35Å; L229-N237 PolarHBondContact O-OD1 3.37Å; L229-V238 HydrophobicContact CD2-CG1 3.54Å; L229-V239 HydrophobicContact CD2-CG2 4.46Å; L229-C269 HydrophobicContact CD2-CB 4.43Å; L229-A272 HydrophobicContact CD1-CB 4.09Å; L229-V273 HydrophobicContact CB-CG2 3.59Å
230	D	85.6	Confident	86	Confident	30 Å²	30	50.2 Å²	50.2	16%	0.16	28%	0.279	C	S	.	.	H	α-helix	trans	-89.2	-15.6	-177.3	-165.6	33.5	0	0	0	112.8	L226 N227 A232 V273 R477	L226-D230 WeakPolarHBondContact O-CB 3.33Å; L226-D230 PolarHBondContact O-N 3.4Å; N227-D230 PolarHBondContact O-N 2.81Å; D230-A232 PolarHBondContact O-N 2.85Å; D230-V273 HydrophobicContact CB-CG1 4.15Å; D230-V273 HydrophobicContact CB-CG2 4.44Å; D230-V273 WeakPolarHBondContact OD1-CG1 3.46Å; D230-R477 VanDerWaalsContact CG-CZ 3.48Å; D230-R477 PolarHBondContact O-NH1 2.88Å; D230-R477 IonicContact OD1-CZ 3.91Å; D230-R477 IonicContact OD1-NH1 3.15Å; D230-R477 PolarHBondContact OD1-NH1 3.24Å; D230-R477 VanDerWaalsContact OD1-NH1 3.13Å; D230-R477 IonicContact OD1-NH2 3.8Å; D230-R477 IonicContact OD2-CZ 3.3Å; D230-R477 IonicContact OD2-NH1 2.68Å; D230-R477 PolarHBondContact OD2-NH1 3.3Å; D230-R477 IonicContact OD2-NH2 3.06Å; D230-R477 PolarHBondContact OD2-NH2 3.44Å
231	D	83	Confident	86.1	Confident	60 Å²	60	47.1 Å²	47.1	32%	0.321	27%	0.267	S	S	.	.			trans	-72.4	95.2	177.5	-175.7	6.7	0	0	0	111.4	N227 T233 S234 N237	N227-D231 VanDerWaalsContact O-CB 3.31Å; N227-D231 WeakPolarHBondContact O-CB 3.49Å; N227-D231 PolarHBondContact O-N 3.16Å; D231-T233 PolarHBondContact O-N 2.93Å; D231-T233 WeakPolarHBondContact OD1-CB 3.39Å; D231-T233 PolarHBondContact OD1-N 2.78Å; D231-T233 PolarHBondContact OD1-OG1 2.82Å; D231-S234 PolarHBondContact OD1-N 3.03Å; D231-S234 WeakPolarHBondContact OD2-CB 3.41Å; D231-N237 PolarHBondContact O-ND2 3.05Å
232	A	71.1	Confident	86.2	Confident	45 Å²	45	46.8 Å²	46.8	37%	0.372	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.8	177.3	0	0	0	0	0	113.6	D230 M481	D230-A232 PolarHBondContact O-N 2.85Å; A232-M481 HydrophobicContact CB-CG 4.43Å; A232-M481 HydrophobicContact CB-SD 4.33Å
233	T	72.1	Confident	86.2	Confident	129 Å²	129	45.1 Å²	45.1	79%	0.791	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-23.3	-179.4	69.4	0	0	0	0	112.8	D231 S235	D231-T233 PolarHBondContact O-N 2.93Å; D231-T233 WeakPolarHBondContact OD1-CB 3.39Å; D231-T233 PolarHBondContact OD1-N 2.78Å; D231-T233 PolarHBondContact OD1-OG1 2.82Å; T233-S235 PolarHBondContact O-N 3.24Å
234	S	77.9	Confident	86.1	Confident	42 Å²	42	41.4 Å²	41.4	29%	0.294	25%	0.247	S	C	.	.			trans	-69.9	125.1	178	-179.7	0	0	0	0	111.5	D231 L236 N237	D231-S234 PolarHBondContact OD1-N 3.03Å; D231-S234 WeakPolarHBondContact OD2-CB 3.41Å; S234-L236 PolarHBondContact O-N 2.94Å; S234-L236 PolarHBondContact OG-N 3.49Å; S234-N237 WeakPolarHBondContact O-CB 3.42Å; S234-N237 PolarHBondContact O-N 3.34Å
235	S	74.6	Confident	86	Confident	101 Å²	101	39.6 Å²	39.6	71%	0.706	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17	171.9	58	0	0	0	0	113.1	Q143 T233	Q143-S235 PolarHBondContact NE2-O 3.2Å; T233-S235 PolarHBondContact O-N 3.24Å
236	L	80.6	Confident	85.9	Confident	57 Å²	57	39.4 Å²	39.4	30%	0.298	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.4	178.4	-74.6	157.4	0	0	0	112.6	C139 M140 S234 V238	C139-L236 HydrophobicContact CB-CD2 4.08Å; M140-L236 HydrophobicContact CE-CD1 4.49Å; M140-L236 HydrophobicContact CG-CD2 3.98Å; S234-L236 PolarHBondContact O-N 2.94Å; S234-L236 PolarHBondContact OG-N 3.49Å; L236-V238 PolarHBondContact O-N 3.34Å; L236-V238 VanDerWaalsContact O-N 3.14Å
237	N	85.6	Confident	85.8	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	23%	0.227	C	C	.	.			trans	-61.8	121.1	176.5	-170.5	-29.3	0	0	0	109.7	L229 D231 S234 V239 P240 V241	L229-N237 PolarHBondContact O-ND2 3.35Å; L229-N237 PolarHBondContact O-OD1 3.37Å; D231-N237 PolarHBondContact O-ND2 3.05Å; S234-N237 WeakPolarHBondContact O-CB 3.42Å; S234-N237 PolarHBondContact O-N 3.34Å; N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 PolarHBondContact O-N 2.92Å; N237-V239 WeakPolarHBondContact OD1-CB 3.39Å; N237-V239 PolarHBondContact OD1-N 2.63Å; N237-P240 HydrophobicContact CB-CG 4.31Å; N237-P240 WeakPolarHBondContact O-CD 3.39Å; N237-P240 VanDerWaalsContact OD1-CD 3.31Å; N237-P240 WeakPolarHBondContact OD1-CD 3.39Å; N237-V241 WeakPolarHBondContact O-CG2 3.08Å
238	V	91.6	Very high	85.6	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.024	21%	0.214	C	C	.	.	H	α-helix	trans	-70.2	-26.2	-177.5	76.5	0	0	0	0	112.2	W135 L142 M187 L229 L236 V241 L242 L265	W135-V238 HydrophobicContact CH2-CG1 4.18Å; W135-V238 HydrophobicContact CZ2-CB 4.49Å; W135-V238 HydrophobicContact CZ2-CG1 4Å; L142-V238 HydrophobicContact CD2-CG2 3.87Å; M187-V238 HydrophobicContact CE-CB 4.13Å; M187-V238 HydrophobicContact CE-CG2 3.49Å; M187-V238 VanDerWaalsContact CE-CG2 3.49Å; M187-V238 HydrophobicContact SD-CG2 4.46Å; L229-V238 HydrophobicContact CD2-CG1 3.54Å; L236-V238 PolarHBondContact O-N 3.34Å; L236-V238 VanDerWaalsContact O-N 3.14Å; V238-V241 WeakPolarHBondContact O-CB 3.35Å; V238-V241 PolarHBondContact O-N 3.32Å; V238-L242 HydrophobicContact CG1-CD1 4.34Å; V238-L242 HydrophobicContact CG2-CD1 3.88Å; V238-L242 HydrophobicContact CG2-CG 3.97Å; V238-L242 VanDerWaalsContact O-CG 3.22Å; V238-L242 WeakPolarHBondContact O-CG 3.32Å; V238-L242 PolarHBondContact O-N 3.29Å; V238-L265 HydrophobicContact CG2-CD2 4.48Å
239	V	91.6	Very high	85.4	Confident	5 Å²	5	33 Å²	33	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-65.7	-50.5	-173.7	176.3	0	0	0	0	112.5	L229 N237 V241 L242 F243 L266 C269 M481	L229-V239 HydrophobicContact CD2-CG2 4.46Å; N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 PolarHBondContact O-N 2.92Å; N237-V239 WeakPolarHBondContact OD1-CB 3.39Å; N237-V239 PolarHBondContact OD1-N 2.63Å; V239-V241 VanDerWaalsContact C-N 3.29Å; V239-V241 PolarHBondContact O-N 3Å; V239-L242 PolarHBondContact O-N 3.27Å; V239-F243 HydrophobicContact CG1-CD2 3.84Å; V239-F243 HydrophobicContact CG1-CE2 3.59Å; V239-F243 VanDerWaalsContact O-CD2 3.26Å; V239-F243 WeakPolarHBondContact O-CD2 3.26Å; V239-F243 PolarHBondContact O-N 3.49Å; V239-L266 HydrophobicContact CG1-CD1 4.09Å; V239-C269 HydrophobicContact CG2-CB 3.82Å; V239-M481 HydrophobicContact CB-CE 3.87Å; V239-M481 HydrophobicContact CG1-CE 3.77Å
240	P	89.3	Confident	85.1	Confident	52 Å²	52	33.3 Å²	33.3	34%	0.338	20%	0.201	S	C	.	.	H	α-helix	trans	-57.3	-40.9	171	-23.2	32.4	0	0	0	113	N237 F243 D244 M481	N237-P240 HydrophobicContact CB-CG 4.31Å; N237-P240 WeakPolarHBondContact O-CD 3.39Å; N237-P240 VanDerWaalsContact OD1-CD 3.31Å; N237-P240 WeakPolarHBondContact OD1-CD 3.39Å; P240-F243 PolarHBondContact O-N 2.74Å; P240-D244 WeakPolarHBondContact O-CB 3.31Å; P240-D244 PolarHBondContact O-N 2.91Å; P240-M481 HydrophobicContact CG-CE 3.35Å
241	V	90.7	Very high	84.8	Confident	26 Å²	26	35 Å²	35	16%	0.158	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-46.9	-179.7	176.1	0	0	0	0	110.4	L142 I146 N237 V238 V239 F243 D244 M245	L142-V241 HydrophobicContact CD2-CG1 4.34Å; I146-V241 HydrophobicContact CD1-CG1 3.33Å; N237-V241 WeakPolarHBondContact O-CG2 3.08Å; V238-V241 WeakPolarHBondContact O-CB 3.35Å; V238-V241 PolarHBondContact O-N 3.32Å; V239-V241 VanDerWaalsContact C-N 3.29Å; V239-V241 PolarHBondContact O-N 3Å; V241-F243 PolarHBondContact O-N 3.5Å; V241-D244 PolarHBondContact O-N 3.11Å; V241-M245 WeakPolarHBondContact O-CG 3.41Å; V241-M245 PolarHBondContact O-N 3.43Å
242	L	93.4	Very high	84.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-37.6	177.4	-66.3	168.7	0	0	0	112.5	L184 V238 V239 D244 M245 L246 V262 L265 L266	L184-L242 HydrophobicContact CD2-CD2 3.84Å; V238-L242 HydrophobicContact CG1-CD1 4.34Å; V238-L242 HydrophobicContact CG2-CD1 3.88Å; V238-L242 HydrophobicContact CG2-CG 3.97Å; V238-L242 VanDerWaalsContact O-CG 3.22Å; V238-L242 WeakPolarHBondContact O-CG 3.32Å; V238-L242 PolarHBondContact O-N 3.29Å; V239-L242 PolarHBondContact O-N 3.27Å; L242-D244 VanDerWaalsContact C-N 3.31Å; L242-M245 HydrophobicContact CD2-SD 4.2Å; L242-M245 PolarHBondContact O-N 2.82Å; L242-L246 WeakPolarHBondContact O-CB 3.39Å; L242-L246 PolarHBondContact O-N 3Å; L242-V262 HydrophobicContact CB-CG1 4.39Å; L242-V262 HydrophobicContact CD2-CG1 4.01Å; L242-L265 HydrophobicContact CD1-CB 4.29Å; L242-L265 HydrophobicContact CD1-CD2 3.82Å; L242-L265 HydrophobicContact CD1-CG 3.72Å; L242-L265 HydrophobicContact CD2-CD2 4.05Å; L242-L266 HydrophobicContact CB-CB 4.17Å; L242-L266 HydrophobicContact CB-CD1 4.06Å; L242-L266 HydrophobicContact CB-CD2 4.37Å; L242-L266 HydrophobicContact CB-CG 4.43Å; L242-L266 HydrophobicContact CD1-CB 4.09Å; L242-L266 HydrophobicContact CD1-CD1 4.43Å
243	F	90.8	Very high	84.7	Confident	15 Å²	15	34.7 Å²	34.7	7%	0.066	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-37.9	173.1	-82.7	-51.7	0	0	0	112.3	V239 P240 V241 S247 L266 L270 L478 I482 L489	V239-F243 HydrophobicContact CG1-CD2 3.84Å; V239-F243 HydrophobicContact CG1-CE2 3.59Å; V239-F243 VanDerWaalsContact O-CD2 3.26Å; V239-F243 WeakPolarHBondContact O-CD2 3.26Å; V239-F243 PolarHBondContact O-N 3.49Å; P240-F243 PolarHBondContact O-N 2.74Å; V241-F243 PolarHBondContact O-N 3.5Å; F243-S247 WeakPolarHBondContact O-CB 3.45Å; F243-S247 PolarHBondContact O-N 3.41Å; F243-S247 PolarHBondContact O-OG 3.35Å; F243-L266 HydrophobicContact CD1-CD1 4.32Å; F243-L266 HydrophobicContact CD1-CD2 3.65Å; F243-L266 HydrophobicContact CD2-CD1 4.26Å; F243-L266 HydrophobicContact CE1-CD1 4.14Å; F243-L266 HydrophobicContact CE1-CD2 3.7Å; F243-L266 HydrophobicContact CE1-CG 4.31Å; F243-L266 HydrophobicContact CE2-CD1 4.06Å; F243-L266 HydrophobicContact CG-CD1 4.4Å; F243-L266 HydrophobicContact CG-CD2 4.32Å; F243-L266 HydrophobicContact CZ-CD1 4Å; F243-L266 HydrophobicContact CZ-CD2 4.39Å; F243-L270 HydrophobicContact CZ-CD1 4.32Å; F243-L270 HydrophobicContact CZ-CD2 4.28Å; F243-L478 HydrophobicContact CE2-CD1 3.84Å; F243-L478 HydrophobicContact CZ-CD1 4.19Å; F243-I482 HydrophobicContact CE2-CD1 4.35Å; F243-I482 HydrophobicContact CE2-CG1 4Å; F243-I482 HydrophobicContact CZ-CD1 3.94Å; F243-I482 HydrophobicContact CZ-CG1 3.97Å; F243-L489 HydrophobicContact CD1-CD1 3.41Å; F243-L489 VanDerWaalsContact CD1-CD1 3.41Å; F243-L489 HydrophobicContact CD1-CD2 3.76Å; F243-L489 HydrophobicContact CD1-CG 4.22Å; F243-L489 HydrophobicContact CE1-CD1 3.8Å; F243-L489 HydrophobicContact CE1-CD2 3.56Å; F243-L489 HydrophobicContact CE1-CG 4.31Å; F243-L489 HydrophobicContact CG-CD1 4.5Å; F243-L489 HydrophobicContact CZ-CD2 4.35Å
244	D	88.6	Confident	85	Confident	52 Å²	52	28.6 Å²	28.6	28%	0.278	18%	0.182	S	C	.	.	H	α-helix	trans	-70.2	-44.6	176.7	-168.4	50.8	0	0	0	111.3	P240 V241 L242 L246 S247 R248	P240-D244 WeakPolarHBondContact O-CB 3.31Å; P240-D244 PolarHBondContact O-N 2.91Å; V241-D244 PolarHBondContact O-N 3.11Å; L242-D244 VanDerWaalsContact C-N 3.31Å; D244-L246 VanDerWaalsContact C-N 3.33Å; D244-L246 PolarHBondContact O-N 3.02Å; D244-S247 WeakPolarHBondContact O-CB 3.43Å; D244-S247 PolarHBondContact O-N 3.33Å; D244-R248 WeakPolarHBondContact O-CG 3.39Å; D244-R248 PolarHBondContact O-N 3.39Å; D244-R248 IonicContact OD1-NE 2.85Å; D244-R248 IonicContact OD2-CZ 3.39Å; D244-R248 IonicContact OD2-NE 3.97Å; D244-R248 PolarHBondContact OD2-NE 3.35Å; D244-R248 IonicContact OD2-NH2 3.35Å; D244-R248 PolarHBondContact OD2-NH2 2.56Å
245	M	90.1	Very high	84.9	Confident	1 Å²	1	28 Å²	28	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-54.1	-48.4	171.9	-71.7	-178.5	82.7	0	0	111.8	L142 I146 V241 L242 S247 R248 F249 Y257 V262	L142-M245 HydrophobicContact CD1-SD 4.37Å; I146-M245 HydrophobicContact CD1-CE 4.2Å; I146-M245 HydrophobicContact CD1-CG 3.67Å; I146-M245 HydrophobicContact CD1-SD 3.46Å; I146-M245 WeakPolarHBondContact CD1-SD 3.3Å; I146-M245 HydrophobicContact CG1-CE 4.09Å; I146-M245 HydrophobicContact CG1-CG 4.15Å; I146-M245 HydrophobicContact CG1-SD 4.01Å; V241-M245 WeakPolarHBondContact O-CG 3.41Å; V241-M245 PolarHBondContact O-N 3.43Å; L242-M245 HydrophobicContact CD2-SD 4.2Å; L242-M245 PolarHBondContact O-N 2.82Å; M245-S247 VanDerWaalsContact C-N 3.31Å; M245-S247 PolarHBondContact O-N 3.46Å; M245-R248 PolarHBondContact O-N 3.3Å; M245-F249 WeakPolarHBondContact O-CB 3.43Å; M245-F249 PolarHBondContact O-N 2.7Å; M245-Y257 HydrophobicContact CB-CD2 3.97Å; M245-Y257 HydrophobicContact CB-CE2 3.91Å; M245-Y257 HydrophobicContact CE-CD1 4.03Å; M245-Y257 HydrophobicContact CE-CD2 3.96Å; M245-Y257 HydrophobicContact CE-CE1 4.13Å; M245-Y257 HydrophobicContact CE-CE2 4.1Å; M245-Y257 HydrophobicContact CE-CG 3.93Å; M245-Y257 HydrophobicContact CG-CD2 4.32Å; M245-Y257 HydrophobicContact CG-CE2 3.92Å; M245-V262 HydrophobicContact CB-CG1 4.34Å; M245-V262 HydrophobicContact CE-CG2 3.85Å; M245-V262 HydrophobicContact SD-CG2 4.21Å
246	L	90	Very high	85	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-42.9	176.3	171.6	60.9	0	0	0	111.5	L242 D244 C250 I259 L263 L266 L489 L493 V496	L242-L246 WeakPolarHBondContact O-CB 3.39Å; L242-L246 PolarHBondContact O-N 3Å; D244-L246 VanDerWaalsContact C-N 3.33Å; D244-L246 PolarHBondContact O-N 3.02Å; L246-C250 WeakPolarHBondContact O-CB 3.33Å; L246-C250 PolarHBondContact O-N 2.7Å; L246-C250 PolarHBondContact O-SG 3.02Å; L246-I259 HydrophobicContact CD1-CD1 3.7Å; L246-L263 HydrophobicContact CD1-CD2 4.04Å; L246-L263 HydrophobicContact CD2-CD2 4.08Å; L246-L266 HydrophobicContact CD2-CD2 4.26Å; L246-L489 HydrophobicContact CD2-CD1 3.47Å; L246-L489 VanDerWaalsContact CD2-CD1 3.47Å; L246-L489 HydrophobicContact CG-CD1 4.25Å; L246-L493 HydrophobicContact CD2-CD2 3.63Å; L246-L493 HydrophobicContact CD2-CG 4.11Å; L246-V496 HydrophobicContact CD1-CG2 4.49Å
247	S	87.6	Confident	85.2	Confident	15 Å²	15	21.3 Å²	21.3	11%	0.105	13%	0.133	C	C	.	.	H	α-helix	trans	-65.4	-42.9	179.4	-61.7	0	0	0	0	112	F243 D244 M245 C250 A251	F243-S247 WeakPolarHBondContact O-CB 3.45Å; F243-S247 PolarHBondContact O-N 3.41Å; F243-S247 PolarHBondContact O-OG 3.35Å; D244-S247 WeakPolarHBondContact O-CB 3.43Å; D244-S247 PolarHBondContact O-N 3.33Å; M245-S247 VanDerWaalsContact C-N 3.31Å; M245-S247 PolarHBondContact O-N 3.46Å; S247-C250 PolarHBondContact O-N 2.87Å; S247-A251 WeakPolarHBondContact O-CB 3.31Å; S247-A251 PolarHBondContact O-N 3.05Å
248	R	85.1	Confident	85.4	Confident	48 Å²	48	21.1 Å²	21.1	18%	0.181	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-42.5	176.7	-67.5	-179.4	-166.9	-160.1	8.9	112.1	D244 M245 A251 G252 L253 V254 Y257	D244-R248 WeakPolarHBondContact O-CG 3.39Å; D244-R248 PolarHBondContact O-N 3.39Å; D244-R248 IonicContact OD1-NE 2.85Å; D244-R248 IonicContact OD2-CZ 3.39Å; D244-R248 IonicContact OD2-NE 3.97Å; D244-R248 PolarHBondContact OD2-NE 3.35Å; D244-R248 IonicContact OD2-NH2 3.35Å; D244-R248 PolarHBondContact OD2-NH2 2.56Å; M245-R248 PolarHBondContact O-N 3.3Å; R248-A251 PolarHBondContact O-N 3.2Å; R248-G252 PolarHBondContact O-N 3.44Å; R248-L253 PolarHBondContact O-N 2.68Å; R248-L253 VanDerWaalsContact O-N 3.13Å; R248-V254 HydrophobicContact CB-CG2 4.34Å; R248-Y257 HydrophobicContact CB-CE2 4.44Å
249	F	84.3	Confident	85.3	Confident	3 Å²	3	21.1 Å²	21.1	1%	0.013	13%	0.131	C	C	.	.	H	α-helix	trans	-60.3	-48.2	174.3	177.2	-99.8	0	0	0	111.5	M245 A251 G252 Y257 I259 V496 V511	M245-F249 WeakPolarHBondContact O-CB 3.43Å; M245-F249 PolarHBondContact O-N 2.7Å; F249-A251 PolarHBondContact O-N 3.45Å; F249-G252 WeakPolarHBondContact O-CA 3.31Å; F249-G252 PolarHBondContact O-N 2.73Å; F249-Y257 HydrophobicContact CB-CD2 4.45Å; F249-I259 HydrophobicContact CB-CD1 4.14Å; F249-I259 HydrophobicContact CD1-CB 4.03Å; F249-I259 HydrophobicContact CD1-CD1 3.39Å; F249-I259 HydrophobicContact CD1-CG1 3.57Å; F249-I259 HydrophobicContact CD2-CB 4.46Å; F249-I259 HydrophobicContact CE1-CB 3.64Å; F249-I259 HydrophobicContact CE1-CD1 3.85Å; F249-I259 HydrophobicContact CE1-CG1 3.43Å; F249-I259 VanDerWaalsContact CE1-CG1 3.43Å; F249-I259 HydrophobicContact CE1-CG2 3.89Å; F249-I259 HydrophobicContact CE2-CB 4.13Å; F249-I259 HydrophobicContact CE2-CG2 4.46Å; F249-I259 HydrophobicContact CG-CB 4.41Å; F249-I259 HydrophobicContact CG-CD1 3.8Å; F249-I259 HydrophobicContact CG-CG1 4.26Å; F249-I259 HydrophobicContact CZ-CB 3.69Å; F249-I259 HydrophobicContact CZ-CG1 4.05Å; F249-I259 HydrophobicContact CZ-CG2 3.73Å; F249-V496 HydrophobicContact CE1-CG2 4.35Å; F249-V511 HydrophobicContact CD1-CG1 3.75Å; F249-V511 HydrophobicContact CE1-CB 4.28Å; F249-V511 HydrophobicContact CE1-CG1 3.15Å; F249-V511 HydrophobicContact CE2-CG1 4.07Å; F249-V511 HydrophobicContact CG-CG1 4.44Å; F249-V511 HydrophobicContact CZ-CG1 3.34Å
250	C	83.2	Confident	85.3	Confident	10 Å²	10	21 Å²	21	7%	0.068	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-24	179.5	-67.5	0	0	0	0	113.7	L246 S247 G492	L246-C250 WeakPolarHBondContact O-CB 3.33Å; L246-C250 PolarHBondContact O-N 2.7Å; L246-C250 PolarHBondContact O-SG 3.02Å; S247-C250 PolarHBondContact O-N 2.87Å; C250-G492 VanDerWaalsContact SG-C 3.52Å; C250-G492 WeakPolarHBondContact SG-CA 3.42Å
251	A	80.5	Confident	85.5	Confident	67 Å²	67	18.6 Å²	18.6	55%	0.554	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.1	171.8	0	0	0	0	0	112.9	S247 R248 F249 L253	S247-A251 WeakPolarHBondContact O-CB 3.31Å; S247-A251 PolarHBondContact O-N 3.05Å; R248-A251 PolarHBondContact O-N 3.2Å; F249-A251 PolarHBondContact O-N 3.45Å; A251-L253 HydrophobicContact CB-CD1 4.01Å; A251-L253 HydrophobicContact CB-CG 3.89Å; A251-L253 PolarHBondContact O-N 2.98Å
252	G	74.5	Confident	85.7	Confident	32 Å²	32	17.3 Å²	17.3	33%	0.33	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	16.1	-177.6	0	0	0	0	0	113.7	R248 F249	R248-G252 PolarHBondContact O-N 3.44Å; F249-G252 WeakPolarHBondContact O-CA 3.31Å; F249-G252 PolarHBondContact O-N 2.73Å
253	L	77.5	Confident	85.8	Confident	66 Å²	66	17.3 Å²	17.3	35%	0.346	11%	0.107	S	C	.	.	S	Bend	trans	-77.4	-34.8	-178.6	-61.5	172.9	0	0	0	111.8	W150 R248 A251	W150-L253 HydrophobicContact CH2-CD1 3.99Å; W150-L253 HydrophobicContact CZ3-CB 4.07Å; W150-L253 HydrophobicContact CZ3-CD1 3.93Å; R248-L253 PolarHBondContact O-N 2.68Å; R248-L253 VanDerWaalsContact O-N 3.13Å; A251-L253 HydrophobicContact CB-CD1 4.01Å; A251-L253 HydrophobicContact CB-CG 3.89Å; A251-L253 PolarHBondContact O-N 2.98Å
254	V	78.5	Confident	86	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.104	C	C	.	.			trans	-138	80.6	-173.3	-163.2	0	0	0	0	109.1	W150 R248 H256 Y257	W150-V254 HydrophobicContact CE3-CG2 4.04Å; W150-V254 HydrophobicContact CZ3-CG2 4.31Å; R248-V254 HydrophobicContact CB-CG2 4.34Å; V254-H256 VanDerWaalsContact C-N 3.26Å; V254-H256 WeakPolarHBondContact CG1-CE1 3.37Å; V254-H256 VanDerWaalsContact CG1-ND1 3.34Å; V254-H256 WeakPolarHBondContact CG1-ND1 3.48Å; V254-H256 PolarHBondContact O-N 3.47Å; V254-Y257 HydrophobicContact CB-CD1 4.44Å; V254-Y257 HydrophobicContact CB-CD2 4.16Å; V254-Y257 HydrophobicContact CB-CE1 4.29Å; V254-Y257 HydrophobicContact CB-CE2 3.95Å; V254-Y257 HydrophobicContact CB-CG 4.39Å; V254-Y257 HydrophobicContact CG1-CD1 3.61Å; V254-Y257 HydrophobicContact CG1-CD2 4.18Å; V254-Y257 HydrophobicContact CG1-CE1 3.4Å; V254-Y257 VanDerWaalsContact CG1-CE1 3.4Å; V254-Y257 HydrophobicContact CG1-CE2 3.97Å; V254-Y257 HydrophobicContact CG1-CG 4.01Å; V254-Y257 HydrophobicContact CG2-CE2 4.35Å
255	P	74.1	Confident	86.4	Confident	29 Å²	29	14.1 Å²	14.1	19%	0.188	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-15.2	-173.9	29.1	-34.5	0	0	0	113.7	F164 Y257	F164-P255 HydrophobicContact CB-CG 4.39Å; P255-Y257 VanDerWaalsContact C-N 3.31Å; P255-Y257 PolarHBondContact O-N 3.05Å
256	H	76.9	Confident	86.7	Confident	14 Å²	14	14.1 Å²	14.1	7%	0.065	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.6	-176.9	63.3	-85.6	0	0	0	115	S149 S173 S177 V254 Y515	S149-H256 WeakPolarHBondContact CB-NE2 3.32Å; S149-H256 PolarHBondContact OG-NE2 2.85Å; S173-H256 WeakPolarHBondContact OG-CB 3.46Å; S177-H256 WeakPolarHBondContact CB-O 3.37Å; S177-H256 PolarHBondContact OG-O 3.19Å; V254-H256 VanDerWaalsContact C-N 3.26Å; V254-H256 WeakPolarHBondContact CG1-CE1 3.37Å; V254-H256 VanDerWaalsContact CG1-ND1 3.34Å; V254-H256 WeakPolarHBondContact CG1-ND1 3.48Å; V254-H256 PolarHBondContact O-N 3.47Å; H256-Y515 VanDerWaalsContact CA-CE1 3.41Å; H256-Y515 HydrophobicContact CB-CD1 4.22Å; H256-Y515 HydrophobicContact CB-CE1 3.49Å; H256-Y515 VanDerWaalsContact CB-CE1 3.49Å
257	Y	86.6	Confident	87	Confident	4 Å²	4	14.2 Å²	14.2	2%	0.016	9%	0.091	C	C	.	.	S	Bend	trans	-64.1	132.6	175.5	-75.3	-9.5	0	0	0	111.5	L180 M245 R248 F249 V254 P255 I259	L180-Y257 HydrophobicContact CD1-CD1 3.87Å; L180-Y257 HydrophobicContact CD1-CE1 3.94Å; M245-Y257 HydrophobicContact CB-CD2 3.97Å; M245-Y257 HydrophobicContact CB-CE2 3.91Å; M245-Y257 HydrophobicContact CE-CD1 4.03Å; M245-Y257 HydrophobicContact CE-CD2 3.96Å; M245-Y257 HydrophobicContact CE-CE1 4.13Å; M245-Y257 HydrophobicContact CE-CE2 4.1Å; M245-Y257 HydrophobicContact CE-CG 3.93Å; M245-Y257 HydrophobicContact CG-CD2 4.32Å; M245-Y257 HydrophobicContact CG-CE2 3.92Å; R248-Y257 HydrophobicContact CB-CE2 4.44Å; F249-Y257 HydrophobicContact CB-CD2 4.45Å; V254-Y257 HydrophobicContact CB-CD1 4.44Å; V254-Y257 HydrophobicContact CB-CD2 4.16Å; V254-Y257 HydrophobicContact CB-CE1 4.29Å; V254-Y257 HydrophobicContact CB-CE2 3.95Å; V254-Y257 HydrophobicContact CB-CG 4.39Å; V254-Y257 HydrophobicContact CG1-CD1 3.61Å; V254-Y257 HydrophobicContact CG1-CD2 4.18Å; V254-Y257 HydrophobicContact CG1-CE1 3.4Å; V254-Y257 VanDerWaalsContact CG1-CE1 3.4Å; V254-Y257 HydrophobicContact CG1-CE2 3.97Å; V254-Y257 HydrophobicContact CG1-CG 4.01Å; V254-Y257 HydrophobicContact CG2-CE2 4.35Å; P255-Y257 VanDerWaalsContact C-N 3.31Å; P255-Y257 PolarHBondContact O-N 3.05Å; Y257-I259 VanDerWaalsContact C-N 3.27Å; Y257-I259 PolarHBondContact O-N 3.35Å
258	P	88.9	Confident	87.3	Confident	1 Å²	1	13.5 Å²	13.5	1%	0.006	9%	0.086	C	C	.	.			trans	-75.2	79.8	178.9	32.4	-36.8	0	0	0	110.6	L180 R181 L184 R260 K261 V262 E516	L180-P258 HydrophobicContact CB-CG 4.44Å; R181-P258 HydrophobicContact CG-CB 3.48Å; R181-P258 VanDerWaalsContact CG-CB 3.48Å; R181-P258 HydrophobicContact CG-CG 3.73Å; L184-P258 HydrophobicContact CD1-CG 3.61Å; P258-R260 PolarHBondContact O-N 2.84Å; P258-R260 VanDerWaalsContact O-N 3.14Å; P258-K261 HydrophobicContact CB-CB 4.47Å; P258-K261 HydrophobicContact CB-CD 4.47Å; P258-K261 HydrophobicContact CB-CG 4.35Å; P258-K261 PolarHBondContact O-N 2.87Å; P258-V262 PolarHBondContact O-N 3.07Å; P258-V262 VanDerWaalsContact O-N 3.09Å; P258-E516 HydrophobicContact CB-CG 4.25Å
259	I	88.9	Confident	87.8	Confident	3 Å²	3	11.2 Å²	11.2	2%	0.015	8%	0.078	C	C	.	.	H	α-helix	trans	-59.4	-31.7	-167.8	-165.1	62	0	0	0	113.4	L246 F249 Y257 L263 I513 I550	L246-I259 HydrophobicContact CD1-CD1 3.7Å; F249-I259 HydrophobicContact CB-CD1 4.14Å; F249-I259 HydrophobicContact CD1-CB 4.03Å; F249-I259 HydrophobicContact CD1-CD1 3.39Å; F249-I259 HydrophobicContact CD1-CG1 3.57Å; F249-I259 HydrophobicContact CD2-CB 4.46Å; F249-I259 HydrophobicContact CE1-CB 3.64Å; F249-I259 HydrophobicContact CE1-CD1 3.85Å; F249-I259 HydrophobicContact CE1-CG1 3.43Å; F249-I259 VanDerWaalsContact CE1-CG1 3.43Å; F249-I259 HydrophobicContact CE1-CG2 3.89Å; F249-I259 HydrophobicContact CE2-CB 4.13Å; F249-I259 HydrophobicContact CE2-CG2 4.46Å; F249-I259 HydrophobicContact CG-CB 4.41Å; F249-I259 HydrophobicContact CG-CD1 3.8Å; F249-I259 HydrophobicContact CG-CG1 4.26Å; F249-I259 HydrophobicContact CZ-CB 3.69Å; F249-I259 HydrophobicContact CZ-CG1 4.05Å; F249-I259 HydrophobicContact CZ-CG2 3.73Å; Y257-I259 VanDerWaalsContact C-N 3.27Å; Y257-I259 PolarHBondContact O-N 3.35Å; I259-L263 HydrophobicContact CD1-CG 4.42Å; I259-L263 HydrophobicContact CG1-CD1 3.97Å; I259-L263 HydrophobicContact CG1-CG 4.25Å; I259-L263 WeakPolarHBondContact O-CB 3.3Å; I259-L263 VanDerWaalsContact O-CG 3.23Å; I259-L263 WeakPolarHBondContact O-CG 3.4Å; I259-L263 PolarHBondContact O-N 3.37Å; I259-I513 HydrophobicContact CG2-CG2 4.25Å; I259-I550 HydrophobicContact CG2-CD1 4.08Å
260	R	91.7	Very high	88.2	Confident	3 Å²	3	11.2 Å²	11.2	1%	0.011	8%	0.078	C	C	.	.	H	α-helix	trans	-60	-51.3	175.2	176.9	-176	46.3	163.7	7.9	110.4	E44 P258 L263 L264 E516 Q546 I549 I550	E44-R260 IonicContact OE2-NH2 3.67Å; E44-R260 PolarHBondContact OE2-NH2 3.49Å; P258-R260 PolarHBondContact O-N 2.84Å; P258-R260 VanDerWaalsContact O-N 3.14Å; R260-L263 PolarHBondContact O-N 2.98Å; R260-L264 HydrophobicContact CG-CD1 3.92Å; R260-L264 WeakPolarHBondContact O-CB 3.43Å; R260-L264 WeakPolarHBondContact O-CG 3.45Å; R260-L264 PolarHBondContact O-N 3.32Å; R260-E516 WeakPolarHBondContact CB-OE2 3.46Å; R260-E516 IonicContact CZ-OE1 2.83Å; R260-E516 IonicContact NE-OE1 2.73Å; R260-E516 PolarHBondContact NE-OE1 3.39Å; R260-E516 IonicContact NE-OE2 3.71Å; R260-E516 PolarHBondContact NE-OE2 3.01Å; R260-E516 IonicContact NH2-OE1 3.41Å; R260-E516 PolarHBondContact NH2-OE1 3.01Å; R260-E516 IonicContact NH2-OE2 2.62Å; R260-Q546 HydrophobicContact CB-CG 4.29Å; R260-I549 HydrophobicContact CG-CG2 4.07Å; R260-I550 HydrophobicContact CB-CD1 4.29Å; R260-I550 HydrophobicContact CB-CG1 4.35Å
261	K	93.8	Very high	88.7	Confident	1 Å²	1	11 Å²	11	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-66.4	-40.1	-177.9	-53.7	-167.7	-169.2	-79.4	0	111.3	M39 E44 R181 L184 P258 L263 L264 L265 E516	M39-K261 PolarHBondContact O-NZ 2.97Å; M39-K261 HydrophobicContact SD-CB 3.86Å; M39-K261 HydrophobicContact SD-CD 3.64Å; M39-K261 HydrophobicContact SD-CG 3.49Å; M39-K261 WeakPolarHBondContact SD-CG 3.48Å; E44-K261 WeakPolarHBondContact OE1-CE 3.33Å; E44-K261 IonicContact OE1-NZ 3.52Å; E44-K261 PolarHBondContact OE1-NZ 2.94Å; E44-K261 IonicContact OE2-NZ 3.58Å; E44-K261 PolarHBondContact OE2-NZ 3.07Å; R181-K261 HydrophobicContact CB-CD 4.18Å; R181-K261 HydrophobicContact CG-CD 4.21Å; R181-K261 WeakPolarHBondContact O-CD 3.18Å; L184-K261 HydrophobicContact CB-CB 4.03Å; L184-K261 HydrophobicContact CD1-CB 4.22Å; P258-K261 HydrophobicContact CB-CB 4.47Å; P258-K261 HydrophobicContact CB-CD 4.47Å; P258-K261 HydrophobicContact CB-CG 4.35Å; P258-K261 PolarHBondContact O-N 2.87Å; K261-L263 PolarHBondContact O-N 2.96Å; K261-L264 PolarHBondContact O-N 3.11Å; K261-L265 WeakPolarHBondContact O-CB 3.33Å; K261-L265 PolarHBondContact O-N 3.09Å; K261-E516 VanDerWaalsContact CE-OE1 3.23Å; K261-E516 WeakPolarHBondContact CE-OE1 3.18Å; K261-E516 WeakPolarHBondContact CG-OE1 3.28Å; K261-E516 IonicContact NZ-OE1 3.47Å
262	V	94.7	Very high	89.3	Confident	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-58.2	-48	173.5	174.2	0	0	0	0	111.2	L184 L242 M245 P258 L266	L184-V262 HydrophobicContact CD1-CG2 3.69Å; L242-V262 HydrophobicContact CB-CG1 4.39Å; L242-V262 HydrophobicContact CD2-CG1 4.01Å; M245-V262 HydrophobicContact CB-CG1 4.34Å; M245-V262 HydrophobicContact CE-CG2 3.85Å; M245-V262 HydrophobicContact SD-CG2 4.21Å; P258-V262 PolarHBondContact O-N 3.07Å; P258-V262 VanDerWaalsContact O-N 3.09Å; V262-L266 WeakPolarHBondContact O-CB 3.41Å; V262-L266 PolarHBondContact O-N 3.42Å
263	L	95.4	Very high	90	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-68.4	-39.9	-179.5	-73.3	170.7	0	0	0	112.8	L246 I259 R260 K261 W267 L493 V496 I550 C553 V554 M557	L246-L263 HydrophobicContact CD1-CD2 4.04Å; L246-L263 HydrophobicContact CD2-CD2 4.08Å; I259-L263 HydrophobicContact CD1-CG 4.42Å; I259-L263 HydrophobicContact CG1-CD1 3.97Å; I259-L263 HydrophobicContact CG1-CG 4.25Å; I259-L263 WeakPolarHBondContact O-CB 3.3Å; I259-L263 VanDerWaalsContact O-CG 3.23Å; I259-L263 WeakPolarHBondContact O-CG 3.4Å; I259-L263 PolarHBondContact O-N 3.37Å; R260-L263 PolarHBondContact O-N 2.98Å; K261-L263 PolarHBondContact O-N 2.96Å; L263-W267 WeakPolarHBondContact O-CB 3.36Å; L263-W267 PolarHBondContact O-N 3.49Å; L263-L493 HydrophobicContact CD2-CD2 4.05Å; L263-V496 HydrophobicContact CD1-CG1 3.99Å; L263-I550 HydrophobicContact CD1-CG1 4.26Å; L263-I550 HydrophobicContact CD1-CG2 4Å; L263-C553 HydrophobicContact CB-CB 4.22Å; L263-V554 HydrophobicContact CD1-CG2 3.94Å; L263-V554 HydrophobicContact CD2-CG2 4.28Å; L263-M557 HydrophobicContact CD2-CE 4.47Å; L263-M557 HydrophobicContact CD2-SD 4.08Å
264	L	96.2	Very high	90.7	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-61	-52.9	175.9	-82	169.5	0	0	0	110.6	M39 Y188 R260 K261 L266 W267 K268 I549 C553	M39-L264 HydrophobicContact CE-CB 4.17Å; M39-L264 HydrophobicContact CE-CD1 4.1Å; Y188-L264 HydrophobicContact CD2-CB 4.04Å; Y188-L264 HydrophobicContact CE2-CB 3.74Å; Y188-L264 HydrophobicContact CE2-CD2 4.34Å; R260-L264 HydrophobicContact CG-CD1 3.92Å; R260-L264 WeakPolarHBondContact O-CB 3.43Å; R260-L264 WeakPolarHBondContact O-CG 3.45Å; R260-L264 PolarHBondContact O-N 3.32Å; K261-L264 PolarHBondContact O-N 3.11Å; L264-L266 PolarHBondContact O-N 3.2Å; L264-W267 HydrophobicContact CD2-CE3 4.39Å; L264-W267 PolarHBondContact O-N 3.13Å; L264-K268 WeakPolarHBondContact O-CG 3.39Å; L264-K268 PolarHBondContact O-N 2.85Å; L264-I549 HydrophobicContact CD1-CG2 4.12Å; L264-I549 HydrophobicContact CD2-CG2 4.06Å; L264-I549 HydrophobicContact CG-CG2 4.19Å; L264-C553 WeakPolarHBondContact CD2-SG 3.49Å
265	L	97.1	Very high	91.2	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.8	-49.5	178.3	179.5	60.6	0	0	0	111.3	L184 M187 V191 V238 L242 K261 W267 K268 C269	L184-L265 HydrophobicContact CD2-CD2 3.7Å; M187-L265 HydrophobicContact CB-CD1 4.26Å; M187-L265 HydrophobicContact CB-CD2 3.88Å; M187-L265 HydrophobicContact SD-CD2 4.42Å; V191-L265 HydrophobicContact CB-CD1 4.29Å; V191-L265 HydrophobicContact CG2-CD1 4.01Å; V238-L265 HydrophobicContact CG2-CD2 4.48Å; L242-L265 HydrophobicContact CD1-CB 4.29Å; L242-L265 HydrophobicContact CD1-CD2 3.82Å; L242-L265 HydrophobicContact CD1-CG 3.72Å; L242-L265 HydrophobicContact CD2-CD2 4.05Å; K261-L265 WeakPolarHBondContact O-CB 3.33Å; K261-L265 PolarHBondContact O-N 3.09Å; L265-W267 VanDerWaalsContact C-N 3.28Å; L265-W267 PolarHBondContact O-N 3.4Å; L265-K268 PolarHBondContact O-N 3.4Å; L265-K268 VanDerWaalsContact O-N 3.11Å; L265-C269 PolarHBondContact O-N 2.87Å; L265-C269 PolarHBondContact O-SG 3.48Å
266	L	95.6	Very high	91.9	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-58.4	-41.7	179.1	-179.7	55.8	0	0	0	111.6	V239 L242 F243 L246 V262 L264 C269 L270 M557	V239-L266 HydrophobicContact CG1-CD1 4.09Å; L242-L266 HydrophobicContact CB-CB 4.17Å; L242-L266 HydrophobicContact CB-CD1 4.06Å; L242-L266 HydrophobicContact CB-CD2 4.37Å; L242-L266 HydrophobicContact CB-CG 4.43Å; L242-L266 HydrophobicContact CD1-CB 4.09Å; L242-L266 HydrophobicContact CD1-CD1 4.43Å; F243-L266 HydrophobicContact CD1-CD1 4.32Å; F243-L266 HydrophobicContact CD1-CD2 3.65Å; F243-L266 HydrophobicContact CD2-CD1 4.26Å; F243-L266 HydrophobicContact CE1-CD1 4.14Å; F243-L266 HydrophobicContact CE1-CD2 3.7Å; F243-L266 HydrophobicContact CE1-CG 4.31Å; F243-L266 HydrophobicContact CE2-CD1 4.06Å; F243-L266 HydrophobicContact CG-CD1 4.4Å; F243-L266 HydrophobicContact CG-CD2 4.32Å; F243-L266 HydrophobicContact CZ-CD1 4Å; F243-L266 HydrophobicContact CZ-CD2 4.39Å; L246-L266 HydrophobicContact CD2-CD2 4.26Å; V262-L266 WeakPolarHBondContact O-CB 3.41Å; V262-L266 PolarHBondContact O-N 3.42Å; L264-L266 PolarHBondContact O-N 3.2Å; L266-C269 PolarHBondContact O-N 2.94Å; L266-L270 HydrophobicContact CD1-CG 4.38Å; L266-L270 HydrophobicContact CG-CD1 4.44Å; L266-L270 VanDerWaalsContact O-CG 3.25Å; L266-L270 WeakPolarHBondContact O-CG 3.36Å; L266-L270 PolarHBondContact O-N 3.31Å; L266-M557 HydrophobicContact CB-CE 4.37Å; L266-M557 HydrophobicContact CD2-CE 3.47Å; L266-M557 VanDerWaalsContact CD2-CE 3.47Å; L266-M557 HydrophobicContact CG-CE 3.63Å
267	W	95.3	Very high	92.3	Very high	3 Å²	3	6.4 Å²	6.4	1%	0.011	4%	0.044	C	C	.	.	H	α-helix	trans	-62.2	-45.7	175.6	176.6	29.2	0	0	0	112.4	D28 L263 L264 L265 L270 L271 K552 C553 A556 M557 F616	D28-W267 WeakPolarHBondContact O-CZ2 3.46Å; L263-W267 WeakPolarHBondContact O-CB 3.36Å; L263-W267 PolarHBondContact O-N 3.49Å; L264-W267 HydrophobicContact CD2-CE3 4.39Å; L264-W267 PolarHBondContact O-N 3.13Å; L265-W267 VanDerWaalsContact C-N 3.28Å; L265-W267 PolarHBondContact O-N 3.4Å; W267-L270 PolarHBondContact O-N 3.49Å; W267-L271 HydrophobicContact CZ2-CD1 4.21Å; W267-L271 PolarHBondContact O-N 3Å; W267-K552 HydrophobicContact CH2-CD 4.46Å; W267-K552 HydrophobicContact CH2-CG 4.3Å; W267-K552 HydrophobicContact CZ3-CD 4.46Å; W267-K552 HydrophobicContact CZ3-CG 4.32Å; W267-C553 HydrophobicContact CE3-CB 4.34Å; W267-A556 HydrophobicContact CD2-CB 4.33Å; W267-A556 HydrophobicContact CZ2-CB 3.74Å; W267-M557 HydrophobicContact CB-CG 3.63Å; W267-M557 HydrophobicContact CB-SD 3.96Å; W267-M557 HydrophobicContact CG-CG 3.91Å; W267-F616 HydrophobicContact CZ2-CZ 4.41Å
268	K	95.4	Very high	92.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-66.9	-39.1	178.3	-58.9	-44.1	-173.8	-179.3	0	112.3	C29 E35 Y188 V191 E192 L264 L265 L270 L271 A272	C29-K268 PolarHBondContact SG-NZ 3.46Å; E35-K268 IonicContact OE1-NZ 3.17Å; E35-K268 WeakPolarHBondContact OE2-CE 3.49Å; E35-K268 IonicContact OE2-NZ 2.7Å; E35-K268 PolarHBondContact OE2-NZ 3.02Å; Y188-K268 HydrophobicContact CD2-CG 3.97Å; Y188-K268 HydrophobicContact CE2-CD 4.3Å; Y188-K268 HydrophobicContact CE2-CG 3.41Å; Y188-K268 VanDerWaalsContact CE2-CG 3.41Å; Y188-K268 WeakPolarHBondContact OH-CE 3.49Å; V191-K268 HydrophobicContact CG1-CB 3.93Å; E192-K268 IonicContact OE1-NZ 3.77Å; E192-K268 VanDerWaalsContact OE2-CD 3.24Å; E192-K268 WeakPolarHBondContact OE2-CD 3.44Å; E192-K268 WeakPolarHBondContact OE2-CG 3.48Å; L264-K268 WeakPolarHBondContact O-CG 3.39Å; L264-K268 PolarHBondContact O-N 2.85Å; L265-K268 PolarHBondContact O-N 3.4Å; L265-K268 VanDerWaalsContact O-N 3.11Å; K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 2.93Å; K268-L271 HydrophobicContact CD-CD1 4.39Å; K268-L271 PolarHBondContact O-N 3.37Å; K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.41Å
269	C	94.7	Very high	92.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.1	-44	172.2	-66.5	0	0	0	0	111.4	L229 V239 L265 L266 L271 A272 V273	L229-C269 HydrophobicContact CD2-CB 4.43Å; V239-C269 HydrophobicContact CG2-CB 3.82Å; L265-C269 PolarHBondContact O-N 2.87Å; L265-C269 PolarHBondContact O-SG 3.48Å; L266-C269 PolarHBondContact O-N 2.94Å; C269-L271 PolarHBondContact O-N 3.39Å; C269-A272 WeakPolarHBondContact O-CB 3.38Å; C269-A272 PolarHBondContact O-N 2.95Å; C269-V273 WeakPolarHBondContact O-CG2 3.34Å; C269-V273 PolarHBondContact O-N 3.48Å
270	L	93.7	Very high	92.4	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.016	9%	0.091	C	C	.	.	H	α-helix	trans	-64.3	-38.9	176.8	-70.3	174.7	0	0	0	112.5	F243 L266 W267 K268 A272 L274 L478 M557 L560 I561	F243-L270 HydrophobicContact CZ-CD1 4.32Å; F243-L270 HydrophobicContact CZ-CD2 4.28Å; L266-L270 HydrophobicContact CD1-CG 4.38Å; L266-L270 HydrophobicContact CG-CD1 4.44Å; L266-L270 VanDerWaalsContact O-CG 3.25Å; L266-L270 WeakPolarHBondContact O-CG 3.36Å; L266-L270 PolarHBondContact O-N 3.31Å; W267-L270 PolarHBondContact O-N 3.49Å; K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 2.93Å; L270-A272 VanDerWaalsContact C-N 3.31Å; L270-L274 WeakPolarHBondContact O-CB 3.48Å; L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 3.26Å; L270-L478 HydrophobicContact CD2-CD1 3.58Å; L270-L478 HydrophobicContact CD2-CD2 3.8Å; L270-L478 HydrophobicContact CD2-CG 4.37Å; L270-M557 HydrophobicContact CD1-CE 4.04Å; L270-M557 HydrophobicContact CD1-CG 4.32Å; L270-L560 HydrophobicContact CB-CD2 4.01Å; L270-I561 HydrophobicContact CD1-CD1 4.32Å; L270-I561 HydrophobicContact CD1-CG1 4.5Å
271	L	93.6	Very high	92.3	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-66.8	-33.8	173.6	-76	173.9	0	0	0	112.3	D28 C29 W267 K268 C269 G275 L560	D28-L271 HydrophobicContact CB-CD2 4.42Å; C29-L271 WeakPolarHBondContact SG-CD1 3.35Å; W267-L271 HydrophobicContact CZ2-CD1 4.21Å; W267-L271 PolarHBondContact O-N 3Å; K268-L271 HydrophobicContact CD-CD1 4.39Å; K268-L271 PolarHBondContact O-N 3.37Å; C269-L271 PolarHBondContact O-N 3.39Å; L271-G275 CarbonylContact O-C 3.59Å; L271-G275 WeakPolarHBondContact O-CA 3.33Å; L271-G275 PolarHBondContact O-N 3.27Å; L271-L560 HydrophobicContact CD2-CD1 4.24Å; L271-L560 HydrophobicContact CD2-CD2 3.85Å; L271-L560 HydrophobicContact CG-CD2 4.24Å
272	A	92.1	Very high	92.1	Very high	13 Å²	13	21.5 Å²	21.5	11%	0.107	12%	0.121	C	C	.	.	H	α-helix	trans	-66.5	-50.3	176.8	0	0	0	0	0	111	R195 L226 L229 K268 C269 L270	R195-A272 HydrophobicContact CB-CB 4.41Å; R195-A272 HydrophobicContact CG-CB 3.87Å; L226-A272 HydrophobicContact CD2-CB 3.64Å; L226-A272 VanDerWaalsContact CD2-O 3.28Å; L226-A272 WeakPolarHBondContact CD2-O 3.37Å; L229-A272 HydrophobicContact CD1-CB 4.09Å; K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.41Å; C269-A272 WeakPolarHBondContact O-CB 3.38Å; C269-A272 PolarHBondContact O-N 2.95Å; L270-A272 VanDerWaalsContact C-N 3.31Å
273	V	90.5	Very high	91.9	Very high	29 Å²	29	24.3 Å²	24.3	18%	0.176	14%	0.135	C	C	.	.	H	α-helix	trans	-74.5	-44.1	-176	174.6	0	0	0	0	112.6	L229 D230 C269 P474	L229-V273 HydrophobicContact CB-CG2 3.59Å; D230-V273 HydrophobicContact CB-CG1 4.15Å; D230-V273 HydrophobicContact CB-CG2 4.44Å; D230-V273 WeakPolarHBondContact OD1-CG1 3.46Å; C269-V273 WeakPolarHBondContact O-CG2 3.34Å; C269-V273 PolarHBondContact O-N 3.48Å; V273-P474 HydrophobicContact CG1-CB 3.93Å
274	L	90.5	Very high	91.7	Very high	15 Å²	15	26.9 Å²	26.9	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-87.4	-22.1	-176.3	-60.8	176.6	0	0	0	113.3	L270 L478 L560 H564	L270-L274 WeakPolarHBondContact O-CB 3.48Å; L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 3.26Å; L274-L478 HydrophobicContact CD1-CD2 3.62Å; L274-L478 HydrophobicContact CD2-CD2 3.94Å; L274-L478 HydrophobicContact CG-CD2 4.13Å; L274-L560 HydrophobicContact CD1-CD2 4.04Å; L274-L560 HydrophobicContact CD1-CG 4.06Å; L274-H564 HydrophobicContact CD1-CB 4.34Å; L274-H564 PolarHBondContact O-CE1 3.34Å
275	G	89.5	Confident	91.5	Very high	19 Å²	19	27.7 Å²	27.7	20%	0.196	15%	0.151	C	C	.	.			trans	85.5	169.2	-170.4	0	0	0	0	0	114	L271	L271-G275 CarbonylContact O-C 3.59Å; L271-G275 WeakPolarHBondContact O-CA 3.33Å; L271-G275 PolarHBondContact O-N 3.27Å
276	G	88.7	Confident	91.2	Very high	20 Å²	20	31.9 Å²	31.9	21%	0.206	17%	0.173	C	C	.	.			trans	-75.2	-177.3	175.8	0	0	0	0	0	113.8	D28 A279 L280	D28-G276 VanDerWaalsContact OD2-C 3.27Å; D28-G276 WeakPolarHBondContact OD2-CA 3.35Å; G276-A279 PolarHBondContact O-N 3.38Å; G276-L280 WeakPolarHBondContact O-CB 3.31Å; G276-L280 PolarHBondContact O-N 3.34Å
277	W	85.8	Confident	90.8	Very high	17 Å²	17	34 Å²	34	6%	0.064	18%	0.182	C	C	.	.	H	α-helix	trans	-77.5	-27	-174.4	-66.2	17.2	0	0	0	114.1	Y26 D28 L280 H281 I300 K563 R623	Y26-W277 HydrophobicContact CD1-CH2 4.39Å; Y26-W277 HydrophobicContact CD1-CZ3 4.04Å; Y26-W277 HydrophobicContact CE1-CE3 4.29Å; Y26-W277 AromaticContact CE1-CH2 3.21Å; Y26-W277 HydrophobicContact CE1-CH2 3.21Å; Y26-W277 AromaticContact CE1-CZ3 3.05Å; Y26-W277 HydrophobicContact CE1-CZ3 3.05Å; Y26-W277 HydrophobicContact CE2-CH2 4.46Å; Y26-W277 AromaticContact CZ-CH2 3.4Å; Y26-W277 AromaticContact CZ-CZ3 3.74Å; Y26-W277 WeakPolarHBondContact OH-CH2 3.46Å; D28-W277 VanDerWaalsContact OD1-CB 3.25Å; D28-W277 WeakPolarHBondContact OD1-CB 3.15Å; D28-W277 PolarHBondContact OD1-N 2.96Å; D28-W277 PolarHBondContact OD1-NE1 3.19Å; D28-W277 PolarHBondContact OD2-N 2.93Å; W277-L280 PolarHBondContact O-N 3.5Å; W277-H281 VanDerWaalsContact O-CB 3.32Å; W277-H281 WeakPolarHBondContact O-CB 3.42Å; W277-H281 PolarHBondContact O-N 2.86Å; W277-I300 HydrophobicContact CE3-CD1 3.28Å; W277-I300 HydrophobicContact CZ3-CD1 3.43Å; W277-I300 VanDerWaalsContact CZ3-CD1 3.43Å; W277-K563 VanDerWaalsContact CE3-NZ 3.3Å; W277-R623 VanDerWaalsContact CZ3-CZ 3.49Å
278	R	87.6	Confident	90.6	Very high	147 Å²	147	34.2 Å²	34.2	56%	0.555	18%	0.183	S	C	*	.	H	α-helix	trans	-62.3	-49.6	169.6	-63.8	-175.5	-176.9	98.8	3.2	109.8	D27 L280 H281 N282	D27-R278 IonicContact OD1-NH1 3.69Å; D27-R278 IonicContact OD2-CZ 3.39Å; D27-R278 IonicContact OD2-NH1 3.37Å; D27-R278 PolarHBondContact OD2-NH1 2.97Å; D27-R278 IonicContact OD2-NH2 3.84Å; D27-R278 PolarHBondContact OD2-NH2 3.47Å; D27-R278 VanDerWaalsContact OD2-NH2 3.12Å; R278-L280 PolarHBondContact O-N 2.91Å; R278-H281 WeakPolarHBondContact O-CB 3.5Å; R278-H281 PolarHBondContact O-N 3.39Å; R278-H281 VanDerWaalsContact O-N 3.1Å; R278-N282 PolarHBondContact O-N 2.91Å
279	A	88.1	Confident	90.4	Very high	52 Å²	52	39.8 Å²	39.8	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-57.9	-45.7	175.1	0	0	0	0	0	112	G276 H281 N282 L283	G276-A279 PolarHBondContact O-N 3.38Å; A279-H281 VanDerWaalsContact C-N 3.34Å; A279-H281 PolarHBondContact O-N 3.24Å; A279-N282 PolarHBondContact O-N 3.37Å; A279-L283 WeakPolarHBondContact O-CB 3.4Å; A279-L283 PolarHBondContact O-N 2.86Å
280	L	90	Very high	90.1	Very high	7 Å²	7	44 Å²	44	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-35.2	175.2	170.4	63.6	0	0	0	113.4	G276 W277 R278 K284 K563 V567	G276-L280 WeakPolarHBondContact O-CB 3.31Å; G276-L280 PolarHBondContact O-N 3.34Å; W277-L280 PolarHBondContact O-N 3.5Å; R278-L280 PolarHBondContact O-N 2.91Å; L280-K284 WeakPolarHBondContact O-CB 3.22Å; L280-K284 PolarHBondContact O-N 3.3Å; L280-K563 HydrophobicContact CD2-CB 3.34Å; L280-K563 HydrophobicContact CD2-CD 3.7Å; L280-K563 HydrophobicContact CD2-CG 4.05Å; L280-K563 HydrophobicContact CG-CB 4.46Å; L280-V567 HydrophobicContact CD1-CB 4.36Å; L280-V567 HydrophobicContact CD1-CG2 3.9Å
281	H	89.6	Confident	89.7	Confident	32 Å²	32	46.9 Å²	46.9	15%	0.148	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-44.2	175.9	-175.5	-102.4	0	0	0	110.8	W277 R278 A279 K284 N285 C296 D298	W277-H281 VanDerWaalsContact O-CB 3.32Å; W277-H281 WeakPolarHBondContact O-CB 3.42Å; W277-H281 PolarHBondContact O-N 2.86Å; R278-H281 WeakPolarHBondContact O-CB 3.5Å; R278-H281 PolarHBondContact O-N 3.39Å; R278-H281 VanDerWaalsContact O-N 3.1Å; A279-H281 VanDerWaalsContact C-N 3.34Å; A279-H281 PolarHBondContact O-N 3.24Å; H281-K284 PolarHBondContact O-N 3.28Å; H281-N285 PolarHBondContact CE1-ND2 3.02Å; H281-N285 PolarHBondContact ND1-ND2 3.26Å; H281-N285 PolarHBondContact O-N 3.36Å; H281-C296 PolarHBondContact CE1-O 2.98Å; H281-C296 VanDerWaalsContact CE1-O 3.32Å; H281-C296 PolarHBondContact NE2-O 3.21Å; H281-D298 PolarHBondContact NE2-N 3.18Å
282	N	91.1	Very high	89.3	Confident	91 Å²	91	50 Å²	50	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-61.7	-52.2	174.8	-65.6	-13	0	0	0	110.6	R278 A279 K284 N285 D286	R278-N282 PolarHBondContact O-N 2.91Å; A279-N282 PolarHBondContact O-N 3.37Å; N282-K284 PolarHBondContact O-N 3.5Å; N282-K284 VanDerWaalsContact O-N 3.13Å; N282-N285 CarbonylContact O-C 3.6Å; N282-N285 WeakPolarHBondContact O-CA 3.41Å; N282-N285 WeakPolarHBondContact O-CB 3.26Å; N282-N285 PolarHBondContact O-N 3.44Å; N282-D286 PolarHBondContact O-N 2.91Å
283	L	90.5	Very high	89.1	Confident	59 Å²	59	50.7 Å²	50.7	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-52.8	-41.6	175.9	180	65.3	0	0	0	112.5	A279 D286 K287 V567	A279-L283 WeakPolarHBondContact O-CB 3.4Å; A279-L283 PolarHBondContact O-N 2.86Å; L283-D286 PolarHBondContact O-N 2.97Å; L283-K287 WeakPolarHBondContact O-CG 3.5Å; L283-K287 PolarHBondContact O-N 3.29Å; L283-V567 HydrophobicContact CD2-CG1 4.29Å; L283-V567 HydrophobicContact CG-CG1 4.16Å
284	K	90.2	Very high	88.8	Confident	53 Å²	53	56.4 Å²	56.4	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-38.4	176.2	178.5	-179.5	161.9	-132.5	0	112	L280 H281 N282 R288 C296 V567	L280-K284 WeakPolarHBondContact O-CB 3.22Å; L280-K284 PolarHBondContact O-N 3.3Å; H281-K284 PolarHBondContact O-N 3.28Å; N282-K284 PolarHBondContact O-N 3.5Å; N282-K284 VanDerWaalsContact O-N 3.13Å; K284-R288 WeakPolarHBondContact O-CB 3.26Å; K284-R288 WeakPolarHBondContact O-CG 3.13Å; K284-R288 PolarHBondContact O-N 3.21Å; K284-C296 PolarHBondContact NZ-SG 2.86Å; K284-V567 HydrophobicContact CB-CG1 4.29Å; K284-V567 HydrophobicContact CB-CG2 3.83Å; K284-V567 HydrophobicContact CD-CG2 4.19Å; K284-V567 HydrophobicContact CG-CG2 4.01Å
285	N	91.8	Very high	88.4	Confident	17 Å²	17	59.7 Å²	59.7	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-70.5	-38.7	177.3	-76.9	-19.3	0	0	0	111.4	H281 N282 R288 Q289 C296	H281-N285 PolarHBondContact CE1-ND2 3.02Å; H281-N285 PolarHBondContact ND1-ND2 3.26Å; H281-N285 PolarHBondContact O-N 3.36Å; N282-N285 CarbonylContact O-C 3.6Å; N282-N285 WeakPolarHBondContact O-CA 3.41Å; N282-N285 WeakPolarHBondContact O-CB 3.26Å; N282-N285 PolarHBondContact O-N 3.44Å; N285-R288 CarbonylContact O-C 3.53Å; N285-R288 WeakPolarHBondContact O-CA 3.41Å; N285-R288 WeakPolarHBondContact O-CB 3.37Å; N285-R288 PolarHBondContact O-N 3.32Å; N285-R288 VanDerWaalsContact O-N 3.11Å; N285-Q289 WeakPolarHBondContact O-CG 3.36Å; N285-Q289 PolarHBondContact O-N 3.11Å; N285-C296 PolarHBondContact ND2-O 2.71Å; N285-C296 WeakPolarHBondContact OD1-CB 3.21Å; N285-C296 PolarHBondContact OD1-N 3.37Å
286	D	91.1	Very high	88	Confident	89 Å²	89	59.5 Å²	59.5	48%	0.476	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-48.6	174.9	-58.1	-23.6	0	0	0	110.5	N282 L283 R288 Q289 A290	N282-D286 PolarHBondContact O-N 2.91Å; L283-D286 PolarHBondContact O-N 2.97Å; D286-R288 VanDerWaalsContact C-N 3.27Å; D286-R288 PolarHBondContact O-N 2.93Å; D286-Q289 PolarHBondContact O-N 3.48Å; D286-Q289 VanDerWaalsContact O-N 3.14Å; D286-A290 PolarHBondContact O-N 2.94Å
287	K	88.1	Confident	87.5	Confident	44 Å²	44	62.3 Å²	62.3	19%	0.191	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-36.9	173.3	-70.4	-161.2	-176.3	-167.1	0	112.2	L283 A290 F291 L447 V567	L283-K287 WeakPolarHBondContact O-CG 3.5Å; L283-K287 PolarHBondContact O-N 3.29Å; K287-A290 PolarHBondContact O-N 3.09Å; K287-F291 WeakPolarHBondContact O-CD2 3.5Å; K287-F291 PolarHBondContact O-N 3.14Å; K287-L447 HydrophobicContact CB-CD2 4.31Å; K287-V567 HydrophobicContact CD-CG1 3.82Å; K287-V567 WeakPolarHBondContact CD-O 3.4Å; K287-V567 HydrophobicContact CG-CG1 4.49Å
288	R	90.1	Very high	87.3	Confident	8 Å²	8	62.6 Å²	62.6	3%	0.03	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-43.1	175.3	-77.4	175.5	70	73.8	0.9	111.8	K284 N285 D286 A290 F291 G292 L293 Q294 V445 L447	K284-R288 WeakPolarHBondContact O-CB 3.26Å; K284-R288 WeakPolarHBondContact O-CG 3.13Å; K284-R288 PolarHBondContact O-N 3.21Å; N285-R288 CarbonylContact O-C 3.53Å; N285-R288 WeakPolarHBondContact O-CA 3.41Å; N285-R288 WeakPolarHBondContact O-CB 3.37Å; N285-R288 PolarHBondContact O-N 3.32Å; N285-R288 VanDerWaalsContact O-N 3.11Å; D286-R288 VanDerWaalsContact C-N 3.27Å; D286-R288 PolarHBondContact O-N 2.93Å; R288-A290 VanDerWaalsContact C-N 3.33Å; R288-F291 CarbonylContact O-C 3.57Å; R288-F291 PolarHBondContact O-N 2.7Å; R288-F291 VanDerWaalsContact O-N 3.16Å; R288-G292 PolarHBondContact O-N 2.62Å; R288-L293 HydrophobicContact CB-CB 4.11Å; R288-L293 WeakPolarHBondContact O-CA 3.31Å; R288-L293 WeakPolarHBondContact O-CB 3.15Å; R288-L293 PolarHBondContact O-N 3.01Å; R288-Q294 VanDerWaalsContact CZ-O 3.23Å; R288-Q294 PolarHBondContact NE-O 2.83Å; R288-Q294 PolarHBondContact NH2-O 2.94Å; R288-V445 PolarHBondContact NH1-O 3.3Å; R288-L447 HydrophobicContact CG-CB 4.45Å; R288-L447 HydrophobicContact CG-CD1 4.47Å
289	Q	91.1	Very high	87.1	Confident	117 Å²	117	57.9 Å²	57.9	55%	0.547	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-39.4	176.7	-70.8	177.4	20.5	0	0	111.5	N285 D286 F291 G292	N285-Q289 WeakPolarHBondContact O-CG 3.36Å; N285-Q289 PolarHBondContact O-N 3.11Å; D286-Q289 PolarHBondContact O-N 3.48Å; D286-Q289 VanDerWaalsContact O-N 3.14Å; Q289-F291 PolarHBondContact O-N 3.07Å; Q289-G292 WeakPolarHBondContact O-CA 3.3Å; Q289-G292 PolarHBondContact O-N 3.31Å
290	A	87.9	Confident	86.8	Confident	89 Å²	89	56.6 Å²	56.6	74%	0.736	32%	0.318	S	S	*	.	H	α-helix	trans	-59.2	-34	173.6	0	0	0	0	0	112.7	D286 K287 R288 G292	D286-A290 PolarHBondContact O-N 2.94Å; K287-A290 PolarHBondContact O-N 3.09Å; R288-A290 VanDerWaalsContact C-N 3.33Å; A290-G292 VanDerWaalsContact C-N 3.29Å; A290-G292 PolarHBondContact O-N 3.14Å
291	F	85.4	Confident	86.2	Confident	63 Å²	63	62.1 Å²	62.1	28%	0.276	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	8.7	171.6	-75.4	-71.3	0	0	0	114.2	K287 R288 Q289 L293 L447 M450	K287-F291 WeakPolarHBondContact O-CD2 3.5Å; K287-F291 PolarHBondContact O-N 3.14Å; R288-F291 CarbonylContact O-C 3.57Å; R288-F291 PolarHBondContact O-N 2.7Å; R288-F291 VanDerWaalsContact O-N 3.16Å; Q289-F291 PolarHBondContact O-N 3.07Å; F291-L293 HydrophobicContact CB-CD1 4.39Å; F291-L293 HydrophobicContact CB-CG 4.14Å; F291-L293 PolarHBondContact O-N 2.82Å; F291-L447 HydrophobicContact CD2-CD1 3.44Å; F291-L447 VanDerWaalsContact CD2-CD1 3.44Å; F291-L447 HydrophobicContact CE2-CD1 3.75Å; F291-L447 HydrophobicContact CG-CD1 4.44Å; F291-M450 HydrophobicContact CD1-CB 4.16Å; F291-M450 HydrophobicContact CD1-CE 4.15Å; F291-M450 HydrophobicContact CE1-CB 4.45Å; F291-M450 HydrophobicContact CG-CB 4.3Å
292	G	85.9	Confident	85.6	Confident	70 Å²	70	62 Å²	62	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	19.3	-177.8	0	0	0	0	0	114.3	R288 Q289 A290	R288-G292 PolarHBondContact O-N 2.62Å; Q289-G292 WeakPolarHBondContact O-CA 3.3Å; Q289-G292 PolarHBondContact O-N 3.31Å; A290-G292 VanDerWaalsContact C-N 3.29Å; A290-G292 PolarHBondContact O-N 3.14Å
293	L	87.5	Confident	84.9	Confident	26 Å²	26	57.9 Å²	57.9	14%	0.136	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-92.6	147.8	179.6	-58.5	-178.8	0	0	0	111.5	R288 F291 V445 M450	R288-L293 HydrophobicContact CB-CB 4.11Å; R288-L293 WeakPolarHBondContact O-CA 3.31Å; R288-L293 WeakPolarHBondContact O-CB 3.15Å; R288-L293 PolarHBondContact O-N 3.01Å; F291-L293 HydrophobicContact CB-CD1 4.39Å; F291-L293 HydrophobicContact CB-CG 4.14Å; F291-L293 PolarHBondContact O-N 2.82Å; L293-V445 HydrophobicContact CD2-CB 3.89Å; L293-V445 HydrophobicContact CD2-CG1 4.2Å; L293-V445 HydrophobicContact CD2-CG2 4.48Å; L293-M450 HydrophobicContact CD1-CG 3.79Å; L293-M450 HydrophobicContact CG-CG 4.44Å
294	Q	83.9	Confident	84	Confident	150 Å²	150	59.6 Å²	59.6	70%	0.701	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-60.1	145.7	172.7	-70.3	-178.1	-8.8	0	0	112.2	R288	R288-Q294 VanDerWaalsContact CZ-O 3.23Å; R288-Q294 PolarHBondContact NE-O 2.83Å; R288-Q294 PolarHBondContact NH2-O 2.94Å
295	P	83.3	Confident	83.2	Confident	84 Å²	84	62.2 Å²	62.2	55%	0.545	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-58.6	149.1	176.5	25.3	-33.7	0	0	0	111
296	C	80	Confident	82.2	Confident	15 Å²	15	62.7 Å²	62.7	10%	0.101	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-90	139.2	176.1	-170.6	0	0	0	0	109.4	H281 K284 N285	H281-C296 PolarHBondContact CE1-O 2.98Å; H281-C296 VanDerWaalsContact CE1-O 3.32Å; H281-C296 PolarHBondContact NE2-O 3.21Å; K284-C296 PolarHBondContact NZ-SG 2.86Å; N285-C296 PolarHBondContact ND2-O 2.71Å; N285-C296 WeakPolarHBondContact OD1-CB 3.21Å; N285-C296 PolarHBondContact OD1-N 3.37Å
297	E	78.9	Confident	81.4	Confident	78 Å²	78	64.8 Å²	64.8	36%	0.364	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-65.8	144.5	168.1	-56.3	162.3	-175.5	0	0	110.8	T299 I302 S393	E297-T299 PolarHBondContact O-N 2.86Å; E297-I302 HydrophobicContact CB-CD1 3.49Å; E297-I302 VanDerWaalsContact CB-CD1 3.49Å; E297-I302 HydrophobicContact CG-CD1 4.13Å; E297-I302 WeakPolarHBondContact OE2-CD1 3.43Å; E297-S393 VanDerWaalsContact OE1-CB 3.31Å; E297-S393 WeakPolarHBondContact OE1-CB 3.46Å; E297-S393 PolarHBondContact OE1-OG 3.28Å
298	D	81.8	Confident	80.6	Confident	23 Å²	23	63.6 Å²	63.6	12%	0.123	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-75.6	124.9	172.1	-165.9	-11.4	0	0	0	110.2	H281 I300 E301 I302	H281-D298 PolarHBondContact NE2-N 3.18Å; D298-I300 VanDerWaalsContact C-N 3.28Å; D298-I300 PolarHBondContact O-N 3.45Å; D298-I300 PolarHBondContact OD1-N 2.98Å; D298-E301 HydrophobicContact CB-CB 4.14Å; D298-E301 HydrophobicContact CB-CG 3.96Å; D298-I302 WeakPolarHBondContact O-CD1 3.24Å; D298-I302 WeakPolarHBondContact O-CG1 3.47Å; D298-I302 PolarHBondContact O-N 3.37Å
299	T	82.3	Confident	79.7	Confident	48 Å²	48	64.7 Å²	64.7	29%	0.294	37%	0.372	S	S	.	.	H	α-helix	trans	-70.4	-27	178.3	-55.2	0	0	0	0	112.4	E297 A303 L661 F662	E297-T299 PolarHBondContact O-N 2.86Å; T299-A303 WeakPolarHBondContact O-CB 3.02Å; T299-A303 PolarHBondContact O-N 2.9Å; T299-A303 VanDerWaalsContact O-N 3.16Å; T299-L661 HydrophobicContact CG2-CD2 3.92Å; T299-F662 HydrophobicContact CG2-CE1 4.48Å; T299-F662 HydrophobicContact CG2-CZ 3.95Å
300	I	82	Confident	78.3	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.133	37%	0.371	C	S	.	.	H	α-helix	trans	-78.4	-51.3	-176.6	-61.9	162.8	0	0	0	109.6	Y26 W277 D298 I302 A303 S304	Y26-I300 HydrophobicContact CD1-CD1 4.46Å; Y26-I300 HydrophobicContact CD1-CG1 4.47Å; Y26-I300 HydrophobicContact CD1-CG2 4.07Å; Y26-I300 HydrophobicContact CE1-CD1 4.34Å; W277-I300 HydrophobicContact CE3-CD1 3.28Å; W277-I300 HydrophobicContact CZ3-CD1 3.43Å; W277-I300 VanDerWaalsContact CZ3-CD1 3.43Å; D298-I300 VanDerWaalsContact C-N 3.28Å; D298-I300 PolarHBondContact O-N 3.45Å; D298-I300 PolarHBondContact OD1-N 2.98Å; I300-I302 VanDerWaalsContact C-N 3.33Å; I300-I302 PolarHBondContact O-N 2.94Å; I300-A303 CarbonylContact O-C 3.5Å; I300-A303 PolarHBondContact O-N 3.27Å; I300-S304 PolarHBondContact O-N 3.33Å
301	E	78.5	Confident	76.6	Confident	123 Å²	123	64.8 Å²	64.8	58%	0.575	37%	0.369	S	S	*	.	H	α-helix	trans	-57.4	-44.1	176.1	-63.5	178.2	167.6	0	0	112.1	D298 A303 S304 T305	D298-E301 HydrophobicContact CB-CB 4.14Å; D298-E301 HydrophobicContact CB-CG 3.96Å; E301-A303 VanDerWaalsContact C-N 3.32Å; E301-A303 PolarHBondContact O-N 3.47Å; E301-S304 PolarHBondContact O-N 2.96Å; E301-S304 PolarHBondContact O-OG 2.97Å; E301-T305 PolarHBondContact O-N 2.65Å
302	I	75.2	Confident	75	Confident	30 Å²	30	63.1 Å²	63.1	15%	0.154	36%	0.363	C	S	.	.	H	α-helix	trans	-66.2	-40.4	177	-59.8	170.8	0	0	0	110	E297 D298 I300 S304 T305 M306 P391 W392	E297-I302 HydrophobicContact CB-CD1 3.49Å; E297-I302 VanDerWaalsContact CB-CD1 3.49Å; E297-I302 HydrophobicContact CG-CD1 4.13Å; E297-I302 WeakPolarHBondContact OE2-CD1 3.43Å; D298-I302 WeakPolarHBondContact O-CD1 3.24Å; D298-I302 WeakPolarHBondContact O-CG1 3.47Å; D298-I302 PolarHBondContact O-N 3.37Å; I300-I302 VanDerWaalsContact C-N 3.33Å; I300-I302 PolarHBondContact O-N 2.94Å; I302-S304 VanDerWaalsContact C-N 3.33Å; I302-S304 PolarHBondContact O-N 2.84Å; I302-T305 PolarHBondContact O-N 3.19Å; I302-T305 PolarHBondContact O-OG1 3.3Å; I302-M306 HydrophobicContact CB-CE 4.25Å; I302-M306 HydrophobicContact CG2-CE 3.16Å; I302-M306 VanDerWaalsContact O-CE 3.28Å; I302-M306 WeakPolarHBondContact O-CE 3.24Å; I302-M306 WeakPolarHBondContact O-CG 2.97Å; I302-P391 HydrophobicContact CG2-CB 4.09Å; I302-P391 WeakPolarHBondContact CG2-O 3.29Å; I302-W392 HydrophobicContact CB-CZ3 4.35Å; I302-W392 HydrophobicContact CG2-CE3 3.87Å; I302-W392 HydrophobicContact CG2-CZ3 3.82Å
303	A	76.3	Confident	72.8	Confident	3 Å²	3	65 Å²	65	3%	0.025	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-27.4	-180	0	0	0	0	0	113.7	T299 I300 E301 T305 M306 L658 L661	T299-A303 WeakPolarHBondContact O-CB 3.02Å; T299-A303 PolarHBondContact O-N 2.9Å; T299-A303 VanDerWaalsContact O-N 3.16Å; I300-A303 CarbonylContact O-C 3.5Å; I300-A303 PolarHBondContact O-N 3.27Å; E301-A303 VanDerWaalsContact C-N 3.32Å; E301-A303 PolarHBondContact O-N 3.47Å; A303-T305 VanDerWaalsContact C-N 3.29Å; A303-M306 WeakPolarHBondContact O-CB 3.21Å; A303-M306 PolarHBondContact O-N 3.49Å; A303-L658 HydrophobicContact CB-CB 4.46Å; A303-L658 HydrophobicContact CB-CD1 3.38Å; A303-L661 HydrophobicContact CB-CD2 4.05Å
304	S	73	Confident	70.9	Confident	96 Å²	96	65 Å²	65	67%	0.671	36%	0.36	S	S	*	.	H	α-helix	trans	-69.6	-27.6	174.6	63.8	0	0	0	0	112.1	I300 E301 I302 M306	I300-S304 PolarHBondContact O-N 3.33Å; E301-S304 PolarHBondContact O-N 2.96Å; E301-S304 PolarHBondContact O-OG 2.97Å; I302-S304 VanDerWaalsContact C-N 3.33Å; I302-S304 PolarHBondContact O-N 2.84Å; S304-M306 PolarHBondContact O-N 3.22Å
305	T	72.1	Confident	68.6	Low	108 Å²	108	66.5 Å²	66.5	66%	0.663	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.6	172	69	0	0	0	0	114	E301 I302 A303	E301-T305 PolarHBondContact O-N 2.65Å; I302-T305 PolarHBondContact O-N 3.19Å; I302-T305 PolarHBondContact O-OG1 3.3Å; A303-T305 VanDerWaalsContact C-N 3.29Å
306	M	72.6	Confident	66.3	Low	27 Å²	27	67.4 Å²	67.4	13%	0.133	36%	0.364	C	S	.	.	S	Bend	trans	-93.8	139.8	-175.2	-63.7	-172.5	-164.1	0	0	112.8	I302 A303 S304 P391 W392 A657	I302-M306 HydrophobicContact CB-CE 4.25Å; I302-M306 HydrophobicContact CG2-CE 3.16Å; I302-M306 VanDerWaalsContact O-CE 3.28Å; I302-M306 WeakPolarHBondContact O-CE 3.24Å; I302-M306 WeakPolarHBondContact O-CG 2.97Å; A303-M306 WeakPolarHBondContact O-CB 3.21Å; A303-M306 PolarHBondContact O-N 3.49Å; S304-M306 PolarHBondContact O-N 3.22Å; M306-P391 HydrophobicContact CE-CB 3.61Å; M306-P391 HydrophobicContact CE-CG 3.48Å; M306-P391 VanDerWaalsContact CE-CG 3.48Å; M306-P391 HydrophobicContact SD-CG 4.17Å; M306-W392 HydrophobicContact CE-CD2 3.96Å; M306-W392 HydrophobicContact CE-CE3 3.9Å; M306-W392 HydrophobicContact CE-CH2 2.97Å; M306-W392 HydrophobicContact CE-CZ2 3.07Å; M306-W392 HydrophobicContact CE-CZ3 3.42Å; M306-W392 VanDerWaalsContact CE-CZ3 3.42Å; M306-W392 HydrophobicContact SD-CH2 3.37Å; M306-W392 WeakPolarHBondContact SD-CH2 3.48Å; M306-W392 HydrophobicContact SD-CZ2 3.17Å; M306-W392 WeakPolarHBondContact SD-CZ2 3.29Å; M306-W392 HydrophobicContact SD-CZ3 4.38Å; M306-A657 HydrophobicContact CB-CB 4Å; M306-A657 VanDerWaalsContact O-CB 3.29Å; M306-A657 WeakPolarHBondContact O-CB 3.38Å
307	Q	72.8	Confident	63.8	Low	132 Å²	132	71.6 Å²	71.6	62%	0.617	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-81	133.4	170.7	-67.8	-78.1	-72.5	0	0	110.3	E21	E21-Q307 PolarHBondContact OE1-NE2 2.78Å; E21-Q307 PolarHBondContact OE1-OE1 2.85Å; E21-Q307 PolarHBondContact OE2-NE2 2.78Å
308	P	71.8	Confident	61.5	Low	19 Å²	19	72.1 Å²	72.1	12%	0.123	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-61.9	151.2	173.6	27.5	-33.5	0	0	0	111	E21 S310 K655	E21-P308 HydrophobicContact CG-CG 4.33Å; E21-P308 WeakPolarHBondContact OE1-CD 3.18Å; E21-P308 WeakPolarHBondContact OE1-CG 3.33Å; P308-S310 PolarHBondContact O-N 2.76Å; P308-S310 VanDerWaalsContact O-N 3.07Å; P308-K655 HydrophobicContact CB-CB 4.24Å; P308-K655 HydrophobicContact CG-CB 4.38Å
309	I	71	Confident	58.9	Low	32 Å²	32	78.7 Å²	78.7	16%	0.164	44%	0.44	C	S	.	.			trans	-77.5	100.2	178.3	-50.5	158.8	0	0	0	108.2	L312 Q660 L664 A688 N692	I309-L312 HydrophobicContact CB-CD1 4.01Å; I309-L312 HydrophobicContact CD1-CD1 3.92Å; I309-L312 HydrophobicContact CG2-CD1 3.52Å; I309-L312 HydrophobicContact CG2-CG 3.62Å; I309-Q660 PolarHBondContact O-NE2 3.34Å; I309-L664 HydrophobicContact CD1-CD1 3.85Å; I309-A688 HydrophobicContact CD1-CB 4.16Å; I309-N692 WeakPolarHBondContact CD1-ND2 3.48Å; I309-N692 WeakPolarHBondContact CG1-ND2 3.47Å
310	S	61.3	Low	56.3	Low	76 Å²	76	87.9 Å²	87.9	53%	0.531	47%	0.469	S	S	.	.			trans	-71.3	-39.1	179	50.8	0	0	0	0	113.4	P308	P308-S310 PolarHBondContact O-N 2.76Å; P308-S310 VanDerWaalsContact O-N 3.07Å
311	N	53.2	Low	53.6	Low	132 Å²	132	95.6 Å²	95.6	71%	0.706	51%	0.505	S	S	*	.			trans	-105.5	31.3	-162.2	-73.6	-16.1	0	0	0	115.9	T313	N311-T313 PolarHBondContact O-N 3.13Å
312	L	52	Low	51.4	Low	27 Å²	27	95.8 Å²	95.8	14%	0.141	52%	0.516	C	S	.	.			trans	-78	78.8	167.7	-78	158	0	0	0	109.2	I309 F314 L652 E684 A688	I309-L312 HydrophobicContact CB-CD1 4.01Å; I309-L312 HydrophobicContact CD1-CD1 3.92Å; I309-L312 HydrophobicContact CG2-CD1 3.52Å; I309-L312 HydrophobicContact CG2-CG 3.62Å; L312-F314 HydrophobicContact CB-CD2 3.81Å; L312-F314 HydrophobicContact CB-CE1 4.35Å; L312-F314 HydrophobicContact CB-CE2 3.48Å; L312-F314 VanDerWaalsContact CB-CE2 3.48Å; L312-F314 HydrophobicContact CB-CG 4.39Å; L312-F314 HydrophobicContact CB-CZ 3.8Å; L312-F314 HydrophobicContact CD1-CE2 3.87Å; L312-F314 HydrophobicContact CD1-CZ 3.73Å; L312-F314 HydrophobicContact CD2-CE1 3.81Å; L312-F314 HydrophobicContact CD2-CE2 4.26Å; L312-F314 HydrophobicContact CD2-CZ 3.65Å; L312-F314 HydrophobicContact CG-CE1 4.49Å; L312-F314 HydrophobicContact CG-CE2 4.06Å; L312-F314 HydrophobicContact CG-CZ 3.92Å; L312-F314 PolarHBondContact O-N 3.35Å; L312-L652 HydrophobicContact CD1-CB 4.43Å; L312-L652 HydrophobicContact CD1-CD1 4.34Å; L312-E684 HydrophobicContact CD2-CB 4.47Å; L312-A688 HydrophobicContact CD2-CB 4.39Å
313	T	39.1	Very low	49	Very low	111 Å²	111	97.9 Å²	97.9	68%	0.681	55%	0.546	S	S	*	.			trans	-67.8	74.7	167.9	-34.1	0	0	0	0	108.6	N311 K315	N311-T313 PolarHBondContact O-N 3.13Å; T313-K315 VanDerWaalsContact C-N 3.31Å; T313-K315 PolarHBondContact O-N 3.47Å
314	F	48.2	Very low	46.7	Very low	26 Å²	26	101.2 Å²	101.2	11%	0.114	58%	0.58	C	S	.	*			trans	-67.6	92.2	175.7	-71.2	-59.1	0	0	0	108.5	L312 L316 K649 L652 L685	L312-F314 HydrophobicContact CB-CD2 3.81Å; L312-F314 HydrophobicContact CB-CE1 4.35Å; L312-F314 HydrophobicContact CB-CE2 3.48Å; L312-F314 VanDerWaalsContact CB-CE2 3.48Å; L312-F314 HydrophobicContact CB-CG 4.39Å; L312-F314 HydrophobicContact CB-CZ 3.8Å; L312-F314 HydrophobicContact CD1-CE2 3.87Å; L312-F314 HydrophobicContact CD1-CZ 3.73Å; L312-F314 HydrophobicContact CD2-CE1 3.81Å; L312-F314 HydrophobicContact CD2-CE2 4.26Å; L312-F314 HydrophobicContact CD2-CZ 3.65Å; L312-F314 HydrophobicContact CG-CE1 4.49Å; L312-F314 HydrophobicContact CG-CE2 4.06Å; L312-F314 HydrophobicContact CG-CZ 3.92Å; L312-F314 PolarHBondContact O-N 3.35Å; F314-L316 VanDerWaalsContact C-N 3.32Å; F314-L316 PolarHBondContact O-N 3.43Å; F314-K649 HydrophobicContact CD1-CD 4.07Å; F314-K649 HydrophobicContact CD1-CG 3.98Å; F314-K649 HydrophobicContact CD2-CG 4.16Å; F314-K649 HydrophobicContact CE1-CD 4.15Å; F314-K649 HydrophobicContact CE1-CG 3.78Å; F314-K649 HydrophobicContact CE2-CG 4.01Å; F314-K649 HydrophobicContact CG-CD 4.42Å; F314-K649 VanDerWaalsContact CG-CE 3.44Å; F314-K649 HydrophobicContact CG-CG 4.12Å; F314-K649 HydrophobicContact CZ-CG 3.8Å; F314-L652 HydrophobicContact CE2-CB 3.93Å; F314-L652 HydrophobicContact CE2-CD1 4.16Å; F314-L652 HydrophobicContact CZ-CB 4.4Å; F314-L652 HydrophobicContact CZ-CD1 3.77Å; F314-L685 HydrophobicContact CE1-CB 4.19Å; F314-L685 HydrophobicContact CE1-CD1 4.38Å; F314-L685 HydrophobicContact CZ-CD1 4.08Å
315	K	35.2	Very low	44.6	Very low	180 Å²	180	104.5 Å²	104.5	78%	0.783	59%	0.59	S	S	*	*			trans	-56.2	104.5	157.5	-83.2	-176.4	175.4	179.4	0	106.5	T313 S317	T313-K315 VanDerWaalsContact C-N 3.31Å; T313-K315 PolarHBondContact O-N 3.47Å; K315-S317 PolarHBondContact O-N 2.67Å
316	L	34.7	Very low	42.4	Very low	103 Å²	103	107.3 Å²	107.3	54%	0.539	60%	0.601	S	S	.	*			trans	-60.9	105	166.3	-80.6	158	0	0	0	105.6	F314 C318 R653	F314-L316 VanDerWaalsContact C-N 3.32Å; F314-L316 PolarHBondContact O-N 3.43Å; L316-C318 PolarHBondContact O-N 3.33Å; L316-C318 VanDerWaalsContact O-N 3.09Å; L316-R653 VanDerWaalsContact CD1-NH2 3.32Å
317	S	27.8	Very low	40.3	Very low	103 Å²	103	113.4 Å²	113.4	72%	0.72	63%	0.634	S	S	*	*			trans	-80.9	62.1	164.1	-41.7	0	0	0	0	107.6	K315	K315-S317 PolarHBondContact O-N 2.67Å
318	C	30.5	Very low	38.1	Very low	89 Å²	89	115 Å²	115	60%	0.601	65%	0.647	S	S	*	*			trans	-120.6	141.5	157.7	-61.3	0	0	0	0	103.7	L316	L316-C318 PolarHBondContact O-N 3.33Å; L316-C318 VanDerWaalsContact O-N 3.09Å
319	D	27.5	Very low	36	Very low	161 Å²	161	121.4 Å²	121.4	86%	0.861	68%	0.68	S	S	*	*			trans	91	55.6	-173	-42.8	-18.7	0	0	0	114.4
320	R	26.7	Very low	33.8	Very low	242 Å²	242	123.6 Å²	123.6	91%	0.913	71%	0.71	S	S	*	*			trans	-134.4	93.2	139.5	-76.6	-168.8	178.7	175	-3.7	108
321	E	26.5	Very low	32.1	Very low	188 Å²	188	127.5 Å²	127.5	88%	0.879	73%	0.725	S	S	*	*			trans	-59.6	127.6	156.1	-66.5	-165.1	154.8	0	0	107.6	G323	E321-G323 PolarHBondContact O-N 3.09Å
322	P	31.2	Very low	30.7	Very low	126 Å²	126	124.5 Å²	124.5	82%	0.818	73%	0.725	S	S	*	*			trans	-74.4	95	-176	27.8	-30.1	0	0	0	109.5	G324	P322-G324 PolarHBondContact O-N 2.95Å
323	G	26.4	Very low	29.4	Very low	75 Å²	75	131 Å²	131	77%	0.773	76%	0.755	S	S	*	*			trans	-54.7	126.8	158.6	0	0	0	0	0	109.1	E321	E321-G323 PolarHBondContact O-N 3.09Å
324	G	27.5	Very low	28.8	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	76%	0.764	S	S	*	*			trans	-57.6	138.7	-161	0	0	0	0	0	115.3	P322	P322-G324 PolarHBondContact O-N 2.95Å
325	D	27.7	Very low	27.9	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	79%	0.793	S	S	*	*			trans	-131.2	112.1	140.5	-101.4	-28.9	0	0	0	107.1	N327	D325-N327 PolarHBondContact O-N 3Å
326	N	26.8	Very low	27.8	Very low	167 Å²	167	136.2 Å²	136.2	89%	0.893	79%	0.789	S	S	*	*			trans	-54.8	105.1	170.6	-90.3	-24.3	0	0	0	109
327	N	29	Very low	27.4	Very low	155 Å²	155	137.3 Å²	137.3	83%	0.829	80%	0.796	S	S	*	*			trans	-148.1	96.4	153.6	-105.7	-22.6	0	0	0	109.7	D325 N329	D325-N327 PolarHBondContact O-N 3Å; N327-N329 PolarHBondContact O-N 3.23Å
328	N	25.8	Very low	27.8	Very low	166 Å²	166	135 Å²	135	89%	0.888	78%	0.778	S	S	*	*			trans	-51.1	103.9	162.7	-92.4	-16.1	0	0	0	109.3
329	N	27.5	Very low	27.8	Very low	153 Å²	153	134.4 Å²	134.4	82%	0.818	77%	0.774	S	S	*	*			trans	-143.4	95.8	154	-99.9	-19.1	0	0	0	107.5	N327 N331	N327-N329 PolarHBondContact O-N 3.23Å; N329-N331 PolarHBondContact O-N 3.18Å
330	G	24.7	Very low	27.8	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	77%	0.771	S	S	*	*			trans	-60.5	118.9	172.3	0	0	0	0	0	109.9
331	N	25.2	Very low	28.1	Very low	159 Å²	159	128.9 Å²	128.9	85%	0.85	76%	0.758	S	S	*	*			trans	-140.9	108.7	158.3	-94.7	-28.5	0	0	0	106.7	N329 E333	N329-N331 PolarHBondContact O-N 3.18Å; N331-E333 PolarHBondContact O-N 3.29Å
332	G	25.1	Very low	28.4	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	74%	0.736	S	S	*	*			trans	-58.8	115.7	-171.3	0	0	0	0	0	113	F334	G332-F334 PolarHBondContact O-N 3.13Å
333	E	24.8	Very low	28.4	Very low	165 Å²	165	120.2 Å²	120.2	77%	0.771	72%	0.722	S	S	*	*			trans	-69.9	104.5	147.7	-90.1	-177.6	145.5	0	0	107.1	N331 P335	N331-E333 PolarHBondContact O-N 3.29Å; E333-P335 WeakPolarHBondContact O-CD 3.37Å; E333-P335 VanDerWaalsContact O-N 3.13Å
334	F	26	Very low	28.8	Very low	196 Å²	196	123.7 Å²	123.7	86%	0.86	72%	0.723	S	S	*	*			trans	-60.5	108.3	166	-78.4	-92.6	0	0	0	108.1	G332 V336	G332-F334 PolarHBondContact O-N 3.13Å; F334-V336 PolarHBondContact O-N 2.94Å
335	P	28.8	Very low	29	Very low	114 Å²	114	126.3 Å²	126.3	74%	0.74	72%	0.72	S	S	*	*			trans	-69.6	126.3	167.7	21.4	-9.5	0	0	0	105.6	E333 D337	E333-P335 WeakPolarHBondContact O-CD 3.37Å; E333-P335 VanDerWaalsContact O-N 3.13Å; P335-D337 PolarHBondContact O-N 3.17Å
336	V	33.3	Very low	28.9	Very low	115 Å²	115	123.2 Å²	123.2	70%	0.697	71%	0.706	S	S	*	*			trans	-54.1	116.9	167.4	179.4	0	0	0	0	105.6	F334 V338	F334-V336 PolarHBondContact O-N 2.94Å; V336-V338 HydrophobicContact CB-CG2 4.3Å; V336-V338 HydrophobicContact CG1-CG2 4.1Å; V336-V338 VanDerWaalsContact O-CG2 3.26Å; V336-V338 WeakPolarHBondContact O-CG2 3.29Å; V336-V338 PolarHBondContact O-N 3.24Å
337	D	26.9	Very low	28.8	Very low	126 Å²	126	120.5 Å²	120.5	67%	0.674	70%	0.701	S	S	*	*			trans	-72	84	-177.1	-155.9	-12.1	0	0	0	108.3	P335 S339	P335-D337 PolarHBondContact O-N 3.17Å; D337-S339 PolarHBondContact O-N 2.87Å; D337-S339 PolarHBondContact OD1-OG 2.74Å
338	V	35.2	Very low	28.5	Very low	56 Å²	56	120.1 Å²	120.1	34%	0.339	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.3	-4.3	-177.1	-171.3	0	0	0	0	111.1	V336 M340 I341 V342 V641	V336-V338 HydrophobicContact CB-CG2 4.3Å; V336-V338 HydrophobicContact CG1-CG2 4.1Å; V336-V338 VanDerWaalsContact O-CG2 3.26Å; V336-V338 WeakPolarHBondContact O-CG2 3.29Å; V336-V338 PolarHBondContact O-N 3.24Å; V338-M340 VanDerWaalsContact C-N 3.28Å; V338-M340 PolarHBondContact O-N 3.34Å; V338-I341 PolarHBondContact O-N 2.92Å; V338-V342 HydrophobicContact CG1-CG2 4.35Å; V338-V641 HydrophobicContact CG1-CG2 4.08Å
339	S	30.4	Very low	28.5	Very low	76 Å²	76	120 Å²	120	53%	0.531	70%	0.698	S	S	.	*	H	α-helix	trans	-60.9	-35.4	-179.7	64.7	0	0	0	0	112.5	D337 I341 A343	D337-S339 PolarHBondContact O-N 2.87Å; D337-S339 PolarHBondContact OD1-OG 2.74Å; S339-I341 VanDerWaalsContact C-N 3.32Å; S339-I341 PolarHBondContact O-N 2.83Å; S339-A343 PolarHBondContact O-N 2.95Å
340	M	27.5	Very low	28.3	Very low	161 Å²	161	116.2 Å²	116.2	79%	0.793	69%	0.694	S	S	*	*	H	α-helix	trans	-72.4	-18.4	-175.7	-163.4	178.5	167.7	0	0	114.4	V338	V338-M340 VanDerWaalsContact C-N 3.28Å; V338-M340 PolarHBondContact O-N 3.34Å
341	I	33.7	Very low	28.1	Very low	125 Å²	125	117 Å²	117	64%	0.641	69%	0.693	S	S	*	*	H	α-helix	trans	-96.3	-25.3	-177.9	-60.9	175.7	0	0	0	112	V338 S339	V338-I341 PolarHBondContact O-N 2.92Å; S339-I341 VanDerWaalsContact C-N 3.32Å; S339-I341 PolarHBondContact O-N 2.83Å
342	V	32.6	Very low	27.9	Very low	67 Å²	67	117.9 Å²	117.9	41%	0.406	70%	0.697	S	S	.	*	H	α-helix	trans	-86.9	-30.3	-177.8	-176.2	0	0	0	0	111.4	V338 D344 L345 V346	V338-V342 HydrophobicContact CG1-CG2 4.35Å; V342-D344 VanDerWaalsContact C-N 3.28Å; V342-D344 PolarHBondContact O-N 2.99Å; V342-L345 PolarHBondContact O-N 3.06Å; V342-L345 VanDerWaalsContact O-N 3.14Å; V342-V346 HydrophobicContact CG1-CB 4.15Å; V342-V346 HydrophobicContact CG1-CG2 3.9Å; V342-V346 PolarHBondContact O-N 3.32Å; V342-V346 VanDerWaalsContact O-N 3.09Å
343	A	32.3	Very low	27.7	Very low	65 Å²	65	121.2 Å²	121.2	54%	0.537	70%	0.704	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	-33.8	-180	0	0	0	0	0	113.4	S339 L345	S339-A343 PolarHBondContact O-N 2.95Å; A343-L345 VanDerWaalsContact C-N 3.29Å; A343-L345 PolarHBondContact O-N 2.93Å
344	D	33.6	Very low	27.5	Very low	148 Å²	148	121.2 Å²	121.2	79%	0.791	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9	179.3	-93.3	0.3	0	0	0	114.6	V342	V342-D344 VanDerWaalsContact C-N 3.28Å; V342-D344 PolarHBondContact O-N 2.99Å
345	L	31.1	Very low	27.2	Very low	128 Å²	128	116 Å²	116	67%	0.67	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	-8.6	-174.5	-71.6	172.2	0	0	0	115.1	V342 A343	V342-L345 PolarHBondContact O-N 3.06Å; V342-L345 VanDerWaalsContact O-N 3.14Å; A343-L345 VanDerWaalsContact C-N 3.29Å; A343-L345 PolarHBondContact O-N 2.93Å
346	V	27.2	Very low	26.9	Very low	100 Å²	100	115.8 Å²	115.8	61%	0.606	70%	0.704	S	S	*	*			trans	-136.4	69.5	-177.3	-166.3	0	0	0	0	108.8	V342	V342-V346 HydrophobicContact CG1-CB 4.15Å; V342-V346 HydrophobicContact CG1-CG2 3.9Å; V342-V346 PolarHBondContact O-N 3.32Å; V342-V346 VanDerWaalsContact O-N 3.09Å
347	S	23.5	Very low	26.3	Very low	111 Å²	111	118.5 Å²	118.5	78%	0.776	71%	0.714	S	S	*	*			trans	-81.5	128.1	158.1	-68.5	0	0	0	0	108.2
348	D	23.6	Very low	26	Very low	146 Å²	146	122.2 Å²	122.2	78%	0.781	73%	0.728	S	S	*	*			trans	80	100.4	166.2	-129.7	17.8	0	0	0	117.5
349	D	25.6	Very low	25.3	Very low	165 Å²	165	131 Å²	131	88%	0.882	76%	0.755	S	S	*	*				-168.8	123.8	125.6	-99.2	-28.7	0	0	0	111
350	G	22.9	Very low	25	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	77%	0.768	S	S	*	*			trans	-76.6	148.1	-170.7	0	0	0	0	0	115.8
351	A	21	Very low	24.7	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	77%	0.771	S	S	*	*			trans	5.9	123	152.1	0	0	0	0	0	119.2
352	L	21.6	Very low	24.1	Very low	179 Å²	179	130.7 Å²	130.7	94%	0.937	78%	0.776	S	S	*	*			trans	-151.7	107.1	132.2	-80.5	-175.3	0	0	0	109.4
353	T	20.5	Very low	24.2	Very low	137 Å²	137	133.6 Å²	133.6	84%	0.84	80%	0.797	S	S	*	*			trans	-76.5	132.6	164.9	46.2	0	0	0	0	109.1
354	D	20.8	Very low	23.7	Very low	165 Å²	165	140 Å²	140	88%	0.882	81%	0.813	S	S	*	*			trans	-145.9	137.4	150.9	-145	-6.9	0	0	0	111.1
355	A	20.2	Very low	23.5	Very low	87 Å²	87	138.7 Å²	138.7	72%	0.719	81%	0.813	S	S	*	*			trans	-128.9	118.6	-163.9	0	0	0	0	0	109
356	S	20.7	Very low	23.2	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	82%	0.824	S	S	*	*			trans	176.1	115.3	152.3	51.4	0	0	0	0	109.3
357	D	20.7	Very low	23.1	Very low	172 Å²	172	147.1 Å²	147.1	92%	0.92	84%	0.838	S	S	*	*			trans	-163.3	93	151.3	-98.1	-24.8	0	0	0	109.1
358	Q	20.5	Very low	23.3	Very low	204 Å²	204	149.5 Å²	149.5	95%	0.953	84%	0.843	S	S	*	*			trans	-90.2	120.7	168.5	-71.3	179.1	5	0	0	108.4
359	R	20.9	Very low	23.4	Very low	241 Å²	241	152.3 Å²	152.3	91%	0.909	85%	0.848	S	S	*	*			trans	-113.5	132.2	178.3	-164.4	173.8	-171.7	168.8	2.3	110.2
360	P	24.2	Very low	23.6	Very low	126 Å²	126	150.4 Å²	150.4	82%	0.818	84%	0.844	S	S	*	*			trans	-85.7	147.1	-174.2	1.7	16.9	0	0	0	113.2
361	S	21.2	Very low	23.9	Very low	122 Å²	122	152.4 Å²	152.4	85%	0.853	85%	0.847	S	S	*	*			trans	-82.3	138.3	177.9	49.3	0	0	0	0	113.7
362	S	21.5	Very low	24.6	Very low	107 Å²	107	153.8 Å²	153.8	75%	0.748	84%	0.842	S	S	*	*			trans	-138.4	147.9	157.8	67.7	0	0	0	0	111.6
363	P	35	Very low	25.5	Very low	128 Å²	128	150.1 Å²	150.1	83%	0.831	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-102.7	136.7	-157.7	13.6	7.9	0	0	0	113.7
364	F	22.2	Very low	26.2	Very low	200 Å²	200	149.3 Å²	149.3	88%	0.877	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.9	138.6	177.8	-75.7	-89.6	0	0	0	113.2
365	P	28.8	Very low	27.1	Very low	121 Å²	121	144.5 Å²	144.5	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-86.2	152.4	170.1	17.1	-2.3	0	0	0	112.8
366	K	25.1	Very low	28.2	Very low	209 Å²	209	145.4 Å²	145.4	91%	0.909	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-88.1	119.7	-174.4	-64.1	170.6	179.3	171.5	0	110.6
367	E	24.7	Very low	28.8	Very low	195 Å²	195	146.1 Å²	146.1	91%	0.911	78%	0.782	S	S	*	*			trans	-107.8	141.9	168.9	-84.2	-172.1	160.1	0	0	113
368	N	26.9	Very low	29.5	Very low	162 Å²	162	142 Å²	142	87%	0.866	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-81.4	142.2	-170.7	-79.3	-37.8	0	0	0	112.7
369	K	25.8	Very low	30.5	Very low	204 Å²	204	135.9 Å²	135.9	89%	0.887	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-73.1	128.4	178.1	-69.9	172.5	174.8	175.8	0	112
370	P	30.1	Very low	31.3	Very low	125 Å²	125	128 Å²	128	81%	0.812	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-89.8	139	163.2	33.1	-27.1	0	0	0	111	N372	P370-N372 PolarHBondContact O-N 2.78Å
371	S	30	Very low	31.8	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	72%	0.715	S	S	*	*			trans	-77.4	105.6	179.5	46.8	0	0	0	0	111.6
372	N	34.8	Very low	32.4	Very low	122 Å²	122	129.9 Å²	129.9	65%	0.652	71%	0.712	S	S	*	*			trans	-139.9	69.9	161.5	-149.9	-6.1	0	0	0	110.6	P370	P370-N372 PolarHBondContact O-N 2.78Å
373	V	41	Very low	33.2	Very low	102 Å²	102	128.5 Å²	128.5	62%	0.618	71%	0.708	S	S	*	*			trans	-85.6	-13.4	-174.1	177.3	0	0	0	0	112.3
374	Q	35.1	Very low	33.3	Very low	119 Å²	119	127.6 Å²	127.6	56%	0.556	70%	0.696	S	S	*	*	H	α-helix	trans	-87.2	-39.1	-170	-153.6	67.5	11	0	0	113.1	V376 K377	Q374-V376 VanDerWaalsContact C-N 3.29Å; Q374-V376 PolarHBondContact O-N 3.23Å; Q374-K377 PolarHBondContact O-N 3.25Å; Q374-K377 VanDerWaalsContact O-N 3.11Å
375	A	39.4	Very low	33.9	Very low	64 Å²	64	126.8 Å²	126.8	53%	0.529	70%	0.695	S	S	.	*	H	α-helix	trans	-62.4	-34.7	177.6	0	0	0	0	0	112.9	K377 D378 A379	A375-K377 VanDerWaalsContact C-N 3.29Å; A375-K377 PolarHBondContact O-N 3.49Å; A375-D378 PolarHBondContact O-N 3.29Å; A375-A379 PolarHBondContact O-N 2.81Å
376	V	42.9	Very low	34.4	Very low	107 Å²	107	129.5 Å²	129.5	65%	0.648	70%	0.697	S	S	*	*	H	α-helix	trans	-67.8	-27.7	177.5	-176.6	0	0	0	0	112.2	Q374	Q374-V376 VanDerWaalsContact C-N 3.29Å; Q374-V376 PolarHBondContact O-N 3.23Å
377	K	34.6	Very low	35.1	Very low	123 Å²	123	127.7 Å²	127.7	54%	0.535	69%	0.692	S	S	.	*	H	α-helix	trans	-75.1	-33.7	-179.5	-86.1	-178	176.8	173.6	0	113.1	Q374 A375 C380	Q374-K377 PolarHBondContact O-N 3.25Å; Q374-K377 VanDerWaalsContact O-N 3.11Å; A375-K377 VanDerWaalsContact C-N 3.29Å; A375-K377 PolarHBondContact O-N 3.49Å; K377-C380 PolarHBondContact O-N 2.9Å
378	D	35.1	Very low	36.3	Very low	85 Å²	85	128.1 Å²	128.1	46%	0.455	69%	0.691	S	S	.	*	H	α-helix	trans	-82.2	-33.1	-175.9	-67.1	-34.3	0	0	0	111.9	A375 C380 K381	A375-D378 PolarHBondContact O-N 3.29Å; D378-C380 PolarHBondContact O-N 2.95Å; D378-K381 PolarHBondContact O-N 3.48Å; D378-K381 IonicContact OD1-NZ 3.57Å
379	A	41.6	Very low	37.4	Very low	76 Å²	76	130.9 Å²	130.9	63%	0.628	69%	0.689	S	S	*	*	H	α-helix	trans	-59.4	-31.1	167.8	0	0	0	0	0	112.7	A375 K381	A375-A379 PolarHBondContact O-N 2.81Å; A379-K381 VanDerWaalsContact C-N 3.34Å; A379-K381 PolarHBondContact O-N 3.38Å
380	C	37.7	Very low	39.2	Very low	76 Å²	76	125.1 Å²	125.1	51%	0.514	67%	0.668	S	S	.	*	H	α-helix	trans	-76.8	-14.5	-178.5	-131.3	0	0	0	0	114.3	K377 D378 N384	K377-C380 PolarHBondContact O-N 2.9Å; D378-C380 PolarHBondContact O-N 2.95Å; C380-N384 PolarHBondContact O-ND2 3.48Å
381	K	33.5	Very low	40.9	Very low	139 Å²	139	122 Å²	122	60%	0.604	65%	0.647	S	S	*	*	H	α-helix	trans	-83.9	-37.1	-178.9	-76.9	178.6	-177.2	161.9	0	113	D378 A379	D378-K381 PolarHBondContact O-N 3.48Å; D378-K381 IonicContact OD1-NZ 3.57Å; A379-K381 VanDerWaalsContact C-N 3.34Å; A379-K381 PolarHBondContact O-N 3.38Å
382	N	35.1	Very low	42.7	Very low	148 Å²	148	117.7 Å²	117.7	79%	0.791	61%	0.613	S	S	*	*	H	α-helix	trans	-75.3	-28.4	-175.8	-71.4	-7.2	0	0	0	112.9	N384	N382-N384 VanDerWaalsContact C-N 3.35Å; N382-N384 PolarHBondContact O-N 3.45Å
383	A	38.4	Very low	44.2	Very low	78 Å²	78	113.9 Å²	113.9	65%	0.645	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-76	-15.3	178	0	0	0	0	0	114.7
384	N	36	Very low	45.5	Very low	109 Å²	109	110.6 Å²	110.6	58%	0.583	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-92.4	3	-168.5	-92	-46.3	0	0	0	115.8	C380 N382	C380-N384 PolarHBondContact O-ND2 3.48Å; N382-N384 VanDerWaalsContact C-N 3.35Å; N382-N384 PolarHBondContact O-N 3.45Å
385	Q	35.7	Very low	47.4	Very low	184 Å²	184	108 Å²	108	86%	0.86	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-90.4	-14.8	177.5	-73.4	-170.6	-3.4	0	0	114.2	Q387	Q385-Q387 PolarHBondContact O-N 2.94Å
386	Q	39.2	Very low	49.2	Very low	178 Å²	178	105 Å²	105	83%	0.832	54%	0.54	S	S	*	.	S	Bend	trans	-89.6	105.2	174.9	-71.5	-178.7	-11.9	0	0	110.6
387	Q	40.3	Very low	51	Low	171 Å²	171	101.2 Å²	101.2	80%	0.799	52%	0.517	S	S	*	.			trans	58.2	87.8	162	-62.1	-177.8	-9.8	0	0	118	Q385 R389	Q385-Q387 PolarHBondContact O-N 2.94Å; Q387-R389 PolarHBondContact O-N 2.86Å
388	K	48.2	Very low	53.2	Low	204 Å²	204	100 Å²	100	89%	0.887	51%	0.512	S	S	*	.			trans	-70.1	43	160.3	-68.9	-178.2	178.9	173.6	0	113.3
389	R	51	Low	55.5	Low	219 Å²	219	102.7 Å²	102.7	83%	0.826	52%	0.519	S	S	*	.	S	Bend	trans	-117.9	137.8	172.7	-67.9	-172.9	-179.2	-173.2	2.1	108.3	Q387	Q387-R389 PolarHBondContact O-N 2.86Å
390	L	64.4	Low	57.3	Low	84 Å²	84	99.9 Å²	99.9	44%	0.44	50%	0.496	S	S	.	.			trans	-61.8	139.8	168.3	-68.4	169.2	0	0	0	107.2	W392 R691 P695	L390-W392 PolarHBondContact O-N 2.89Å; L390-R691 WeakPolarHBondContact CD2-O 3.43Å; L390-P695 HydrophobicContact CD1-CG 4.11Å
391	P	65.4	Low	59.5	Low	60 Å²	60	96.6 Å²	96.6	39%	0.39	47%	0.473	S	S	.	.	S	Bend	trans	-69.4	6.9	-179.5	25.3	-31.4	0	0	0	113.3	I302 M306	I302-P391 HydrophobicContact CG2-CB 4.09Å; I302-P391 WeakPolarHBondContact CG2-O 3.29Å; M306-P391 HydrophobicContact CE-CB 3.61Å; M306-P391 HydrophobicContact CE-CG 3.48Å; M306-P391 VanDerWaalsContact CE-CG 3.48Å; M306-P391 HydrophobicContact SD-CG 4.17Å
392	W	68.2	Low	61.9	Low	24 Å²	24	92.2 Å²	92.2	9%	0.091	46%	0.455	C	S	.	.	S	Bend	trans	-133	141.9	-174	-23.4	83.4	0	0	0	112.6	I302 M306 L390 L661 N692 V694	I302-W392 HydrophobicContact CB-CZ3 4.35Å; I302-W392 HydrophobicContact CG2-CE3 3.87Å; I302-W392 HydrophobicContact CG2-CZ3 3.82Å; M306-W392 HydrophobicContact CE-CD2 3.96Å; M306-W392 HydrophobicContact CE-CE3 3.9Å; M306-W392 HydrophobicContact CE-CH2 2.97Å; M306-W392 HydrophobicContact CE-CZ2 3.07Å; M306-W392 HydrophobicContact CE-CZ3 3.42Å; M306-W392 VanDerWaalsContact CE-CZ3 3.42Å; M306-W392 HydrophobicContact SD-CH2 3.37Å; M306-W392 WeakPolarHBondContact SD-CH2 3.48Å; M306-W392 HydrophobicContact SD-CZ2 3.17Å; M306-W392 WeakPolarHBondContact SD-CZ2 3.29Å; M306-W392 HydrophobicContact SD-CZ3 4.38Å; L390-W392 PolarHBondContact O-N 2.89Å; W392-L661 HydrophobicContact CH2-CD1 3.31Å; W392-L661 HydrophobicContact CH2-CD2 3.52Å; W392-L661 HydrophobicContact CH2-CG 4.01Å; W392-L661 HydrophobicContact CZ2-CD1 3.48Å; W392-L661 VanDerWaalsContact CZ2-CD1 3.48Å; W392-L661 HydrophobicContact CZ2-CD2 4.49Å; W392-L661 HydrophobicContact CZ3-CD1 4.3Å; W392-L661 HydrophobicContact CZ3-CD2 4.12Å; W392-N692 WeakPolarHBondContact CZ2-O 3.39Å; W392-N692 PolarHBondContact NE1-O 2.98Å; W392-V694 HydrophobicContact CB-CB 4.18Å; W392-V694 HydrophobicContact CB-CG2 3.2Å; W392-V694 HydrophobicContact CD2-CG2 4.23Å; W392-V694 HydrophobicContact CG-CG2 3.74Å
393	S	64.8	Low	64.2	Low	42 Å²	42	89.1 Å²	89.1	29%	0.294	44%	0.439	S	S	.	.			trans	-70.2	137	165.9	55.5	0	0	0	0	111.6	E297 V694	E297-S393 VanDerWaalsContact OE1-CB 3.31Å; E297-S393 WeakPolarHBondContact OE1-CB 3.46Å; E297-S393 PolarHBondContact OE1-OG 3.28Å; S393-V694 WeakPolarHBondContact O-CG1 3.46Å; S393-V694 WeakPolarHBondContact O-CG2 3.33Å
394	S	67.9	Low	66.5	Low	32 Å²	32	86.6 Å²	86.6	22%	0.224	41%	0.413	C	S	.	.			trans	-62.4	143.6	174.4	-70.1	0	0	0	0	110.6	H442	S394-H442 WeakPolarHBondContact O-CB 3.25Å
395	K	75.7	Confident	68.8	Low	65 Å²	65	81.4 Å²	81.4	28%	0.283	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-118.8	118.2	177.6	-68	-179.4	-175.9	-178.6	0	109.9	Y444 V694 S696	K395-Y444 HydrophobicContact CD-CD1 4.28Å; K395-Y444 HydrophobicContact CD-CD2 4.3Å; K395-Y444 HydrophobicContact CD-CG 4.03Å; K395-Y444 HydrophobicContact CG-CG 4.16Å; K395-V694 HydrophobicContact CB-CG1 3.96Å; K395-V694 HydrophobicContact CD-CG1 4.4Å; K395-V694 HydrophobicContact CG-CG1 3.93Å; K395-S696 WeakPolarHBondContact O-CA 3.49Å
396	V	77.8	Confident	71.2	Confident	1 Å²	1	77 Å²	77	1%	0.006	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-116.7	136.5	178.3	-171.5	0	0	0	0	108.5	A400 V401 Q439 H442 V443 Y444 I697	V396-A400 HydrophobicContact CG1-CB 4.01Å; V396-V401 HydrophobicContact CG1-CG2 3.74Å; V396-Q439 HydrophobicContact CG1-CB 4.38Å; V396-H442 HydrophobicContact CG2-CB 4.06Å; V396-H442 PolarHBondContact N-O 2.93Å; V396-V443 CarbonylContact O-C 3.41Å; V396-V443 VanDerWaalsContact O-CA 3.29Å; V396-V443 WeakPolarHBondContact O-CA 3.34Å; V396-Y444 PolarHBondContact O-N 3.05Å; V396-I697 HydrophobicContact CG2-CB 4.34Å; V396-I697 HydrophobicContact CG2-CD1 3.75Å; V396-I697 HydrophobicContact CG2-CG1 4.29Å
397	T	80.9	Confident	73.4	Confident	27 Å²	27	71.9 Å²	71.9	17%	0.166	34%	0.342	C	S	.	.			trans	-86.7	152.4	173.5	56.8	0	0	0	0	110.2	K399 A400 V401 W631	T397-K399 PolarHBondContact O-N 3.14Å; T397-A400 WeakPolarHBondContact O-CB 3.48Å; T397-A400 PolarHBondContact O-N 3.47Å; T397-A400 WeakPolarHBondContact OG1-CB 3.49Å; T397-A400 PolarHBondContact OG1-N 3.26Å; T397-V401 PolarHBondContact O-N 3.42Å; T397-W631 HydrophobicContact CG2-CH2 3.95Å; T397-W631 HydrophobicContact CG2-CZ2 4.29Å
398	F	80.8	Confident	75.6	Confident	98 Å²	98	65.9 Å²	65.9	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-56.9	-39.9	175.4	-85.3	-64	0	0	0	112.5	A400 V401 E402 V443 V445	F398-A400 PolarHBondContact O-N 3.19Å; F398-V401 WeakPolarHBondContact O-CA 3.39Å; F398-V401 WeakPolarHBondContact O-CB 3.45Å; F398-V401 PolarHBondContact O-N 2.89Å; F398-E402 WeakPolarHBondContact O-CG 3.32Å; F398-E402 PolarHBondContact O-N 3.43Å; F398-V443 HydrophobicContact CD1-CG1 3.87Å; F398-V443 HydrophobicContact CD1-CG2 4.38Å; F398-V443 HydrophobicContact CD2-CG1 3.77Å; F398-V443 HydrophobicContact CE1-CB 4.45Å; F398-V443 HydrophobicContact CE1-CG1 3.71Å; F398-V443 HydrophobicContact CE1-CG2 4.32Å; F398-V443 HydrophobicContact CE2-CG1 3.62Å; F398-V443 HydrophobicContact CG-CG1 3.89Å; F398-V443 HydrophobicContact CZ-CG1 3.58Å; F398-V445 HydrophobicContact CD2-CG2 3.92Å; F398-V445 HydrophobicContact CE2-CG2 3.35Å; F398-V445 HydrophobicContact CZ-CG2 4.3Å
399	K	81.9	Confident	77.4	Confident	142 Å²	142	56.6 Å²	56.6	62%	0.617	27%	0.273	S	S	*	.	H	α-helix	trans	-58.9	-34.7	176	-170.8	169.2	-174.6	168.8	0	112.6	T397 N403	T397-K399 PolarHBondContact O-N 3.14Å; K399-N403 VanDerWaalsContact O-CB 3.29Å; K399-N403 WeakPolarHBondContact O-CB 3.28Å; K399-N403 PolarHBondContact O-N 3.1Å; K399-N403 PolarHBondContact O-OD1 3.08Å
400	A	80.9	Confident	79.1	Confident	16 Å²	16	50.7 Å²	50.7	13%	0.132	26%	0.255	C	S	.	.	H	α-helix	trans	-69.6	-36	175	0	0	0	0	0	112.4	V396 T397 F398 F404 D698	V396-A400 HydrophobicContact CG1-CB 4.01Å; T397-A400 WeakPolarHBondContact O-CB 3.48Å; T397-A400 PolarHBondContact O-N 3.47Å; T397-A400 WeakPolarHBondContact OG1-CB 3.49Å; T397-A400 PolarHBondContact OG1-N 3.26Å; F398-A400 PolarHBondContact O-N 3.19Å; A400-F404 VanDerWaalsContact O-CB 3.24Å; A400-F404 WeakPolarHBondContact O-CB 3.37Å; A400-F404 PolarHBondContact O-N 3.47Å; A400-D698 WeakPolarHBondContact CB-OD1 3.31Å
401	V	83.3	Confident	80.1	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-67.4	-43.6	174.6	-175.7	0	0	0	0	111	V396 T397 F398 F404 L405 Y436 Q439 V440 V443	V396-V401 HydrophobicContact CG1-CG2 3.74Å; T397-V401 PolarHBondContact O-N 3.42Å; F398-V401 WeakPolarHBondContact O-CA 3.39Å; F398-V401 WeakPolarHBondContact O-CB 3.45Å; F398-V401 PolarHBondContact O-N 2.89Å; V401-F404 WeakPolarHBondContact O-CB 3.49Å; V401-F404 PolarHBondContact O-N 3.12Å; V401-L405 PolarHBondContact O-N 3.49Å; V401-Y436 HydrophobicContact CG1-CD2 3.77Å; V401-Y436 HydrophobicContact CG1-CE2 3.61Å; V401-Q439 HydrophobicContact CG2-CB 4.15Å; V401-V440 HydrophobicContact CG1-CG2 4.23Å; V401-V443 HydrophobicContact CG2-CG2 3.77Å
402	E	83.3	Confident	81.1	Confident	48 Å²	48	55.8 Å²	55.8	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-54.1	174.6	-71.9	172.4	157.2	0	0	111	F398 F404 L405 E406 R422	F398-E402 WeakPolarHBondContact O-CG 3.32Å; F398-E402 PolarHBondContact O-N 3.43Å; E402-F404 PolarHBondContact O-N 3.36Å; E402-L405 PolarHBondContact O-N 3.33Å; E402-L405 VanDerWaalsContact O-N 3.1Å; E402-E406 WeakPolarHBondContact O-CB 3.37Å; E402-E406 PolarHBondContact O-N 3.06Å; E402-R422 HydrophobicContact CG-CG 3.95Å; E402-R422 IonicContact OE1-CZ 2.78Å; E402-R422 IonicContact OE1-NE 2.76Å; E402-R422 PolarHBondContact OE1-NE 3.14Å; E402-R422 IonicContact OE1-NH2 3.2Å; E402-R422 PolarHBondContact OE1-NH2 2.98Å
403	N	84.6	Confident	81.8	Confident	83 Å²	83	58.9 Å²	58.9	44%	0.444	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-38.4	178	-70.2	-1.2	0	0	0	111.8	K399 M407	K399-N403 VanDerWaalsContact O-CB 3.29Å; K399-N403 WeakPolarHBondContact O-CB 3.28Å; K399-N403 PolarHBondContact O-N 3.1Å; K399-N403 PolarHBondContact O-OD1 3.08Å; N403-M407 WeakPolarHBondContact O-CB 3.22Å; N403-M407 PolarHBondContact O-N 3.13Å
404	F	85.2	Confident	82.6	Confident	24 Å²	24	59.6 Å²	59.6	11%	0.105	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-50.7	175.3	173.3	-97.4	0	0	0	111	A400 V401 E402 M407 K408 I432 S435 Q439	A400-F404 VanDerWaalsContact O-CB 3.24Å; A400-F404 WeakPolarHBondContact O-CB 3.37Å; A400-F404 PolarHBondContact O-N 3.47Å; V401-F404 WeakPolarHBondContact O-CB 3.49Å; V401-F404 PolarHBondContact O-N 3.12Å; E402-F404 PolarHBondContact O-N 3.36Å; F404-M407 HydrophobicContact CD2-CE 4.37Å; F404-M407 PolarHBondContact O-N 3.38Å; F404-K408 HydrophobicContact CD2-CG 4.44Å; F404-K408 HydrophobicContact CE1-CG 4.2Å; F404-K408 HydrophobicContact CE2-CD 4.41Å; F404-K408 HydrophobicContact CE2-CG 4.13Å; F404-K408 HydrophobicContact CZ-CG 3.99Å; F404-K408 VanDerWaalsContact O-CG 3.29Å; F404-K408 WeakPolarHBondContact O-CG 3.26Å; F404-K408 PolarHBondContact O-N 3.12Å; F404-I432 HydrophobicContact CE1-CG2 4.05Å; F404-I432 HydrophobicContact CZ-CG2 4.09Å; F404-S435 WeakPolarHBondContact CZ-OG 3.41Å; F404-Q439 VanDerWaalsContact CD2-NE2 3.34Å; F404-Q439 VanDerWaalsContact CG-NE2 3.31Å
405	L	85.9	Confident	83.2	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-61.5	-45.7	178.6	-77.8	-179.9	0	0	0	111.5	V401 E402 K408 R409 R422 T425 L428 Y436	V401-L405 PolarHBondContact O-N 3.49Å; E402-L405 PolarHBondContact O-N 3.33Å; E402-L405 VanDerWaalsContact O-N 3.1Å; L405-K408 PolarHBondContact O-N 3.3Å; L405-R409 WeakPolarHBondContact O-CB 3.32Å; L405-R409 WeakPolarHBondContact O-CD 3.46Å; L405-R409 WeakPolarHBondContact O-CG 3.23Å; L405-R409 PolarHBondContact O-N 3.49Å; L405-R422 WeakPolarHBondContact CD1-O 3.31Å; L405-T425 HydrophobicContact CD2-CG2 4.33Å; L405-L428 HydrophobicContact CD2-CD1 4.02Å; L405-Y436 HydrophobicContact CD1-CD2 3.87Å; L405-Y436 HydrophobicContact CD1-CE2 3.6Å; L405-Y436 HydrophobicContact CD2-CD2 3.68Å; L405-Y436 HydrophobicContact CD2-CE2 4.23Å; L405-Y436 HydrophobicContact CD2-CG 4.15Å; L405-Y436 HydrophobicContact CG-CD2 3.82Å; L405-Y436 HydrophobicContact CG-CE2 4.1Å
406	E	84.8	Confident	83.2	Confident	90 Å²	90	64.1 Å²	64.1	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-47.8	179.2	-171.9	173.8	-164	0	0	111.6	E402 K408 R409 M410	E402-E406 WeakPolarHBondContact O-CB 3.37Å; E402-E406 PolarHBondContact O-N 3.06Å; E406-K408 VanDerWaalsContact C-N 3.29Å; E406-K408 PolarHBondContact O-N 2.91Å; E406-R409 PolarHBondContact O-N 2.69Å; E406-M410 WeakPolarHBondContact O-CB 3.4Å; E406-M410 WeakPolarHBondContact O-CG 3.28Å; E406-M410 PolarHBondContact O-N 3.46Å
407	M	86.1	Confident	83	Confident	71 Å²	71	68.9 Å²	68.9	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-58.1	-42	174.9	178	-174.6	47.6	0	0	111.6	N403 F404 K411 E700	N403-M407 WeakPolarHBondContact O-CB 3.22Å; N403-M407 PolarHBondContact O-N 3.13Å; F404-M407 HydrophobicContact CD2-CE 4.37Å; F404-M407 PolarHBondContact O-N 3.38Å; M407-K411 WeakPolarHBondContact O-CB 3.43Å; M407-K411 PolarHBondContact O-N 3.42Å; M407-E700 WeakPolarHBondContact CE-OE1 3.27Å
408	K	86.5	Confident	82.3	Confident	46 Å²	46	69.7 Å²	69.7	20%	0.2	35%	0.349	C	S	.	.	H	α-helix	trans	-70.7	-41.2	177.6	-63.5	-44.8	178.1	-166.5	0	111.7	F404 L405 E406 M410 K411 F412 L428 I432	F404-K408 HydrophobicContact CD2-CG 4.44Å; F404-K408 HydrophobicContact CE1-CG 4.2Å; F404-K408 HydrophobicContact CE2-CD 4.41Å; F404-K408 HydrophobicContact CE2-CG 4.13Å; F404-K408 HydrophobicContact CZ-CG 3.99Å; F404-K408 VanDerWaalsContact O-CG 3.29Å; F404-K408 WeakPolarHBondContact O-CG 3.26Å; F404-K408 PolarHBondContact O-N 3.12Å; L405-K408 PolarHBondContact O-N 3.3Å; E406-K408 VanDerWaalsContact C-N 3.29Å; E406-K408 PolarHBondContact O-N 2.91Å; K408-M410 PolarHBondContact O-N 3.49Å; K408-K411 PolarHBondContact O-N 2.96Å; K408-K411 VanDerWaalsContact O-N 3.16Å; K408-F412 VanDerWaalsContact O-CD2 3.27Å; K408-F412 WeakPolarHBondContact O-CD2 3.27Å; K408-F412 PolarHBondContact O-N 2.99Å; K408-L428 HydrophobicContact CB-CD2 4.12Å; K408-I432 HydrophobicContact CB-CD1 4.44Å; K408-I432 HydrophobicContact CB-CG2 4.12Å; K408-I432 HydrophobicContact CD-CD1 4.14Å; K408-I432 HydrophobicContact CG-CD1 4.23Å; K408-I432 HydrophobicContact CG-CG2 3.83Å
409	R	86.8	Confident	81.7	Confident	9 Å²	9	75.1 Å²	75.1	3%	0.034	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-43.6	177.5	-72.7	161.4	177.5	175.7	-4.4	111.4	L405 E406 K411 F412 F413 G414 F417 D421 T424	L405-R409 WeakPolarHBondContact O-CB 3.32Å; L405-R409 WeakPolarHBondContact O-CD 3.46Å; L405-R409 WeakPolarHBondContact O-CG 3.23Å; L405-R409 PolarHBondContact O-N 3.49Å; E406-R409 PolarHBondContact O-N 2.69Å; R409-K411 VanDerWaalsContact C-N 3.32Å; R409-K411 PolarHBondContact O-N 3.17Å; R409-F412 PolarHBondContact O-N 3.5Å; R409-F413 HydrophobicContact CB-CD2 3.95Å; R409-F413 HydrophobicContact CB-CE2 4.4Å; R409-F413 HydrophobicContact CG-CD2 4.07Å; R409-F413 HydrophobicContact CG-CE2 4.05Å; R409-F413 WeakPolarHBondContact O-CA 3.38Å; R409-F413 WeakPolarHBondContact O-CB 2.98Å; R409-F413 WeakPolarHBondContact O-CD2 3.33Å; R409-F413 PolarHBondContact O-N 3.05Å; R409-G414 PolarHBondContact O-N 3.27Å; R409-F417 HydrophobicContact CG-CE2 4.38Å; R409-D421 IonicContact CZ-OD2 3.19Å; R409-D421 PolarHBondContact NH1-O 3.47Å; R409-D421 IonicContact NH1-OD2 3.13Å; R409-D421 PolarHBondContact NH1-OD2 2.97Å; R409-D421 PolarHBondContact NH2-O 2.93Å; R409-D421 IonicContact NH2-OD1 3.76Å; R409-D421 IonicContact NH2-OD2 2.71Å; R409-D421 PolarHBondContact NH2-OD2 3.4Å; R409-T424 PolarHBondContact NE-O 3.4Å; R409-T424 PolarHBondContact NH2-O 3.42Å
410	M	85.6	Confident	81	Confident	95 Å²	95	70.9 Å²	70.9	47%	0.468	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-38.8	173.4	-70.3	-61.3	-99.1	0	0	112	E406 K408 G414	E406-M410 WeakPolarHBondContact O-CB 3.4Å; E406-M410 WeakPolarHBondContact O-CG 3.28Å; E406-M410 PolarHBondContact O-N 3.46Å; K408-M410 PolarHBondContact O-N 3.49Å; M410-G414 VanDerWaalsContact O-CA 3.25Å; M410-G414 WeakPolarHBondContact O-CA 3.28Å; M410-G414 PolarHBondContact O-N 2.99Å; M410-G414 VanDerWaalsContact O-N 3.11Å
411	K	86.2	Confident	80.8	Confident	156 Å²	156	72 Å²	72	68%	0.678	38%	0.376	S	S	*	.	H	α-helix	trans	-67.4	-36.6	177.1	-175.5	175.5	179.7	178.2	0	113.7	M407 K408 R409	M407-K411 WeakPolarHBondContact O-CB 3.43Å; M407-K411 PolarHBondContact O-N 3.42Å; K408-K411 PolarHBondContact O-N 2.96Å; K408-K411 VanDerWaalsContact O-N 3.16Å; R409-K411 VanDerWaalsContact C-N 3.32Å; R409-K411 PolarHBondContact O-N 3.17Å
412	F	86.3	Confident	80.2	Confident	95 Å²	95	77.4 Å²	77.4	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-100.4	-35.6	-172.4	-78.6	-84.7	0	0	0	114.2	K408 R409 L428 P429 I432	K408-F412 VanDerWaalsContact O-CD2 3.27Å; K408-F412 WeakPolarHBondContact O-CD2 3.27Å; K408-F412 PolarHBondContact O-N 2.99Å; R409-F412 PolarHBondContact O-N 3.5Å; F412-L428 HydrophobicContact CB-CD2 4.21Å; F412-L428 HydrophobicContact CD2-CD2 4.24Å; F412-L428 HydrophobicContact CG-CD2 4.41Å; F412-P429 HydrophobicContact CD1-CG 3.93Å; F412-P429 HydrophobicContact CE1-CG 3.47Å; F412-P429 VanDerWaalsContact CE1-CG 3.47Å; F412-P429 HydrophobicContact CZ-CG 3.85Å; F412-I432 HydrophobicContact CD2-CD1 3.81Å; F412-I432 HydrophobicContact CE2-CD1 3.1Å; F412-I432 HydrophobicContact CZ-CD1 3.59Å
413	F	83.4	Confident	80	Confident	88 Å²	88	80.2 Å²	80.2	39%	0.386	42%	0.416	S	S	.	.	H	α-helix	trans	-108.7	-19.5	-179.3	-48.7	-65.6	0	0	0	113.1	R409 Y415 V426 L428	R409-F413 HydrophobicContact CB-CD2 3.95Å; R409-F413 HydrophobicContact CB-CE2 4.4Å; R409-F413 HydrophobicContact CG-CD2 4.07Å; R409-F413 HydrophobicContact CG-CE2 4.05Å; R409-F413 WeakPolarHBondContact O-CA 3.38Å; R409-F413 WeakPolarHBondContact O-CB 2.98Å; R409-F413 WeakPolarHBondContact O-CD2 3.33Å; R409-F413 PolarHBondContact O-N 3.05Å; F413-Y415 PolarHBondContact O-N 3.47Å; F413-V426 VanDerWaalsContact CZ-O 3.28Å; F413-V426 WeakPolarHBondContact CZ-O 3.41Å; F413-L428 HydrophobicContact CE2-CD2 3.61Å; F413-L428 HydrophobicContact CE2-CG 3.92Å; F413-L428 HydrophobicContact CZ-CD2 4.02Å; F413-L428 HydrophobicContact CZ-CG 4.13Å
414	G	81.3	Confident	79.9	Confident	57 Å²	57	78.7 Å²	78.7	59%	0.588	41%	0.41	S	S	*	.	S	Bend	trans	67.2	14.2	-169.6	0	0	0	0	0	113.7	R409 M410	R409-G414 PolarHBondContact O-N 3.27Å; M410-G414 VanDerWaalsContact O-CA 3.25Å; M410-G414 WeakPolarHBondContact O-CA 3.28Å; M410-G414 PolarHBondContact O-N 2.99Å; M410-G414 VanDerWaalsContact O-N 3.11Å
415	Y	80.5	Confident	79.7	Confident	150 Å²	150	79 Å²	79	59%	0.588	41%	0.414	S	S	*	.			trans	-133.8	137	-174.6	-173.3	-100	0	0	0	111.6	F413 F417	F413-Y415 PolarHBondContact O-N 3.47Å; Y415-F417 HydrophobicContact CD1-CD1 4.36Å; Y415-F417 HydrophobicContact CD1-CE1 4.44Å; Y415-F417 HydrophobicContact CE1-CD1 4.06Å; Y415-F417 HydrophobicContact CE1-CE1 4.4Å
416	S	75.1	Confident	79.4	Confident	43 Å²	43	84.4 Å²	84.4	30%	0.301	45%	0.446	S	S	.	.			trans	-105.3	131.5	173.9	57.2	0	0	0	0	110	G418	S416-G418 PolarHBondContact O-N 2.87Å; S416-G418 VanDerWaalsContact O-N 3.08Å
417	F	73	Confident	79.3	Confident	100 Å²	100	82.8 Å²	82.8	44%	0.439	45%	0.454	S	S	.	.			trans	-72.1	5.5	177.6	-67.4	-71.9	0	0	0	114.6	R409 Y415 D421	R409-F417 HydrophobicContact CG-CE2 4.38Å; Y415-F417 HydrophobicContact CD1-CD1 4.36Å; Y415-F417 HydrophobicContact CD1-CE1 4.44Å; Y415-F417 HydrophobicContact CE1-CD1 4.06Å; Y415-F417 HydrophobicContact CE1-CE1 4.4Å; F417-D421 HydrophobicContact CB-CB 3.96Å; F417-D421 WeakPolarHBondContact CD2-OD2 3.34Å
418	G	67.7	Low	79.4	Confident	45 Å²	45	79.7 Å²	79.7	46%	0.464	44%	0.438	S	S	.	.			trans	83.2	171.6	-172.5	0	0	0	0	0	113.1	S416 G420	S416-G418 PolarHBondContact O-N 2.87Å; S416-G418 VanDerWaalsContact O-N 3.08Å; G418-G420 PolarHBondContact O-N 3.25Å
419	E	67.8	Low	79.6	Confident	212 Å²	212	79.8 Å²	79.8	99%	0.991	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	121.5	179.5	-67.1	-174.3	169.4	0	0	110.5
420	G	66.9	Low	79.7	Confident	52 Å²	52	86.9 Å²	86.9	54%	0.536	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.9	-18.5	168.8	0	0	0	0	0	116.7	G418 R422	G418-G420 PolarHBondContact O-N 3.25Å; G420-R422 PolarHBondContact O-N 2.99Å; G420-R422 VanDerWaalsContact O-N 3.11Å
421	D	75.8	Confident	80	Confident	39 Å²	39	86.8 Å²	86.8	21%	0.209	48%	0.481	C	S	.	.			trans	-77.1	103.1	176.7	174.7	31.9	0	0	0	111.7	R409 F417 V423 T424	R409-D421 IonicContact CZ-OD2 3.19Å; R409-D421 PolarHBondContact NH1-O 3.47Å; R409-D421 IonicContact NH1-OD2 3.13Å; R409-D421 PolarHBondContact NH1-OD2 2.97Å; R409-D421 PolarHBondContact NH2-O 2.93Å; R409-D421 IonicContact NH2-OD1 3.76Å; R409-D421 IonicContact NH2-OD2 2.71Å; R409-D421 PolarHBondContact NH2-OD2 3.4Å; F417-D421 HydrophobicContact CB-CB 3.96Å; F417-D421 WeakPolarHBondContact CD2-OD2 3.34Å; D421-V423 PolarHBondContact OD1-N 3.09Å; D421-T424 VanDerWaalsContact CG-OG1 3.26Å; D421-T424 WeakPolarHBondContact OD1-CB 3.25Å; D421-T424 PolarHBondContact OD1-N 2.95Å; D421-T424 PolarHBondContact OD1-OG1 3.24Å; D421-T424 WeakPolarHBondContact OD2-CB 3.45Å; D421-T424 PolarHBondContact OD2-OG1 3.4Å; D421-T424 VanDerWaalsContact OD2-OG1 3.08Å
422	R	70.7	Confident	80	Confident	122 Å²	122	80.3 Å²	80.3	46%	0.46	45%	0.454	S	S	.	.			trans	-100.5	-12.2	-173.9	-69	169	179.5	176.7	0.4	114.7	E402 L405 G420 Y436	E402-R422 HydrophobicContact CG-CG 3.95Å; E402-R422 IonicContact OE1-CZ 2.78Å; E402-R422 IonicContact OE1-NE 2.76Å; E402-R422 PolarHBondContact OE1-NE 3.14Å; E402-R422 IonicContact OE1-NH2 3.2Å; E402-R422 PolarHBondContact OE1-NH2 2.98Å; L405-R422 WeakPolarHBondContact CD1-O 3.31Å; G420-R422 PolarHBondContact O-N 2.99Å; G420-R422 VanDerWaalsContact O-N 3.11Å; R422-Y436 PolarHBondContact O-OH 3.48Å
423	V	79.8	Confident	80.2	Confident	107 Å²	107	78.7 Å²	78.7	65%	0.648	45%	0.447	S	S	*	.	S	Bend	trans	-118	-26.1	-161.2	-136	0	0	0	0	112.3	D421 T425	D421-V423 PolarHBondContact OD1-N 3.09Å; V423-T425 PolarHBondContact O-N 2.87Å
424	T	81.7	Confident	80.4	Confident	51 Å²	51	80.7 Å²	80.7	31%	0.313	46%	0.458	S	S	.	.			trans	-74.1	101.4	-171.2	-48.7	0	0	0	0	111.9	R409 D421 V426	R409-T424 PolarHBondContact NE-O 3.4Å; R409-T424 PolarHBondContact NH2-O 3.42Å; D421-T424 VanDerWaalsContact CG-OG1 3.26Å; D421-T424 WeakPolarHBondContact OD1-CB 3.25Å; D421-T424 PolarHBondContact OD1-N 2.95Å; D421-T424 PolarHBondContact OD1-OG1 3.24Å; D421-T424 WeakPolarHBondContact OD2-CB 3.45Å; D421-T424 PolarHBondContact OD2-OG1 3.4Å; D421-T424 VanDerWaalsContact OD2-OG1 3.08Å; T424-V426 HydrophobicContact CG2-CB 4.09Å; T424-V426 HydrophobicContact CG2-CG2 4Å
425	T	81.3	Confident	80.6	Confident	31 Å²	31	80.3 Å²	80.3	19%	0.19	45%	0.446	C	S	.	.			trans	-99.4	8.2	173.1	59.5	0	0	0	0	113.2	L405 V423 G427 L428 Y436	L405-T425 HydrophobicContact CD2-CG2 4.33Å; V423-T425 PolarHBondContact O-N 2.87Å; T425-G427 PolarHBondContact O-N 2.87Å; T425-L428 WeakPolarHBondContact O-CB 3.42Å; T425-L428 PolarHBondContact O-N 3.5Å; T425-Y436 HydrophobicContact CG2-CD1 3.42Å; T425-Y436 VanDerWaalsContact CG2-CD1 3.42Å; T425-Y436 HydrophobicContact CG2-CE1 3.59Å; T425-Y436 HydrophobicContact CG2-CG 3.91Å
426	V	79.2	Confident	81	Confident	114 Å²	114	74.2 Å²	74.2	69%	0.691	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	131.3	-176.3	-177.5	0	0	0	0	109.9	F413 T424 L428	F413-V426 VanDerWaalsContact CZ-O 3.28Å; F413-V426 WeakPolarHBondContact CZ-O 3.41Å; T424-V426 HydrophobicContact CG2-CB 4.09Å; T424-V426 HydrophobicContact CG2-CG2 4Å; V426-L428 VanDerWaalsContact C-N 3.28Å; V426-L428 PolarHBondContact O-N 3.33Å
427	G	84.2	Confident	81.6	Confident	56 Å²	56	75.7 Å²	75.7	58%	0.577	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	-11.9	-179	0	0	0	0	0	115.7	T425	T425-G427 PolarHBondContact O-N 2.87Å
428	L	87.4	Confident	82.1	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.026	43%	0.425	C	S	.	.	S	Bend	trans	-76	140.5	176	-68.5	173.9	0	0	0	110.2	L405 K408 F412 F413 T425 V426 I432 Q433	L405-L428 HydrophobicContact CD2-CD1 4.02Å; K408-L428 HydrophobicContact CB-CD2 4.12Å; F412-L428 HydrophobicContact CB-CD2 4.21Å; F412-L428 HydrophobicContact CD2-CD2 4.24Å; F412-L428 HydrophobicContact CG-CD2 4.41Å; F413-L428 HydrophobicContact CE2-CD2 3.61Å; F413-L428 HydrophobicContact CE2-CG 3.92Å; F413-L428 HydrophobicContact CZ-CD2 4.02Å; F413-L428 HydrophobicContact CZ-CG 4.13Å; T425-L428 WeakPolarHBondContact O-CB 3.42Å; T425-L428 PolarHBondContact O-N 3.5Å; V426-L428 VanDerWaalsContact C-N 3.28Å; V426-L428 PolarHBondContact O-N 3.33Å; L428-I432 HydrophobicContact CB-CB 4.49Å; L428-I432 HydrophobicContact CB-CG2 4.26Å; L428-I432 HydrophobicContact CD1-CG2 4.07Å; L428-Q433 HydrophobicContact CB-CG 4.45Å; L428-Q433 PolarHBondContact O-NE2 2.86Å
429	P	90.2	Very high	82.8	Confident	49 Å²	49	71.5 Å²	71.5	32%	0.318	41%	0.405	S	S	.	.			trans	-54.4	145.4	174.8	-27.5	31.8	0	0	0	113.8	F412 P431 I432 Q433	F412-P429 HydrophobicContact CD1-CG 3.93Å; F412-P429 HydrophobicContact CE1-CG 3.47Å; F412-P429 VanDerWaalsContact CE1-CG 3.47Å; F412-P429 HydrophobicContact CZ-CG 3.85Å; P429-P431 VanDerWaalsContact C-CD 3.45Å; P429-I432 HydrophobicContact CG-CD1 4.36Å; P429-I432 WeakPolarHBondContact O-CA 3.43Å; P429-I432 WeakPolarHBondContact O-CB 3.27Å; P429-I432 PolarHBondContact O-N 3.07Å; P429-Q433 PolarHBondContact O-N 3.21Å
430	K	89.9	Confident	83.6	Confident	158 Å²	158	64.4 Å²	64.4	69%	0.687	38%	0.376	S	S	*	.	H	α-helix	trans	-47.5	-44.3	-179.8	-68.5	-176.1	178	-178	0	114.6	I432 Q433 E434	K430-I432 PolarHBondContact O-N 3.45Å; K430-Q433 WeakPolarHBondContact O-CB 3.34Å; K430-Q433 PolarHBondContact O-N 3.47Å; K430-E434 WeakPolarHBondContact O-CG 3.29Å; K430-E434 PolarHBondContact O-N 3.48Å
431	P	91	Very high	84.3	Confident	92 Å²	92	71.3 Å²	71.3	60%	0.597	39%	0.385	S	S	*	.	H	α-helix	trans	-61.2	-29.3	178.2	-25.1	35.7	0	0	0	114	P429 S435	P429-P431 VanDerWaalsContact C-CD 3.45Å; P431-S435 WeakPolarHBondContact O-CB 3.33Å; P431-S435 PolarHBondContact O-N 3.47Å
432	I	87.9	Confident	84.6	Confident	20 Å²	20	73.4 Å²	73.4	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-76.6	-39.2	176.3	-64.3	179.5	0	0	0	110.3	F404 K408 F412 L428 P429 K430 E434 S435 Y436	F404-I432 HydrophobicContact CE1-CG2 4.05Å; F404-I432 HydrophobicContact CZ-CG2 4.09Å; K408-I432 HydrophobicContact CB-CD1 4.44Å; K408-I432 HydrophobicContact CB-CG2 4.12Å; K408-I432 HydrophobicContact CD-CD1 4.14Å; K408-I432 HydrophobicContact CG-CD1 4.23Å; K408-I432 HydrophobicContact CG-CG2 3.83Å; F412-I432 HydrophobicContact CD2-CD1 3.81Å; F412-I432 HydrophobicContact CE2-CD1 3.1Å; F412-I432 HydrophobicContact CZ-CD1 3.59Å; L428-I432 HydrophobicContact CB-CB 4.49Å; L428-I432 HydrophobicContact CB-CG2 4.26Å; L428-I432 HydrophobicContact CD1-CG2 4.07Å; P429-I432 HydrophobicContact CG-CD1 4.36Å; P429-I432 WeakPolarHBondContact O-CA 3.43Å; P429-I432 WeakPolarHBondContact O-CB 3.27Å; P429-I432 PolarHBondContact O-N 3.07Å; K430-I432 PolarHBondContact O-N 3.45Å; I432-E434 VanDerWaalsContact C-N 3.31Å; I432-E434 PolarHBondContact O-N 3.47Å; I432-S435 PolarHBondContact O-N 3Å; I432-Y436 WeakPolarHBondContact O-CB 3.5Å; I432-Y436 PolarHBondContact O-N 3.14Å
433	Q	88.9	Confident	85.2	Confident	61 Å²	61	69 Å²	69	29%	0.285	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-43	173.2	-56.8	-179.3	3.7	0	0	110.8	L428 P429 K430 S435 Y436 N437	L428-Q433 HydrophobicContact CB-CG 4.45Å; L428-Q433 PolarHBondContact O-NE2 2.86Å; P429-Q433 PolarHBondContact O-N 3.21Å; K430-Q433 WeakPolarHBondContact O-CB 3.34Å; K430-Q433 PolarHBondContact O-N 3.47Å; Q433-S435 PolarHBondContact O-N 3.4Å; Q433-Y436 PolarHBondContact O-N 3.36Å; Q433-N437 WeakPolarHBondContact O-CB 3.25Å; Q433-N437 PolarHBondContact O-N 2.94Å; Q433-N437 PolarHBondContact O-ND2 2.85Å
434	E	88.5	Confident	85.4	Confident	131 Å²	131	66.5 Å²	66.5	61%	0.612	36%	0.36	S	S	*	.	H	α-helix	trans	-60.5	-44.5	173.3	-72.5	172.3	-165.1	0	0	111.9	K430 I432 N437 A438	K430-E434 WeakPolarHBondContact O-CG 3.29Å; K430-E434 PolarHBondContact O-N 3.48Å; I432-E434 VanDerWaalsContact C-N 3.31Å; I432-E434 PolarHBondContact O-N 3.47Å; E434-N437 PolarHBondContact O-N 3.3Å; E434-A438 WeakPolarHBondContact O-CB 3.48Å; E434-A438 PolarHBondContact O-N 3.05Å
435	S	86.1	Confident	85.5	Confident	48 Å²	48	65.3 Å²	65.3	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-65	-39	176.8	-175.9	0	0	0	0	112.9	F404 P431 I432 Q433 A438 Q439	F404-S435 WeakPolarHBondContact CZ-OG 3.41Å; P431-S435 WeakPolarHBondContact O-CB 3.33Å; P431-S435 PolarHBondContact O-N 3.47Å; I432-S435 PolarHBondContact O-N 3Å; Q433-S435 PolarHBondContact O-N 3.4Å; S435-A438 PolarHBondContact O-N 3.44Å; S435-Q439 WeakPolarHBondContact O-CG 3.28Å; S435-Q439 PolarHBondContact O-N 2.91Å
436	Y	87.6	Confident	85.8	Confident	22 Å²	22	64.2 Å²	64.2	9%	0.086	35%	0.346	C	S	.	.	H	α-helix	trans	-62.5	-51	172.5	164.1	-100.4	0	0	0	110.6	V401 L405 R422 T425 I432 Q433 A438 Q439 V440	V401-Y436 HydrophobicContact CG1-CD2 3.77Å; V401-Y436 HydrophobicContact CG1-CE2 3.61Å; L405-Y436 HydrophobicContact CD1-CD2 3.87Å; L405-Y436 HydrophobicContact CD1-CE2 3.6Å; L405-Y436 HydrophobicContact CD2-CD2 3.68Å; L405-Y436 HydrophobicContact CD2-CE2 4.23Å; L405-Y436 HydrophobicContact CD2-CG 4.15Å; L405-Y436 HydrophobicContact CG-CD2 3.82Å; L405-Y436 HydrophobicContact CG-CE2 4.1Å; R422-Y436 PolarHBondContact O-OH 3.48Å; T425-Y436 HydrophobicContact CG2-CD1 3.42Å; T425-Y436 VanDerWaalsContact CG2-CD1 3.42Å; T425-Y436 HydrophobicContact CG2-CE1 3.59Å; T425-Y436 HydrophobicContact CG2-CG 3.91Å; I432-Y436 WeakPolarHBondContact O-CB 3.5Å; I432-Y436 PolarHBondContact O-N 3.14Å; Q433-Y436 PolarHBondContact O-N 3.36Å; Y436-A438 VanDerWaalsContact C-N 3.25Å; Y436-A438 PolarHBondContact O-N 3.01Å; Y436-Q439 WeakPolarHBondContact O-CA 3.36Å; Y436-Q439 WeakPolarHBondContact O-CB 3.4Å; Y436-Q439 PolarHBondContact O-N 3.12Å; Y436-V440 HydrophobicContact CD1-CG2 4.28Å; Y436-V440 HydrophobicContact CD2-CG2 3.89Å; Y436-V440 HydrophobicContact CE1-CG2 3.87Å; Y436-V440 HydrophobicContact CE2-CG2 3.41Å; Y436-V440 VanDerWaalsContact CE2-CG2 3.41Å; Y436-V440 HydrophobicContact CG-CG2 4.31Å; Y436-V440 VanDerWaalsContact CZ-CG2 3.41Å; Y436-V440 WeakPolarHBondContact O-CG2 2.98Å; Y436-V440 PolarHBondContact O-N 3.42Å
437	N	87.7	Confident	86.2	Confident	75 Å²	75	59.3 Å²	59.3	40%	0.401	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-39.4	177.8	-71.1	-23.3	0	0	0	111.7	Q433 E434 R441	Q433-N437 WeakPolarHBondContact O-CB 3.25Å; Q433-N437 PolarHBondContact O-N 2.94Å; Q433-N437 PolarHBondContact O-ND2 2.85Å; E434-N437 PolarHBondContact O-N 3.3Å; N437-R441 VanDerWaalsContact O-CG 3.28Å; N437-R441 WeakPolarHBondContact O-CG 3.25Å; N437-R441 PolarHBondContact O-N 3.06Å; N437-R441 VanDerWaalsContact O-N 3.14Å
438	A	84.3	Confident	86.3	Confident	47 Å²	47	57.8 Å²	57.8	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-39.2	174.7	0	0	0	0	0	112.5	E434 S435 Y436 H442	E434-A438 WeakPolarHBondContact O-CB 3.48Å; E434-A438 PolarHBondContact O-N 3.05Å; S435-A438 PolarHBondContact O-N 3.44Å; Y436-A438 VanDerWaalsContact C-N 3.25Å; Y436-A438 PolarHBondContact O-N 3.01Å; A438-H442 PolarHBondContact O-CD2 2.97Å; A438-H442 VanDerWaalsContact O-CD2 3.28Å
439	Q	82.2	Confident	86.4	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-68.3	-45.1	176.2	-74.2	176.5	59.8	0	0	111.9	V396 V401 F404 S435 Y436 R441 H442 V443 I697	V396-Q439 HydrophobicContact CG1-CB 4.38Å; V401-Q439 HydrophobicContact CG2-CB 4.15Å; F404-Q439 VanDerWaalsContact CD2-NE2 3.34Å; F404-Q439 VanDerWaalsContact CG-NE2 3.31Å; S435-Q439 WeakPolarHBondContact O-CG 3.28Å; S435-Q439 PolarHBondContact O-N 2.91Å; Y436-Q439 WeakPolarHBondContact O-CA 3.36Å; Y436-Q439 WeakPolarHBondContact O-CB 3.4Å; Y436-Q439 PolarHBondContact O-N 3.12Å; Q439-R441 VanDerWaalsContact C-N 3.3Å; Q439-R441 PolarHBondContact O-N 3.48Å; Q439-H442 CarbonylContact O-C 3.32Å; Q439-H442 WeakPolarHBondContact O-CA 3.38Å; Q439-H442 PolarHBondContact O-N 3.11Å; Q439-V443 PolarHBondContact O-N 3.38Å; Q439-I697 HydrophobicContact CG-CD1 4.18Å
440	V	85.2	Confident	86.2	Confident	62 Å²	62	62 Å²	62	38%	0.376	31%	0.312	S	S	.	.	H	α-helix	trans	-57.4	-42.5	178.5	173	0	0	0	0	111.4	V401 Y436 H442 V443	V401-V440 HydrophobicContact CG1-CG2 4.23Å; Y436-V440 HydrophobicContact CD1-CG2 4.28Å; Y436-V440 HydrophobicContact CD2-CG2 3.89Å; Y436-V440 HydrophobicContact CE1-CG2 3.87Å; Y436-V440 HydrophobicContact CE2-CG2 3.41Å; Y436-V440 VanDerWaalsContact CE2-CG2 3.41Å; Y436-V440 HydrophobicContact CG-CG2 4.31Å; Y436-V440 VanDerWaalsContact CZ-CG2 3.41Å; Y436-V440 WeakPolarHBondContact O-CG2 2.98Å; Y436-V440 PolarHBondContact O-N 3.42Å; V440-H442 PolarHBondContact O-N 3.11Å; V440-H442 VanDerWaalsContact O-N 3.17Å; V440-V443 WeakPolarHBondContact O-CG2 3.35Å; V440-V443 PolarHBondContact O-N 2.97Å
441	R	81.7	Confident	86.2	Confident	197 Å²	197	54.9 Å²	54.9	74%	0.743	28%	0.282	S	S	*	.	H	α-helix	trans	-60.3	-24.1	175.8	-74.2	173.6	-173	177.5	2.4	114.1	N437 Q439	N437-R441 VanDerWaalsContact O-CG 3.28Å; N437-R441 WeakPolarHBondContact O-CG 3.25Å; N437-R441 PolarHBondContact O-N 3.06Å; N437-R441 VanDerWaalsContact O-N 3.14Å; Q439-R441 VanDerWaalsContact C-N 3.3Å; Q439-R441 PolarHBondContact O-N 3.48Å
442	H	80.7	Confident	86.2	Confident	83 Å²	83	52.9 Å²	52.9	38%	0.384	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	17.1	-177.9	-72.5	-56.7	0	0	0	112.6	S394 V396 A438 Q439 V440 Y444	S394-H442 WeakPolarHBondContact O-CB 3.25Å; V396-H442 HydrophobicContact CG2-CB 4.06Å; V396-H442 PolarHBondContact N-O 2.93Å; A438-H442 PolarHBondContact O-CD2 2.97Å; A438-H442 VanDerWaalsContact O-CD2 3.28Å; Q439-H442 CarbonylContact O-C 3.32Å; Q439-H442 WeakPolarHBondContact O-CA 3.38Å; Q439-H442 PolarHBondContact O-N 3.11Å; V440-H442 PolarHBondContact O-N 3.11Å; V440-H442 VanDerWaalsContact O-N 3.17Å; H442-Y444 PolarHBondContact O-N 3.38Å
443	V	83	Confident	86.2	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.176	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-67.2	120.3	174	173.7	0	0	0	0	109.2	V396 F398 V401 Q439 V440 V445	V396-V443 CarbonylContact O-C 3.41Å; V396-V443 VanDerWaalsContact O-CA 3.29Å; V396-V443 WeakPolarHBondContact O-CA 3.34Å; F398-V443 HydrophobicContact CD1-CG1 3.87Å; F398-V443 HydrophobicContact CD1-CG2 4.38Å; F398-V443 HydrophobicContact CD2-CG1 3.77Å; F398-V443 HydrophobicContact CE1-CB 4.45Å; F398-V443 HydrophobicContact CE1-CG1 3.71Å; F398-V443 HydrophobicContact CE1-CG2 4.32Å; F398-V443 HydrophobicContact CE2-CG1 3.62Å; F398-V443 HydrophobicContact CG-CG1 3.89Å; F398-V443 HydrophobicContact CZ-CG1 3.58Å; V401-V443 HydrophobicContact CG2-CG2 3.77Å; Q439-V443 PolarHBondContact O-N 3.38Å; V440-V443 WeakPolarHBondContact O-CG2 3.35Å; V440-V443 PolarHBondContact O-N 2.97Å; V443-V445 HydrophobicContact CG1-CG2 4.28Å
444	Y	84	Confident	86.1	Confident	55 Å²	55	54.3 Å²	54.3	22%	0.216	28%	0.276	C	S	.	.			trans	-107.1	115	175.9	176.2	-96.9	0	0	0	109.5	K395 V396 H442	K395-Y444 HydrophobicContact CD-CD1 4.28Å; K395-Y444 HydrophobicContact CD-CD2 4.3Å; K395-Y444 HydrophobicContact CD-CG 4.03Å; K395-Y444 HydrophobicContact CG-CG 4.16Å; V396-Y444 PolarHBondContact O-N 3.05Å; H442-Y444 PolarHBondContact O-N 3.38Å
445	V	84.6	Confident	86.2	Confident	26 Å²	26	50 Å²	50	16%	0.158	26%	0.257	C	S	.	.			trans	-96.6	125	168.7	-171.7	0	0	0	0	108.9	R288 L293 F398 V443 E449 M450	R288-V445 PolarHBondContact NH1-O 3.3Å; L293-V445 HydrophobicContact CD2-CB 3.89Å; L293-V445 HydrophobicContact CD2-CG1 4.2Å; L293-V445 HydrophobicContact CD2-CG2 4.48Å; F398-V445 HydrophobicContact CD2-CG2 3.92Å; F398-V445 HydrophobicContact CE2-CG2 3.35Å; F398-V445 HydrophobicContact CZ-CG2 4.3Å; V443-V445 HydrophobicContact CG1-CG2 4.28Å; V445-E449 HydrophobicContact CG1-CB 4.43Å; V445-M450 HydrophobicContact CG1-CG 4.06Å; V445-M450 HydrophobicContact CG1-SD 3.86Å
446	S	87.1	Confident	86.4	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.063	27%	0.269	C	S	.	.			trans	-79.1	145.7	176	69.3	0	0	0	0	110.8	S448 E449 M450	S446-S448 WeakPolarHBondContact CB-OG 3.48Å; S446-S448 PolarHBondContact O-N 2.85Å; S446-S448 PolarHBondContact OG-OG 3.46Å; S446-E449 WeakPolarHBondContact CB-OE2 3.23Å; S446-E449 PolarHBondContact N-OE2 3.31Å; S446-E449 PolarHBondContact O-N 3.14Å; S446-E449 WeakPolarHBondContact OG-CG 3.43Å; S446-E449 PolarHBondContact OG-N 3.34Å; S446-E449 PolarHBondContact OG-OE2 2.57Å; S446-M450 PolarHBondContact O-N 3.02Å
447	L	87.4	Confident	86.4	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-55.8	-35.8	173.4	-177.7	64.2	0	0	0	111.4	K287 R288 F291 E449 M450 Q451	K287-L447 HydrophobicContact CB-CD2 4.31Å; R288-L447 HydrophobicContact CG-CB 4.45Å; R288-L447 HydrophobicContact CG-CD1 4.47Å; F291-L447 HydrophobicContact CD2-CD1 3.44Å; F291-L447 VanDerWaalsContact CD2-CD1 3.44Å; F291-L447 HydrophobicContact CE2-CD1 3.75Å; F291-L447 HydrophobicContact CG-CD1 4.44Å; L447-E449 VanDerWaalsContact C-N 3.34Å; L447-E449 PolarHBondContact O-N 3.07Å; L447-M450 WeakPolarHBondContact O-CB 3.48Å; L447-M450 PolarHBondContact O-N 2.89Å; L447-Q451 WeakPolarHBondContact O-CG 3.3Å; L447-Q451 PolarHBondContact O-N 3.09Å
448	S	88	Confident	86.5	Confident	23 Å²	23	55.2 Å²	55.2	16%	0.161	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-36.2	176.3	43	0	0	0	0	113.9	S446 M450 Q451 I452	S446-S448 WeakPolarHBondContact CB-OG 3.48Å; S446-S448 PolarHBondContact O-N 2.85Å; S446-S448 PolarHBondContact OG-OG 3.46Å; S448-M450 VanDerWaalsContact C-N 3.35Å; S448-Q451 PolarHBondContact O-N 3.4Å; S448-I452 WeakPolarHBondContact O-CD1 3.33Å; S448-I452 WeakPolarHBondContact O-CG1 3.37Å; S448-I452 PolarHBondContact O-N 2.7Å
449	E	88.1	Confident	86.6	Confident	84 Å²	84	59.2 Å²	59.2	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-68.9	-37.4	176.4	-75.8	154.6	163.4	0	0	111	V445 S446 L447 I452 A453	V445-E449 HydrophobicContact CG1-CB 4.43Å; S446-E449 WeakPolarHBondContact CB-OE2 3.23Å; S446-E449 PolarHBondContact N-OE2 3.31Å; S446-E449 PolarHBondContact O-N 3.14Å; S446-E449 WeakPolarHBondContact OG-CG 3.43Å; S446-E449 PolarHBondContact OG-N 3.34Å; S446-E449 PolarHBondContact OG-OE2 2.57Å; L447-E449 VanDerWaalsContact C-N 3.34Å; L447-E449 PolarHBondContact O-N 3.07Å; E449-I452 PolarHBondContact O-N 2.94Å; E449-A453 VanDerWaalsContact O-CB 3.27Å; E449-A453 WeakPolarHBondContact O-CB 3.41Å; E449-A453 PolarHBondContact O-N 3.02Å
450	M	87.1	Confident	87	Confident	58 Å²	58	65 Å²	65	29%	0.286	31%	0.309	S	S	.	.	H	α-helix	trans	-64.4	-44.5	174.3	-62.6	-56.2	-64.5	0	0	111.7	F291 L293 V445 S446 L447 S448 A453 R454	F291-M450 HydrophobicContact CD1-CB 4.16Å; F291-M450 HydrophobicContact CD1-CE 4.15Å; F291-M450 HydrophobicContact CE1-CB 4.45Å; F291-M450 HydrophobicContact CG-CB 4.3Å; L293-M450 HydrophobicContact CD1-CG 3.79Å; L293-M450 HydrophobicContact CG-CG 4.44Å; V445-M450 HydrophobicContact CG1-CG 4.06Å; V445-M450 HydrophobicContact CG1-SD 3.86Å; S446-M450 PolarHBondContact O-N 3.02Å; L447-M450 WeakPolarHBondContact O-CB 3.48Å; L447-M450 PolarHBondContact O-N 2.89Å; S448-M450 VanDerWaalsContact C-N 3.35Å; M450-A453 PolarHBondContact O-N 2.83Å; M450-R454 VanDerWaalsContact O-CB 3.3Å; M450-R454 WeakPolarHBondContact O-CB 3.46Å; M450-R454 PolarHBondContact O-N 3.31Å
451	Q	90	Very high	87.2	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-45.9	176.1	-71.6	169.6	-32.7	0	0	111.6	L447 S448 R454 E455 V567 N568 I570	L447-Q451 WeakPolarHBondContact O-CG 3.3Å; L447-Q451 PolarHBondContact O-N 3.09Å; S448-Q451 PolarHBondContact O-N 3.4Å; Q451-R454 WeakPolarHBondContact O-CB 3.46Å; Q451-R454 PolarHBondContact O-N 3.49Å; Q451-E455 PolarHBondContact O-N 3.04Å; Q451-V567 PolarHBondContact NE2-O 2.95Å; Q451-N568 PolarHBondContact NE2-O 3.41Å; Q451-I570 HydrophobicContact CB-CB 4.39Å; Q451-I570 HydrophobicContact CB-CG2 3.77Å
452	I	90.2	Very high	87.3	Confident	49 Å²	49	62.7 Å²	62.7	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-43.9	176.7	-66.7	164.6	0	0	0	111.2	S448 E449 R454 E455 R456 I570 Y571	S448-I452 WeakPolarHBondContact O-CD1 3.33Å; S448-I452 WeakPolarHBondContact O-CG1 3.37Å; S448-I452 PolarHBondContact O-N 2.7Å; E449-I452 PolarHBondContact O-N 2.94Å; I452-R454 VanDerWaalsContact C-N 3.27Å; I452-R454 PolarHBondContact O-N 3.21Å; I452-E455 PolarHBondContact O-N 3.46Å; I452-R456 WeakPolarHBondContact O-CG 3.37Å; I452-R456 PolarHBondContact O-N 2.72Å; I452-R456 VanDerWaalsContact O-N 3.12Å; I452-I570 HydrophobicContact CD1-CG1 4.33Å; I452-I570 HydrophobicContact CG1-CG1 4.42Å; I452-I570 HydrophobicContact CG1-CG2 3.77Å; I452-Y571 HydrophobicContact CG1-CE1 4.46Å
453	A	88.3	Confident	87.5	Confident	46 Å²	46	67.5 Å²	67.5	38%	0.38	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-38.8	178.4	0	0	0	0	0	111.3	E449 M450 R456 L457	E449-A453 VanDerWaalsContact O-CB 3.27Å; E449-A453 WeakPolarHBondContact O-CB 3.41Å; E449-A453 PolarHBondContact O-N 3.02Å; M450-A453 PolarHBondContact O-N 2.83Å; A453-R456 WeakPolarHBondContact O-CB 3.29Å; A453-R456 PolarHBondContact O-N 2.9Å; A453-L457 PolarHBondContact O-N 3.39Å
454	R	87	Confident	87.6	Confident	65 Å²	65	71.6 Å²	71.6	25%	0.245	36%	0.356	C	S	.	.	H	α-helix	trans	-64.1	-46.1	175.2	-173.2	178.6	-172.6	129.4	22.1	112.2	M450 Q451 I452 R456 L457 I458 D468	M450-R454 VanDerWaalsContact O-CB 3.3Å; M450-R454 WeakPolarHBondContact O-CB 3.46Å; M450-R454 PolarHBondContact O-N 3.31Å; Q451-R454 WeakPolarHBondContact O-CB 3.46Å; Q451-R454 PolarHBondContact O-N 3.49Å; I452-R454 VanDerWaalsContact C-N 3.27Å; I452-R454 PolarHBondContact O-N 3.21Å; R454-R456 PolarHBondContact O-N 3.23Å; R454-L457 WeakPolarHBondContact O-CB 3.32Å; R454-L457 PolarHBondContact O-N 3.45Å; R454-I458 HydrophobicContact CG-CD1 4.08Å; R454-I458 WeakPolarHBondContact O-CG1 3.21Å; R454-I458 PolarHBondContact O-N 3.12Å; R454-D468 VanDerWaalsContact CZ-CB 3.45Å; R454-D468 IonicContact CZ-OD1 2.64Å; R454-D468 IonicContact CZ-OD2 2.86Å; R454-D468 VanDerWaalsContact NH1-CG 3.29Å; R454-D468 IonicContact NH1-OD2 2.65Å; R454-D468 PolarHBondContact NH1-OD2 3.46Å; R454-D468 IonicContact NH2-OD1 3.27Å; R454-D468 PolarHBondContact NH2-OD1 3.11Å; R454-D468 IonicContact NH2-OD2 3.93Å; R454-D468 PolarHBondContact NH2-OD2 3.31Å
455	E	89.6	Confident	87.3	Confident	42 Å²	42	72 Å²	72	20%	0.196	36%	0.36	C	S	.	.	H	α-helix	trans	-56.8	-41.9	175.9	-167.6	78.4	-175.2	0	0	111.4	Q451 I452 L457 I458 Q459 H569 Y571	Q451-E455 PolarHBondContact O-N 3.04Å; I452-E455 PolarHBondContact O-N 3.46Å; E455-L457 VanDerWaalsContact C-N 3.27Å; E455-L457 PolarHBondContact O-N 2.96Å; E455-I458 PolarHBondContact O-N 3.25Å; E455-I458 VanDerWaalsContact O-N 3.17Å; E455-Q459 HydrophobicContact CG-CG 4.4Å; E455-Q459 WeakPolarHBondContact O-CG 3.31Å; E455-Q459 PolarHBondContact O-N 3.2Å; E455-H569 IonicContact OE2-CE1 3.47Å; E455-H569 IonicContact OE2-NE2 3.18Å; E455-Y571 HydrophobicContact CB-CE2 3.81Å; E455-Y571 HydrophobicContact CG-CE2 3.59Å
456	R	90.1	Very high	86.8	Confident	158 Å²	158	79.2 Å²	79.2	60%	0.596	39%	0.389	S	S	*	.	H	α-helix	trans	-60.9	-38.8	177.6	-69.3	173.5	-175.3	-176.9	-0.1	111.7	I452 A453 R454 Q459 M460	I452-R456 WeakPolarHBondContact O-CG 3.37Å; I452-R456 PolarHBondContact O-N 2.72Å; I452-R456 VanDerWaalsContact O-N 3.12Å; A453-R456 WeakPolarHBondContact O-CB 3.29Å; A453-R456 PolarHBondContact O-N 2.9Å; R454-R456 PolarHBondContact O-N 3.23Å; R456-Q459 PolarHBondContact O-N 3.05Å; R456-M460 WeakPolarHBondContact O-CB 3.36Å; R456-M460 VanDerWaalsContact O-CG 3.22Å; R456-M460 WeakPolarHBondContact O-CG 3.33Å; R456-M460 PolarHBondContact O-N 3.48Å
457	L	88.9	Confident	85.9	Confident	74 Å²	74	84 Å²	84	39%	0.387	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-40.5	175.3	-68	174.6	0	0	0	111.9	A453 R454 E455 M460 Y461	A453-L457 PolarHBondContact O-N 3.39Å; R454-L457 WeakPolarHBondContact O-CB 3.32Å; R454-L457 PolarHBondContact O-N 3.45Å; E455-L457 VanDerWaalsContact C-N 3.27Å; E455-L457 PolarHBondContact O-N 2.96Å; L457-M460 PolarHBondContact O-N 3.39Å; L457-Y461 HydrophobicContact CD2-CD2 4.44Å; L457-Y461 HydrophobicContact CD2-CE2 4.25Å; L457-Y461 WeakPolarHBondContact O-CD2 3.43Å; L457-Y461 PolarHBondContact O-N 2.94Å
458	I	88.2	Confident	84.9	Confident	21 Å²	21	88.2 Å²	88.2	11%	0.108	44%	0.436	C	S	.	.	H	α-helix	trans	-62.4	-44.5	175.6	-64.7	162.6	0	0	0	110.3	R454 E455 M460 Y461 P462 H465	R454-I458 HydrophobicContact CG-CD1 4.08Å; R454-I458 WeakPolarHBondContact O-CG1 3.21Å; R454-I458 PolarHBondContact O-N 3.12Å; E455-I458 PolarHBondContact O-N 3.25Å; E455-I458 VanDerWaalsContact O-N 3.17Å; I458-M460 VanDerWaalsContact C-N 3.32Å; I458-M460 PolarHBondContact O-N 2.86Å; I458-Y461 CarbonylContact O-C 3.42Å; I458-Y461 PolarHBondContact O-N 3.29Å; I458-P462 WeakPolarHBondContact O-CA 3.11Å; I458-P462 WeakPolarHBondContact O-CD 3.36Å; I458-H465 HydrophobicContact CB-CB 4.42Å; I458-H465 HydrophobicContact CG1-CB 3.7Å
459	Q	88.3	Confident	84	Confident	132 Å²	132	89.4 Å²	89.4	62%	0.617	44%	0.442	S	S	*	.	H	α-helix	trans	-63.9	-35.6	176.1	-71.2	175.7	3.7	0	0	112.9	E455 R456	E455-Q459 HydrophobicContact CG-CG 4.4Å; E455-Q459 WeakPolarHBondContact O-CG 3.31Å; E455-Q459 PolarHBondContact O-N 3.2Å; R456-Q459 PolarHBondContact O-N 3.05Å
460	M	89.9	Confident	82.9	Confident	132 Å²	132	91.6 Å²	91.6	65%	0.65	45%	0.453	S	S	*	.	H	α-helix	trans	-75.3	-34	176.6	-72.8	178.5	116.9	0	0	112.7	R456 L457 I458	R456-M460 WeakPolarHBondContact O-CB 3.36Å; R456-M460 VanDerWaalsContact O-CG 3.22Å; R456-M460 WeakPolarHBondContact O-CG 3.33Å; R456-M460 PolarHBondContact O-N 3.48Å; L457-M460 PolarHBondContact O-N 3.39Å; I458-M460 VanDerWaalsContact C-N 3.32Å; I458-M460 PolarHBondContact O-N 2.86Å
461	Y	89.3	Confident	81.8	Confident	121 Å²	121	93.3 Å²	93.3	48%	0.475	47%	0.47	S	S	.	.			trans	-136.9	62.6	-171.3	-51.7	-65.4	0	0	0	112.2	L457 I458 M463 T464 H465	L457-Y461 HydrophobicContact CD2-CD2 4.44Å; L457-Y461 HydrophobicContact CD2-CE2 4.25Å; L457-Y461 WeakPolarHBondContact O-CD2 3.43Å; L457-Y461 PolarHBondContact O-N 2.94Å; I458-Y461 CarbonylContact O-C 3.42Å; I458-Y461 PolarHBondContact O-N 3.29Å; Y461-M463 PolarHBondContact O-N 3.07Å; Y461-M463 VanDerWaalsContact O-N 3.14Å; Y461-T464 PolarHBondContact O-N 3.02Å; Y461-T464 VanDerWaalsContact O-N 3.08Å; Y461-H465 PolarHBondContact O-N 3.24Å; Y461-H465 VanDerWaalsContact O-N 3.09Å
462	P	84.1	Confident	80.8	Confident	89 Å²	89	98.4 Å²	98.4	58%	0.578	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.2	-170.8	24	-34.6	0	0	0	113.9	I458	I458-P462 WeakPolarHBondContact O-CA 3.11Å; I458-P462 WeakPolarHBondContact O-CD 3.36Å
463	M	85.4	Confident	80.5	Confident	184 Å²	184	96.6 Å²	96.6	91%	0.906	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-17.8	179.4	-59.6	-58	-69.1	0	0	113.3	Y461	Y461-M463 PolarHBondContact O-N 3.07Å; Y461-M463 VanDerWaalsContact O-N 3.14Å
464	T	85	Confident	80.4	Confident	115 Å²	115	96.5 Å²	96.5	71%	0.706	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-34.4	-174.3	-49.3	0	0	0	0	112.1	Y461	Y461-T464 PolarHBondContact O-N 3.02Å; Y461-T464 VanDerWaalsContact O-N 3.08Å
465	H	77.4	Confident	80.4	Confident	64 Å²	64	94 Å²	94	30%	0.296	48%	0.479	S	S	.	.			trans	-103	126.5	178.4	-71.1	-90.5	0	0	0	110.2	I458 Y461	I458-H465 HydrophobicContact CB-CB 4.42Å; I458-H465 HydrophobicContact CG1-CB 3.7Å; Y461-H465 PolarHBondContact O-N 3.24Å; Y461-H465 VanDerWaalsContact O-N 3.09Å
466	K	73	Confident	80.4	Confident	176 Å²	176	93 Å²	93	77%	0.765	48%	0.475	S	S	*	.			trans	-94.5	157.7	171	-65.7	-174.4	178.5	-176.8	0	110.5	D468	K466-D468 PolarHBondContact O-N 3.34Å
467	D	69.5	Low	80.2	Confident	110 Å²	110	87.8 Å²	87.8	59%	0.588	46%	0.455	S	S	*	.			trans	-65.7	115.7	166.2	-68.1	-28.6	0	0	0	108.8	V469	D467-V469 PolarHBondContact O-N 3.38Å
468	D	65.5	Low	80.2	Confident	100 Å²	100	84.8 Å²	84.8	54%	0.535	44%	0.439	S	S	.	.			trans	-85.6	8.8	175.1	-88.2	33.4	0	0	0	112.2	R454 K466 E470	R454-D468 VanDerWaalsContact CZ-CB 3.45Å; R454-D468 IonicContact CZ-OD1 2.64Å; R454-D468 IonicContact CZ-OD2 2.86Å; R454-D468 VanDerWaalsContact NH1-CG 3.29Å; R454-D468 IonicContact NH1-OD2 2.65Å; R454-D468 PolarHBondContact NH1-OD2 3.46Å; R454-D468 IonicContact NH2-OD1 3.27Å; R454-D468 PolarHBondContact NH2-OD1 3.11Å; R454-D468 IonicContact NH2-OD2 3.93Å; R454-D468 PolarHBondContact NH2-OD2 3.31Å; K466-D468 PolarHBondContact O-N 3.34Å; D468-E470 PolarHBondContact O-N 3.25Å
469	V	68.2	Low	80.3	Confident	47 Å²	47	84.8 Å²	84.8	29%	0.285	44%	0.438	S	S	.	.			trans	-66.2	109.2	173.2	-175.8	0	0	0	0	106.3	D467 S471 E476	D467-V469 PolarHBondContact O-N 3.38Å; V469-S471 PolarHBondContact O-N 3.45Å; V469-E476 HydrophobicContact CG1-CG 4.39Å; V469-E476 WeakPolarHBondContact CG1-OE2 3.44Å
470	E	66.2	Low	80.4	Confident	131 Å²	131	83.3 Å²	83.3	61%	0.612	43%	0.431	S	S	*	.			trans	-54.1	102.9	172.9	-72	168.6	-178.1	0	0	108.1	D468 D472 G473	D468-E470 PolarHBondContact O-N 3.25Å; E470-D472 PolarHBondContact O-N 3.42Å; E470-G473 PolarHBondContact O-N 3.47Å
471	S	63.3	Low	80.1	Confident	93 Å²	93	79.2 Å²	79.2	65%	0.65	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.3	-176.8	52.9	0	0	0	0	112.7	V469	V469-S471 PolarHBondContact O-N 3.45Å
472	D	69	Low	80	Confident	117 Å²	117	73.7 Å²	73.7	63%	0.626	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	2.2	-174.5	-155.4	11.5	0	0	0	114.1	E470 R477	E470-D472 PolarHBondContact O-N 3.42Å; D472-R477 PolarHBondContact O-NE 2.81Å; D472-R477 VanDerWaalsContact O-NE 3.1Å; D472-R477 PolarHBondContact O-NH2 3.18Å; D472-R477 IonicContact OD1-CZ 3.39Å; D472-R477 IonicContact OD1-NE 3.75Å; D472-R477 PolarHBondContact OD1-NE 3.1Å; D472-R477 IonicContact OD1-NH2 2.73Å
473	G	83.5	Confident	80.3	Confident	11 Å²	11	73.2 Å²	73.2	11%	0.113	38%	0.382	C	S	.	.	S	Bend	trans	-66.9	144.1	177.7	0	0	0	0	0	112	E470 S475 E476 R477	E470-G473 PolarHBondContact O-N 3.47Å; G473-S475 PolarHBondContact O-N 3.48Å; G473-S475 VanDerWaalsContact O-N 3.14Å; G473-E476 WeakPolarHBondContact O-CB 3.47Å; G473-E476 PolarHBondContact O-N 3.09Å; G473-R477 PolarHBondContact O-N 2.96Å
474	P	86.3	Confident	80.3	Confident	45 Å²	45	69.6 Å²	69.6	29%	0.292	37%	0.372	S	S	.	.	H	α-helix	trans	-60.1	-30.6	-179.8	23	-34	0	0	0	112.4	V273 L478	V273-P474 HydrophobicContact CG1-CB 3.93Å; P474-L478 WeakPolarHBondContact O-CB 3.31Å; P474-L478 PolarHBondContact O-N 3.42Å
475	S	87.5	Confident	80.3	Confident	11 Å²	11	66.7 Å²	66.7	8%	0.077	35%	0.352	C	S	.	.	H	α-helix	trans	-69.1	-32.1	174.8	-61	0	0	0	0	113.3	G473 Y479 H564	G473-S475 PolarHBondContact O-N 3.48Å; G473-S475 VanDerWaalsContact O-N 3.14Å; S475-Y479 WeakPolarHBondContact O-CB 3.29Å; S475-Y479 PolarHBondContact O-N 3.32Å; S475-Y479 VanDerWaalsContact O-N 3.1Å; S475-H564 PolarHBondContact OG-ND1 3.35Å
476	E	89.3	Confident	80.9	Confident	23 Å²	23	64.2 Å²	64.2	11%	0.107	34%	0.341	C	S	.	.	H	α-helix	trans	-76.8	-44.3	177.7	-172.5	60.5	-150.9	0	0	110.5	V469 G473 L478 Y479 Q480 N568 Q572	V469-E476 HydrophobicContact CG1-CG 4.39Å; V469-E476 WeakPolarHBondContact CG1-OE2 3.44Å; G473-E476 WeakPolarHBondContact O-CB 3.47Å; G473-E476 PolarHBondContact O-N 3.09Å; E476-L478 VanDerWaalsContact C-N 3.33Å; E476-L478 PolarHBondContact O-N 2.86Å; E476-Y479 WeakPolarHBondContact O-CA 3.48Å; E476-Y479 WeakPolarHBondContact O-CB 3.15Å; E476-Y479 PolarHBondContact O-N 3.38Å; E476-Q480 WeakPolarHBondContact O-CG 3.44Å; E476-Q480 PolarHBondContact O-N 3.34Å; E476-N568 PolarHBondContact OE2-ND2 3.08Å; E476-Q572 PolarHBondContact OE1-NE2 3.14Å; E476-Q572 PolarHBondContact OE2-NE2 3.28Å
477	R	87.2	Confident	81.7	Confident	48 Å²	48	64.2 Å²	64.2	18%	0.181	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-46.2	173.4	-73.9	-173	-97.4	147.5	2.8	111.5	D230 D472 G473 Y479 Q480 M481	D230-R477 VanDerWaalsContact CG-CZ 3.48Å; D230-R477 PolarHBondContact O-NH1 2.88Å; D230-R477 IonicContact OD1-CZ 3.91Å; D230-R477 IonicContact OD1-NH1 3.15Å; D230-R477 PolarHBondContact OD1-NH1 3.24Å; D230-R477 VanDerWaalsContact OD1-NH1 3.13Å; D230-R477 IonicContact OD1-NH2 3.8Å; D230-R477 IonicContact OD2-CZ 3.3Å; D230-R477 IonicContact OD2-NH1 2.68Å; D230-R477 PolarHBondContact OD2-NH1 3.3Å; D230-R477 IonicContact OD2-NH2 3.06Å; D230-R477 PolarHBondContact OD2-NH2 3.44Å; D472-R477 PolarHBondContact O-NE 2.81Å; D472-R477 VanDerWaalsContact O-NE 3.1Å; D472-R477 PolarHBondContact O-NH2 3.18Å; D472-R477 IonicContact OD1-CZ 3.39Å; D472-R477 IonicContact OD1-NE 3.75Å; D472-R477 PolarHBondContact OD1-NE 3.1Å; D472-R477 IonicContact OD1-NH2 2.73Å; G473-R477 PolarHBondContact O-N 2.96Å; R477-Y479 VanDerWaalsContact C-N 3.31Å; R477-Y479 PolarHBondContact O-N 3.16Å; R477-Q480 PolarHBondContact O-N 2.95Å; R477-M481 VanDerWaalsContact O-CG 3.23Å; R477-M481 WeakPolarHBondContact O-CG 3.43Å; R477-M481 PolarHBondContact O-N 3.47Å
478	L	88.8	Confident	82.6	Confident	10 Å²	10	65.5 Å²	65.5	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-58.8	-42	172.7	179.7	65.1	0	0	0	112.5	F243 L270 L274 P474 E476 Q480 M481 I482	F243-L478 HydrophobicContact CE2-CD1 3.84Å; F243-L478 HydrophobicContact CZ-CD1 4.19Å; L270-L478 HydrophobicContact CD2-CD1 3.58Å; L270-L478 HydrophobicContact CD2-CD2 3.8Å; L270-L478 HydrophobicContact CD2-CG 4.37Å; L274-L478 HydrophobicContact CD1-CD2 3.62Å; L274-L478 HydrophobicContact CD2-CD2 3.94Å; L274-L478 HydrophobicContact CG-CD2 4.13Å; P474-L478 WeakPolarHBondContact O-CB 3.31Å; P474-L478 PolarHBondContact O-N 3.42Å; E476-L478 VanDerWaalsContact C-N 3.33Å; E476-L478 PolarHBondContact O-N 2.86Å; L478-Q480 VanDerWaalsContact C-N 3.34Å; L478-M481 PolarHBondContact O-N 2.67Å; L478-I482 HydrophobicContact CD1-CD1 3.78Å; L478-I482 HydrophobicContact CD1-CG1 4.13Å; L478-I482 HydrophobicContact CD2-CD1 4.32Å; L478-I482 HydrophobicContact CG-CD1 3.77Å; L478-I482 HydrophobicContact CG-CG1 4.42Å; L478-I482 WeakPolarHBondContact O-CG1 3.41Å; L478-I482 PolarHBondContact O-N 2.78Å
479	Y	90.3	Very high	83.7	Confident	21 Å²	21	61 Å²	61	8%	0.082	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-43.7	177.8	-177.3	-108.9	0	0	0	111.5	S475 E476 R477 M481 I482 L483 L565 Q572 Q575	S475-Y479 WeakPolarHBondContact O-CB 3.29Å; S475-Y479 PolarHBondContact O-N 3.32Å; S475-Y479 VanDerWaalsContact O-N 3.1Å; E476-Y479 WeakPolarHBondContact O-CA 3.48Å; E476-Y479 WeakPolarHBondContact O-CB 3.15Å; E476-Y479 PolarHBondContact O-N 3.38Å; R477-Y479 VanDerWaalsContact C-N 3.31Å; R477-Y479 PolarHBondContact O-N 3.16Å; Y479-M481 VanDerWaalsContact C-N 3.34Å; Y479-M481 PolarHBondContact O-N 3.19Å; Y479-I482 PolarHBondContact O-N 3.28Å; Y479-L483 HydrophobicContact CE1-CD1 4.31Å; Y479-L483 VanDerWaalsContact O-CB 3.3Å; Y479-L483 WeakPolarHBondContact O-CB 3.36Å; Y479-L483 PolarHBondContact O-N 2.97Å; Y479-L565 HydrophobicContact CD2-CD1 4.06Å; Y479-L565 HydrophobicContact CD2-CD2 3.78Å; Y479-L565 HydrophobicContact CG-CD2 4.13Å; Y479-Q572 HydrophobicContact CD1-CG 3.94Å; Y479-Q572 HydrophobicContact CD2-CB 4Å; Y479-Q572 HydrophobicContact CD2-CG 4.13Å; Y479-Q572 HydrophobicContact CE1-CB 4.45Å; Y479-Q572 HydrophobicContact CE1-CG 3.68Å; Y479-Q572 HydrophobicContact CE2-CB 3.71Å; Y479-Q572 HydrophobicContact CE2-CG 3.88Å; Y479-Q572 HydrophobicContact CG-CB 4.47Å; Y479-Q572 HydrophobicContact CG-CG 4.15Å; Y479-Q575 PolarHBondContact OH-OE1 3.38Å
480	Q	88.9	Confident	84.7	Confident	101 Å²	101	59 Å²	59	47%	0.472	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-40	176.1	-68	173.6	11.9	0	0	112	E476 R477 L478 P484	E476-Q480 WeakPolarHBondContact O-CG 3.44Å; E476-Q480 PolarHBondContact O-N 3.34Å; R477-Q480 PolarHBondContact O-N 2.95Å; L478-Q480 VanDerWaalsContact C-N 3.34Å; Q480-P484 VanDerWaalsContact O-CD 3.3Å; Q480-P484 WeakPolarHBondContact O-CD 3.25Å
481	M	85.3	Confident	85.8	Confident	47 Å²	47	57.2 Å²	57.2	23%	0.232	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-40.4	176	-64.2	157.3	83.3	0	0	112.2	A232 V239 P240 R477 L478 Y479	A232-M481 HydrophobicContact CB-CG 4.43Å; A232-M481 HydrophobicContact CB-SD 4.33Å; V239-M481 HydrophobicContact CB-CE 3.87Å; V239-M481 HydrophobicContact CG1-CE 3.77Å; P240-M481 HydrophobicContact CG-CE 3.35Å; R477-M481 VanDerWaalsContact O-CG 3.23Å; R477-M481 WeakPolarHBondContact O-CG 3.43Å; R477-M481 PolarHBondContact O-N 3.47Å; L478-M481 PolarHBondContact O-N 2.67Å; Y479-M481 VanDerWaalsContact C-N 3.34Å; Y479-M481 PolarHBondContact O-N 3.19Å
482	I	87	Confident	87	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-75.4	-33.3	-179.5	-68.8	172.8	0	0	0	111.5	F243 L478 Y479 N485 M486 L489 I561	F243-I482 HydrophobicContact CE2-CD1 4.35Å; F243-I482 HydrophobicContact CE2-CG1 4Å; F243-I482 HydrophobicContact CZ-CD1 3.94Å; F243-I482 HydrophobicContact CZ-CG1 3.97Å; L478-I482 HydrophobicContact CD1-CD1 3.78Å; L478-I482 HydrophobicContact CD1-CG1 4.13Å; L478-I482 HydrophobicContact CD2-CD1 4.32Å; L478-I482 HydrophobicContact CG-CD1 3.77Å; L478-I482 HydrophobicContact CG-CG1 4.42Å; L478-I482 WeakPolarHBondContact O-CG1 3.41Å; L478-I482 PolarHBondContact O-N 2.78Å; Y479-I482 PolarHBondContact O-N 3.28Å; I482-N485 CarbonylContact O-C 3.49Å; I482-N485 PolarHBondContact O-N 2.85Å; I482-N485 VanDerWaalsContact O-N 3.1Å; I482-M486 HydrophobicContact CG2-CB 3.92Å; I482-M486 HydrophobicContact CG2-CG 4.07Å; I482-M486 VanDerWaalsContact O-CA 3.27Å; I482-M486 WeakPolarHBondContact O-CA 3.27Å; I482-M486 WeakPolarHBondContact O-CB 3.34Å; I482-M486 PolarHBondContact O-N 2.92Å; I482-L489 HydrophobicContact CB-CD2 4.49Å; I482-L489 HydrophobicContact CD1-CD2 4.28Å; I482-L489 HydrophobicContact CG1-CD2 4.06Å; I482-L489 HydrophobicContact CG2-CD2 3.77Å; I482-I561 HydrophobicContact CD1-CD1 4.25Å
483	L	88.8	Confident	88	Confident	79 Å²	79	47.4 Å²	47.4	41%	0.414	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-50.4	-48.3	-167.7	-177.7	64.8	0	0	0	114.7	Y479 N485 M486	Y479-L483 HydrophobicContact CE1-CD1 4.31Å; Y479-L483 VanDerWaalsContact O-CB 3.3Å; Y479-L483 WeakPolarHBondContact O-CB 3.36Å; Y479-L483 PolarHBondContact O-N 2.97Å; L483-N485 VanDerWaalsContact C-N 3.29Å; L483-N485 PolarHBondContact O-N 3.43Å; L483-M486 PolarHBondContact O-N 2.94Å
484	P	87.1	Confident	88.4	Confident	107 Å²	107	47.3 Å²	47.3	70%	0.695	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-61.7	-35.7	-178.1	-22.2	33.5	0	0	0	113.3	Q480	Q480-P484 VanDerWaalsContact O-CD 3.3Å; Q480-P484 WeakPolarHBondContact O-CD 3.25Å
485	N	85	Confident	88.4	Confident	54 Å²	54	49 Å²	49	29%	0.289	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-110.6	11.4	-176.3	-75	-39.2	0	0	0	113	I482 L483 R487 K488 L489	I482-N485 CarbonylContact O-C 3.49Å; I482-N485 PolarHBondContact O-N 2.85Å; I482-N485 VanDerWaalsContact O-N 3.1Å; L483-N485 VanDerWaalsContact C-N 3.29Å; L483-N485 PolarHBondContact O-N 3.43Å; N485-R487 VanDerWaalsContact C-N 3.32Å; N485-R487 PolarHBondContact O-N 3.3Å; N485-R487 VanDerWaalsContact O-N 3.16Å; N485-K488 WeakPolarHBondContact O-CA 3.23Å; N485-K488 WeakPolarHBondContact O-CB 3.43Å; N485-K488 PolarHBondContact O-N 2.88Å; N485-L489 WeakPolarHBondContact O-CB 3.42Å; N485-L489 PolarHBondContact O-N 3.01Å
486	M	89.3	Confident	88.5	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.059	23%	0.227	C	C	.	.	H	α-helix	trans	-54.5	-44.2	-170	178.7	-164.6	55	0	0	112.8	I482 L483 T490 Q575 I576 Q579	I482-M486 HydrophobicContact CG2-CB 3.92Å; I482-M486 HydrophobicContact CG2-CG 4.07Å; I482-M486 VanDerWaalsContact O-CA 3.27Å; I482-M486 WeakPolarHBondContact O-CA 3.27Å; I482-M486 WeakPolarHBondContact O-CB 3.34Å; I482-M486 PolarHBondContact O-N 2.92Å; L483-M486 PolarHBondContact O-N 2.94Å; M486-T490 VanDerWaalsContact O-CB 3.25Å; M486-T490 WeakPolarHBondContact O-CB 3.05Å; M486-T490 PolarHBondContact O-N 2.96Å; M486-T490 PolarHBondContact O-OG1 2.97Å; M486-Q575 HydrophobicContact CE-CG 3.64Å; M486-Q575 VanDerWaalsContact CE-NE2 3.31Å; M486-Q575 HydrophobicContact SD-CG 3.73Å; M486-I576 HydrophobicContact CG-CD1 4.36Å; M486-I576 HydrophobicContact CG-CG1 4.04Å; M486-I576 HydrophobicContact SD-CG1 3.72Å; M486-Q579 HydrophobicContact CE-CG 3.73Å; M486-Q579 HydrophobicContact SD-CG 4.31Å
487	R	90.3	Very high	88.4	Confident	176 Å²	176	47.3 Å²	47.3	66%	0.664	22%	0.222	S	C	*	.	H	α-helix	trans	-63.8	-47.1	177	-177.6	-178.4	-67	171.7	3.9	111.3	N485 T490 F491	N485-R487 VanDerWaalsContact C-N 3.32Å; N485-R487 PolarHBondContact O-N 3.3Å; N485-R487 VanDerWaalsContact O-N 3.16Å; R487-T490 PolarHBondContact O-N 3.35Å; R487-F491 VanDerWaalsContact O-CB 3.28Å; R487-F491 WeakPolarHBondContact O-CB 3.45Å; R487-F491 PolarHBondContact O-N 3.3Å
488	K	88.7	Confident	88.4	Confident	137 Å²	137	47.7 Å²	47.7	60%	0.596	23%	0.227	S	C	*	.	H	α-helix	trans	-62.9	-46.9	-179.6	-63.6	179.3	-174.8	168.2	0	110.8	N485 F491 G492	N485-K488 WeakPolarHBondContact O-CA 3.23Å; N485-K488 WeakPolarHBondContact O-CB 3.43Å; N485-K488 PolarHBondContact O-N 2.88Å; K488-F491 PolarHBondContact O-N 3.01Å; K488-G492 PolarHBondContact O-N 3.26Å
489	L	87.6	Confident	88.1	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-58.8	-51.2	176.9	178.5	67.6	0	0	0	111.3	F243 L246 I482 N485 F491 G492 L493	F243-L489 HydrophobicContact CD1-CD1 3.41Å; F243-L489 VanDerWaalsContact CD1-CD1 3.41Å; F243-L489 HydrophobicContact CD1-CD2 3.76Å; F243-L489 HydrophobicContact CD1-CG 4.22Å; F243-L489 HydrophobicContact CE1-CD1 3.8Å; F243-L489 HydrophobicContact CE1-CD2 3.56Å; F243-L489 HydrophobicContact CE1-CG 4.31Å; F243-L489 HydrophobicContact CG-CD1 4.5Å; F243-L489 HydrophobicContact CZ-CD2 4.35Å; L246-L489 HydrophobicContact CD2-CD1 3.47Å; L246-L489 VanDerWaalsContact CD2-CD1 3.47Å; L246-L489 HydrophobicContact CG-CD1 4.25Å; I482-L489 HydrophobicContact CB-CD2 4.49Å; I482-L489 HydrophobicContact CD1-CD2 4.28Å; I482-L489 HydrophobicContact CG1-CD2 4.06Å; I482-L489 HydrophobicContact CG2-CD2 3.77Å; N485-L489 WeakPolarHBondContact O-CB 3.42Å; N485-L489 PolarHBondContact O-N 3.01Å; L489-F491 PolarHBondContact O-N 3.42Å; L489-G492 PolarHBondContact O-N 3.26Å; L489-L493 HydrophobicContact CD1-CD1 4.22Å; L489-L493 HydrophobicContact CD1-CG 4.35Å; L489-L493 HydrophobicContact CG-CD1 4.13Å; L489-L493 WeakPolarHBondContact O-CB 3.31Å; L489-L493 WeakPolarHBondContact O-CG 3.43Å; L489-L493 PolarHBondContact O-N 3.32Å
490	T	90	Very high	87.8	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-47.8	-177.8	-56.6	0	0	0	0	110.8	M486 R487 G492 L493 V494 Q579 L580	M486-T490 VanDerWaalsContact O-CB 3.25Å; M486-T490 WeakPolarHBondContact O-CB 3.05Å; M486-T490 PolarHBondContact O-N 2.96Å; M486-T490 PolarHBondContact O-OG1 2.97Å; R487-T490 PolarHBondContact O-N 3.35Å; T490-G492 VanDerWaalsContact C-N 3.33Å; T490-G492 PolarHBondContact O-N 3.25Å; T490-L493 PolarHBondContact O-N 3.38Å; T490-V494 VanDerWaalsContact O-CG2 3.23Å; T490-V494 WeakPolarHBondContact O-CG2 3.3Å; T490-V494 PolarHBondContact O-N 3.22Å; T490-V494 VanDerWaalsContact O-N 3.08Å; T490-Q579 HydrophobicContact CG2-CB 3.89Å; T490-L580 HydrophobicContact CG2-CB 4.2Å; T490-L580 HydrophobicContact CG2-CD2 3.35Å; T490-L580 HydrophobicContact CG2-CG 3.48Å; T490-L580 VanDerWaalsContact CG2-CG 3.48Å
491	F	88.6	Confident	87.4	Confident	94 Å²	94	42 Å²	42	41%	0.412	20%	0.203	S	C	.	.	H	α-helix	trans	-65	-38.6	178.5	-159.4	-101.3	0	0	0	111.9	R487 K488 L489 V494 K495 A583	R487-F491 VanDerWaalsContact O-CB 3.28Å; R487-F491 WeakPolarHBondContact O-CB 3.45Å; R487-F491 PolarHBondContact O-N 3.3Å; K488-F491 PolarHBondContact O-N 3.01Å; L489-F491 PolarHBondContact O-N 3.42Å; F491-V494 PolarHBondContact O-N 2.87Å; F491-K495 HydrophobicContact CD1-CD 3.96Å; F491-K495 HydrophobicContact CD1-CG 4.28Å; F491-K495 HydrophobicContact CE1-CD 3.98Å; F491-K495 HydrophobicContact CE1-CG 4.32Å; F491-K495 WeakPolarHBondContact O-CB 3.39Å; F491-K495 WeakPolarHBondContact O-CG 3.46Å; F491-K495 PolarHBondContact O-N 2.94Å; F491-A583 HydrophobicContact CD2-CB 3.55Å; F491-A583 HydrophobicContact CE2-CB 4.18Å; F491-A583 HydrophobicContact CG-CB 4.42Å
492	G	88	Confident	86.7	Confident	2 Å²	2	42.4 Å²	42.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-50.3	175	0	0	0	0	0	112.8	C250 K488 L489 T490 V494 K495 V496	C250-G492 VanDerWaalsContact SG-C 3.52Å; C250-G492 WeakPolarHBondContact SG-CA 3.42Å; K488-G492 PolarHBondContact O-N 3.26Å; L489-G492 PolarHBondContact O-N 3.26Å; T490-G492 VanDerWaalsContact C-N 3.33Å; T490-G492 PolarHBondContact O-N 3.25Å; G492-V494 VanDerWaalsContact C-N 3.28Å; G492-V494 PolarHBondContact O-N 3.35Å; G492-K495 WeakPolarHBondContact O-CB 3.2Å; G492-K495 PolarHBondContact O-N 3.3Å; G492-K495 VanDerWaalsContact O-N 3.11Å; G492-V496 WeakPolarHBondContact O-CG2 3.14Å; G492-V496 PolarHBondContact O-N 3.35Å
493	L	91.7	Very high	85.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-40.5	175.4	-72.7	173.3	0	0	0	111.8	L246 L263 L489 T490 V496 L497 V554 M557 L558	L246-L493 HydrophobicContact CD2-CD2 3.63Å; L246-L493 HydrophobicContact CD2-CG 4.11Å; L263-L493 HydrophobicContact CD2-CD2 4.05Å; L489-L493 HydrophobicContact CD1-CD1 4.22Å; L489-L493 HydrophobicContact CD1-CG 4.35Å; L489-L493 HydrophobicContact CG-CD1 4.13Å; L489-L493 WeakPolarHBondContact O-CB 3.31Å; L489-L493 WeakPolarHBondContact O-CG 3.43Å; L489-L493 PolarHBondContact O-N 3.32Å; T490-L493 PolarHBondContact O-N 3.38Å; L493-V496 PolarHBondContact O-N 3Å; L493-L497 WeakPolarHBondContact O-CB 3.27Å; L493-L497 PolarHBondContact O-N 2.93Å; L493-V554 HydrophobicContact CB-CG1 4.1Å; L493-V554 HydrophobicContact CD2-CG1 4.16Å; L493-V554 HydrophobicContact CD2-CG2 4.13Å; L493-M557 HydrophobicContact CD2-CE 4.43Å; L493-L558 HydrophobicContact CB-CD2 4.33Å; L493-L558 HydrophobicContact CD1-CD2 3.63Å; L493-L558 HydrophobicContact CD1-CG 4.21Å
494	V	90.9	Very high	84.4	Confident	8 Å²	8	42.7 Å²	42.7	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-40.1	175.9	177.7	0	0	0	0	112	T490 F491 G492 L497 L498 L580 A583 C585 L588	T490-V494 VanDerWaalsContact O-CG2 3.23Å; T490-V494 WeakPolarHBondContact O-CG2 3.3Å; T490-V494 PolarHBondContact O-N 3.22Å; T490-V494 VanDerWaalsContact O-N 3.08Å; F491-V494 PolarHBondContact O-N 2.87Å; G492-V494 VanDerWaalsContact C-N 3.28Å; G492-V494 PolarHBondContact O-N 3.35Å; V494-L497 PolarHBondContact O-N 3.16Å; V494-L498 PolarHBondContact O-N 3.01Å; V494-L580 HydrophobicContact CG2-CD2 3.75Å; V494-A583 HydrophobicContact CB-CB 4.13Å; V494-A583 HydrophobicContact CG1-CB 4.27Å; V494-A583 WeakPolarHBondContact CG1-O 3.5Å; V494-A583 HydrophobicContact CG2-CB 3.91Å; V494-C585 HydrophobicContact CG2-CB 4.12Å; V494-L588 HydrophobicContact CG1-CD2 3.54Å; V494-L588 WeakPolarHBondContact O-CD2 3.42Å
495	K	86.5	Confident	82.7	Confident	80 Å²	80	46.6 Å²	46.6	35%	0.348	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-44.6	174.3	-84.1	-177.5	159.7	-179.2	0	112.3	F491 G492 L497 L498 A499 V511	F491-K495 HydrophobicContact CD1-CD 3.96Å; F491-K495 HydrophobicContact CD1-CG 4.28Å; F491-K495 HydrophobicContact CE1-CD 3.98Å; F491-K495 HydrophobicContact CE1-CG 4.32Å; F491-K495 WeakPolarHBondContact O-CB 3.39Å; F491-K495 WeakPolarHBondContact O-CG 3.46Å; F491-K495 PolarHBondContact O-N 2.94Å; G492-K495 WeakPolarHBondContact O-CB 3.2Å; G492-K495 PolarHBondContact O-N 3.3Å; G492-K495 VanDerWaalsContact O-N 3.11Å; K495-L497 VanDerWaalsContact C-N 3.33Å; K495-L498 WeakPolarHBondContact O-CB 3.4Å; K495-L498 PolarHBondContact O-N 3.14Å; K495-A499 PolarHBondContact O-N 3.46Å; K495-V511 HydrophobicContact CB-CG2 4.48Å
496	V	88.4	Confident	81	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-42	177	173.2	0	0	0	0	110.6	L246 F249 L263 G492 L493 L498 A499 S500 I513 I550 V554	L246-V496 HydrophobicContact CD1-CG2 4.49Å; F249-V496 HydrophobicContact CE1-CG2 4.35Å; L263-V496 HydrophobicContact CD1-CG1 3.99Å; G492-V496 WeakPolarHBondContact O-CG2 3.14Å; G492-V496 PolarHBondContact O-N 3.35Å; L493-V496 PolarHBondContact O-N 3Å; V496-L498 VanDerWaalsContact C-N 3.3Å; V496-L498 PolarHBondContact O-N 3.27Å; V496-A499 PolarHBondContact O-N 2.86Å; V496-S500 PolarHBondContact O-N 2.96Å; V496-I513 HydrophobicContact CG1-CD1 4.05Å; V496-I513 WeakPolarHBondContact O-CD1 3.48Å; V496-I550 HydrophobicContact CG1-CG2 3.36Å; V496-V554 HydrophobicContact CG1-CG2 4.13Å
497	L	89	Confident	78.9	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-33.3	174.3	-176.3	64.2	0	0	0	112.9	L493 V494 K495 S500 A501 A551 V554 L588 L621	L493-L497 WeakPolarHBondContact O-CB 3.27Å; L493-L497 PolarHBondContact O-N 2.93Å; V494-L497 PolarHBondContact O-N 3.16Å; K495-L497 VanDerWaalsContact C-N 3.33Å; L497-S500 WeakPolarHBondContact CA-OG 3.47Å; L497-S500 PolarHBondContact O-OG 2.62Å; L497-S500 VanDerWaalsContact O-OG 3.05Å; L497-A501 PolarHBondContact O-N 2.72Å; L497-A551 HydrophobicContact CD1-CB 4.27Å; L497-V554 HydrophobicContact CB-CG1 4.08Å; L497-L588 HydrophobicContact CB-CD2 4.1Å; L497-L588 HydrophobicContact CD2-CD2 3.96Å; L497-L588 HydrophobicContact CG-CD2 4.04Å; L497-L621 HydrophobicContact CD1-CD2 4.48Å; L497-L621 HydrophobicContact CD2-CD2 3.74Å
498	L	86.7	Confident	76.7	Confident	56 Å²	56	51 Å²	51	29%	0.293	28%	0.283	S	S	.	.	H	α-helix	trans	-67.8	-42.2	173.6	178	60.8	0	0	0	110.9	V494 K495 V496 S500 A501 M510 L588	V494-L498 PolarHBondContact O-N 3.01Å; K495-L498 WeakPolarHBondContact O-CB 3.4Å; K495-L498 PolarHBondContact O-N 3.14Å; V496-L498 VanDerWaalsContact C-N 3.3Å; V496-L498 PolarHBondContact O-N 3.27Å; L498-S500 VanDerWaalsContact C-N 3.32Å; L498-S500 PolarHBondContact O-N 3.01Å; L498-A501 VanDerWaalsContact O-CB 3.26Å; L498-A501 WeakPolarHBondContact O-CB 3.35Å; L498-A501 PolarHBondContact O-N 3.36Å; L498-M510 HydrophobicContact CB-CE 4.44Å; L498-M510 HydrophobicContact CB-SD 4.46Å; L498-M510 HydrophobicContact CD1-CE 4.43Å; L498-M510 HydrophobicContact CD2-CE 4.33Å; L498-M510 HydrophobicContact CD2-SD 3.62Å; L498-M510 HydrophobicContact CG-CE 3.7Å; L498-M510 HydrophobicContact CG-SD 3.66Å; L498-M510 WeakPolarHBondContact O-CE 3.36Å; L498-L588 HydrophobicContact CB-CD1 3.68Å; L498-L588 HydrophobicContact CB-CD2 4.13Å; L498-L588 HydrophobicContact CD1-CD1 3.4Å; L498-L588 VanDerWaalsContact CD1-CD1 3.4Å; L498-L588 HydrophobicContact CG-CD1 4.06Å
499	A	83	Confident	74.7	Confident	6 Å²	6	51.5 Å²	51.5	5%	0.05	29%	0.293	C	S	.	.	H	α-helix	trans	-67.5	-30.6	178	0	0	0	0	0	112.9	K495 V496 A501 S504 M510 I513	K495-A499 PolarHBondContact O-N 3.46Å; V496-A499 PolarHBondContact O-N 2.86Å; A499-A501 VanDerWaalsContact C-N 3.27Å; A499-A501 PolarHBondContact O-N 3.16Å; A499-S504 PolarHBondContact O-OG 3.44Å; A499-M510 VanDerWaalsContact CA-CE 3.4Å; A499-M510 HydrophobicContact CB-CE 3.98Å; A499-I513 HydrophobicContact CB-CD1 3.36Å; A499-I513 HydrophobicContact CB-CG1 3.89Å
500	S	84	Confident	73.2	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.021	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.5	173	70.1	0	0	0	0	114.9	V496 L497 L498 K547	V496-S500 PolarHBondContact O-N 2.96Å; L497-S500 WeakPolarHBondContact CA-OG 3.47Å; L497-S500 PolarHBondContact O-OG 2.62Å; L497-S500 VanDerWaalsContact O-OG 3.05Å; L498-S500 VanDerWaalsContact C-N 3.32Å; L498-S500 PolarHBondContact O-N 3.01Å; S500-K547 WeakPolarHBondContact CB-O 3.49Å; S500-K547 WeakPolarHBondContact O-CB 3.48Å
501	A	80.7	Confident	71.8	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.025	31%	0.307	C	S	.	.	S	Bend	trans	-63.1	142	176.8	0	0	0	0	0	111.8	L497 L498 A499 C503 S504 Y592	L497-A501 PolarHBondContact O-N 2.72Å; L498-A501 VanDerWaalsContact O-CB 3.26Å; L498-A501 WeakPolarHBondContact O-CB 3.35Å; L498-A501 PolarHBondContact O-N 3.36Å; A499-A501 VanDerWaalsContact C-N 3.27Å; A499-A501 PolarHBondContact O-N 3.16Å; A501-C503 VanDerWaalsContact C-N 3.31Å; A501-C503 PolarHBondContact O-N 2.93Å; A501-S504 PolarHBondContact O-N 2.87Å; A501-S504 VanDerWaalsContact O-N 3.16Å; A501-S504 PolarHBondContact O-OG 3.26Å; A501-Y592 HydrophobicContact CB-CD2 4.07Å
502	P	70	Confident	70.7	Confident	55 Å²	55	53.5 Å²	53.5	36%	0.357	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-39.3	-173.7	-25.3	31.6	0	0	0	114.1	N596	P502-N596 VanDerWaalsContact CG-OD1 3.31Å; P502-N596 WeakPolarHBondContact CG-OD1 3.42Å
503	C	65.4	Low	69.7	Low	65 Å²	65	53.8 Å²	53.8	44%	0.439	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	28.6	-178.4	-47.9	0	0	0	0	113.2	A501 K505 Q595	A501-C503 VanDerWaalsContact C-N 3.31Å; A501-C503 PolarHBondContact O-N 2.93Å; C503-K505 PolarHBondContact O-N 2.89Å; C503-Q595 HydrophobicContact CB-CG 4.26Å
504	S	62.2	Low	68.4	Low	26 Å²	26	55.1 Å²	55.1	18%	0.182	32%	0.316	C	S	.	.			trans	-64.9	82	167.4	55.1	0	0	0	0	109.5	A499 A501 G506 M510 K547	A499-S504 PolarHBondContact O-OG 3.44Å; A501-S504 PolarHBondContact O-N 2.87Å; A501-S504 VanDerWaalsContact O-N 3.16Å; A501-S504 PolarHBondContact O-OG 3.26Å; S504-G506 PolarHBondContact O-N 3.43Å; S504-M510 VanDerWaalsContact CB-CE 3.47Å; S504-K547 PolarHBondContact OG-NZ 2.88Å
505	K	51.5	Low	67.1	Low	188 Å²	188	55.6 Å²	55.6	82%	0.817	32%	0.318	S	S	*	.			trans	-57.4	122.4	163	-68.4	-172.7	178.6	-175.8	0	105.7	C503 K507	C503-K505 PolarHBondContact O-N 2.89Å; K505-K507 PolarHBondContact O-N 2.81Å
506	G	48.5	Very low	66	Low	76 Å²	76	52.6 Å²	52.6	78%	0.784	31%	0.305	S	S	*	.			trans	-59.9	74.2	-172.1	0	0	0	0	0	113	S504 A508	S504-G506 PolarHBondContact O-N 3.43Å; G506-A508 PolarHBondContact O-N 3.15Å
507	K	45.7	Very low	64.6	Low	167 Å²	167	52.8 Å²	52.8	73%	0.726	31%	0.306	S	S	*	.			trans	-56.4	134.2	162.5	-69.8	-167.8	173	-164.9	0	106.3	K505 D509 M510	K505-K507 PolarHBondContact O-N 2.81Å; K507-D509 PolarHBondContact O-N 2.94Å; K507-M510 HydrophobicContact CB-CG 4.16Å; K507-M510 VanDerWaalsContact O-CB 3.27Å; K507-M510 WeakPolarHBondContact O-CB 3.44Å; K507-M510 WeakPolarHBondContact O-CG 3.46Å; K507-M510 PolarHBondContact O-N 3.48Å
508	A	43.6	Very low	63.3	Low	92 Å²	92	55.4 Å²	55.4	76%	0.76	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-21	-174.5	0	0	0	0	0	114.4	G506 M510	G506-A508 PolarHBondContact O-N 3.15Å; A508-M510 VanDerWaalsContact C-N 3.33Å
509	D	47.2	Very low	61.7	Low	148 Å²	148	56.4 Å²	56.4	79%	0.791	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-2.8	177.1	-63	-36.2	0	0	0	115	K507	K507-D509 PolarHBondContact O-N 2.94Å
510	M	55.1	Low	60.1	Low	43 Å²	43	62.1 Å²	62.1	21%	0.212	35%	0.351	C	S	.	.	S	Bend	trans	-86.3	128.7	-177.8	-67.1	-79.4	-83.6	0	0	110.3	L498 A499 S504 K507 A508 N512	L498-M510 HydrophobicContact CB-CE 4.44Å; L498-M510 HydrophobicContact CB-SD 4.46Å; L498-M510 HydrophobicContact CD1-CE 4.43Å; L498-M510 HydrophobicContact CD2-CE 4.33Å; L498-M510 HydrophobicContact CD2-SD 3.62Å; L498-M510 HydrophobicContact CG-CE 3.7Å; L498-M510 HydrophobicContact CG-SD 3.66Å; L498-M510 WeakPolarHBondContact O-CE 3.36Å; A499-M510 VanDerWaalsContact CA-CE 3.4Å; A499-M510 HydrophobicContact CB-CE 3.98Å; S504-M510 VanDerWaalsContact CB-CE 3.47Å; K507-M510 HydrophobicContact CB-CG 4.16Å; K507-M510 VanDerWaalsContact O-CB 3.27Å; K507-M510 WeakPolarHBondContact O-CB 3.44Å; K507-M510 WeakPolarHBondContact O-CG 3.46Å; K507-M510 PolarHBondContact O-N 3.48Å; A508-M510 VanDerWaalsContact C-N 3.33Å; M510-N512 PolarHBondContact O-N 3.03Å
511	V	60	Low	58.3	Low	25 Å²	25	64.6 Å²	64.6	15%	0.152	37%	0.368	C	S	.	.			trans	-60	127.1	178.9	-168.2	0	0	0	0	109.3	F249 K495 I513	F249-V511 HydrophobicContact CD1-CG1 3.75Å; F249-V511 HydrophobicContact CE1-CB 4.28Å; F249-V511 HydrophobicContact CE1-CG1 3.15Å; F249-V511 HydrophobicContact CE2-CG1 4.07Å; F249-V511 HydrophobicContact CG-CG1 4.44Å; F249-V511 HydrophobicContact CZ-CG1 3.34Å; K495-V511 HydrophobicContact CB-CG2 4.48Å; V511-I513 PolarHBondContact O-N 2.98Å
512	N	65.9	Low	56.5	Low	79 Å²	79	71 Å²	71	42%	0.422	40%	0.402	S	S	.	.			trans	-74.9	93.5	-177.7	-173.4	6.1	0	0	0	110.4	M510 V514	M510-N512 PolarHBondContact O-N 3.03Å; N512-V514 PolarHBondContact O-N 3.01Å; N512-V514 WeakPolarHBondContact OD1-CB 3.24Å; N512-V514 PolarHBondContact OD1-N 3Å
513	I	68.2	Low	55	Low	7 Å²	7	74.3 Å²	74.3	4%	0.036	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-71.5	-23.1	176.5	-64.5	-179.3	0	0	0	111.6	I259 V496 A499 V511 Y515 Q546 I550	I259-I513 HydrophobicContact CG2-CG2 4.25Å; V496-I513 HydrophobicContact CG1-CD1 4.05Å; V496-I513 WeakPolarHBondContact O-CD1 3.48Å; A499-I513 HydrophobicContact CB-CD1 3.36Å; A499-I513 HydrophobicContact CB-CG1 3.89Å; V511-I513 PolarHBondContact O-N 2.98Å; I513-Y515 PolarHBondContact O-N 3Å; I513-Q546 HydrophobicContact CG2-CG 4.28Å; I513-Q546 PolarHBondContact O-NE2 3.48Å; I513-Q546 PolarHBondContact O-OE1 3.19Å; I513-I550 HydrophobicContact CB-CD1 4.46Å; I513-I550 HydrophobicContact CD1-CD1 4.37Å; I513-I550 HydrophobicContact CD1-CG2 4.4Å; I513-I550 HydrophobicContact CG2-CD1 3.13Å
514	V	63.2	Low	54	Low	30 Å²	30	75.5 Å²	75.5	18%	0.182	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-78.3	-7.1	-171.3	-177.1	0	0	0	0	112.6	N512 E516 V517 L518 V543	N512-V514 PolarHBondContact O-N 3.01Å; N512-V514 WeakPolarHBondContact OD1-CB 3.24Å; N512-V514 PolarHBondContact OD1-N 3Å; V514-E516 PolarHBondContact O-N 2.83Å; V514-V517 PolarHBondContact O-N 3.02Å; V514-L518 HydrophobicContact CG1-CD2 4.16Å; V514-L518 HydrophobicContact CG1-CG 4.38Å; V514-L518 PolarHBondContact O-N 3.02Å; V514-V543 HydrophobicContact CB-CG2 4.42Å; V514-V543 HydrophobicContact CG1-CG2 3.48Å; V514-V543 VanDerWaalsContact CG1-CG2 3.48Å; V514-V543 HydrophobicContact CG2-CG1 3.83Å; V514-V543 HydrophobicContact CG2-CG2 4.1Å
515	Y	63.3	Low	52.9	Low	19 Å²	19	82.9 Å²	82.9	8%	0.075	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-50.9	-36.8	-176.7	-167.9	-89.1	0	0	0	113.3	S173 L174 H256 I513 V517	S173-Y515 VanDerWaalsContact CB-OH 3.3Å; S173-Y515 WeakPolarHBondContact CB-OH 3.14Å; S173-Y515 PolarHBondContact OG-OH 3.32Å; L174-Y515 HydrophobicContact CG-CE1 4.19Å; H256-Y515 VanDerWaalsContact CA-CE1 3.41Å; H256-Y515 HydrophobicContact CB-CD1 4.22Å; H256-Y515 HydrophobicContact CB-CE1 3.49Å; H256-Y515 VanDerWaalsContact CB-CE1 3.49Å; I513-Y515 PolarHBondContact O-N 3Å; Y515-V517 VanDerWaalsContact C-N 3.25Å; Y515-V517 PolarHBondContact O-N 3.35Å
516	E	64.1	Low	52.4	Low	17 Å²	17	77.2 Å²	77.2	8%	0.079	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-67.8	-18.9	-179	-163.1	-178.4	167.1	0	0	114.5	P258 R260 K261 V514 Q546	P258-E516 HydrophobicContact CB-CG 4.25Å; R260-E516 WeakPolarHBondContact CB-OE2 3.46Å; R260-E516 IonicContact CZ-OE1 2.83Å; R260-E516 IonicContact NE-OE1 2.73Å; R260-E516 PolarHBondContact NE-OE1 3.39Å; R260-E516 IonicContact NE-OE2 3.71Å; R260-E516 PolarHBondContact NE-OE2 3.01Å; R260-E516 IonicContact NH2-OE1 3.41Å; R260-E516 PolarHBondContact NH2-OE1 3.01Å; R260-E516 IonicContact NH2-OE2 2.62Å; K261-E516 VanDerWaalsContact CE-OE1 3.23Å; K261-E516 WeakPolarHBondContact CE-OE1 3.18Å; K261-E516 WeakPolarHBondContact CG-OE1 3.28Å; K261-E516 IonicContact NZ-OE1 3.47Å; V514-E516 PolarHBondContact O-N 2.83Å; E516-Q546 PolarHBondContact OE2-NE2 3.14Å; E516-Q546 VanDerWaalsContact OE2-NE2 3.15Å
517	V	59.8	Low	52.1	Low	4 Å²	4	76.8 Å²	76.8	2%	0.024	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-109.5	-9.2	-173.2	-162.5	0	0	0	0	111.9	V514 Y515 L539 D542 Q546	V514-V517 PolarHBondContact O-N 3.02Å; Y515-V517 VanDerWaalsContact C-N 3.25Å; Y515-V517 PolarHBondContact O-N 3.35Å; V517-L539 HydrophobicContact CB-CD1 4Å; V517-L539 HydrophobicContact CG1-CD1 3.46Å; V517-L539 VanDerWaalsContact CG1-CD1 3.46Å; V517-L539 VanDerWaalsContact O-CD1 3.27Å; V517-L539 WeakPolarHBondContact O-CD1 3.14Å; V517-D542 HydrophobicContact CG1-CB 3.33Å; V517-D542 HydrophobicContact CG2-CB 4.46Å; V517-Q546 VanDerWaalsContact CG2-OE1 3.25Å
518	L	61.3	Low	52.1	Low	54 Å²	54	74.8 Å²	74.8	28%	0.283	43%	0.428	S	S	.	.			trans	-65.4	130.5	-177	-68.8	174.1	0	0	0	110.8	V514	V514-L518 HydrophobicContact CG1-CD2 4.16Å; V514-L518 HydrophobicContact CG1-CG 4.38Å; V514-L518 PolarHBondContact O-N 3.02Å
519	P	52.5	Low	52.1	Low	77 Å²	77	74.7 Å²	74.7	50%	0.5	42%	0.422	S	S	.	.			trans	-65.9	145	-179.1	24.7	-32.3	0	0	0	112	S521	P519-S521 PolarHBondContact O-N 2.99Å
520	Y	51	Low	52.1	Low	127 Å²	127	71.6 Å²	71.6	50%	0.498	41%	0.405	S	S	.	.			trans	-64.1	96.9	165.8	-68.2	-87.1	0	0	0	108.9	L174 R181	L174-Y520 HydrophobicContact CB-CD1 4.34Å; L174-Y520 HydrophobicContact CB-CE1 3.78Å; L174-Y520 HydrophobicContact CD2-CE1 4.37Å; R181-Y520 PolarHBondContact NH2-OH 2.82Å
521	S	45.4	Very low	52.2	Low	55 Å²	55	74.4 Å²	74.4	39%	0.385	42%	0.424	S	S	.	.			trans	-143.8	127	165.7	56.9	0	0	0	0	108.8	P519 D523	P519-S521 PolarHBondContact O-N 2.99Å; S521-D523 PolarHBondContact O-N 3.37Å
522	D	43.6	Very low	52.1	Low	137 Å²	137	79.9 Å²	79.9	73%	0.733	45%	0.452	S	S	*	.	S	Bend	trans	-65	-15	172.2	-68.4	-35.9	0	0	0	111.2
523	D	38.4	Very low	52.4	Low	125 Å²	125	78 Å²	78	67%	0.668	44%	0.444	S	S	*	.			trans	-109.7	64.5	-175.8	-59.1	-41.6	0	0	0	112.4	S521 E525 S526	S521-D523 PolarHBondContact O-N 3.37Å; D523-E525 PolarHBondContact O-N 2.72Å; D523-S526 PolarHBondContact O-N 2.99Å
524	V	43.1	Very low	52.7	Low	89 Å²	89	82.7 Å²	82.7	54%	0.539	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-56.2	-19.8	-179.3	177.7	0	0	0	0	113.6	S526	V524-S526 VanDerWaalsContact C-N 3.27Å; V524-S526 PolarHBondContact O-N 3.38Å
525	E	39.9	Very low	53.1	Low	182 Å²	182	88.5 Å²	88.5	85%	0.85	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-68.1	-20.7	-177	-70.1	-171.3	164.2	0	0	114.2	D523	D523-E525 PolarHBondContact O-N 2.72Å
526	S	40.9	Very low	53.6	Low	69 Å²	69	88.4 Å²	88.4	48%	0.483	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-85.3	-18.5	-177.3	-61.3	0	0	0	0	114.1	D523 V524 T528 S529	D523-S526 PolarHBondContact O-N 2.99Å; V524-S526 VanDerWaalsContact C-N 3.27Å; V524-S526 PolarHBondContact O-N 3.38Å; S526-T528 VanDerWaalsContact C-N 3.34Å; S526-T528 PolarHBondContact O-N 3.04Å; S526-S529 PolarHBondContact O-N 3.45Å; S526-S529 PolarHBondContact O-OG 2.84Å
527	A	41.7	Very low	54.2	Low	66 Å²	66	92.5 Å²	92.5	55%	0.545	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-25.4	-172.3	0	0	0	0	0	114.1
528	T	45.3	Very low	55	Low	125 Å²	125	97.1 Å²	97.1	77%	0.767	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-16.9	-176.9	-24	0	0	0	0	113.4	S526	S526-T528 VanDerWaalsContact C-N 3.34Å; S526-T528 PolarHBondContact O-N 3.04Å
529	S	44.8	Very low	55.8	Low	90 Å²	90	96.4 Å²	96.4	63%	0.629	54%	0.538	S	S	*	.	S	Bend	trans	-96.7	-0.1	-174.9	67	0	0	0	0	114.6	S526	S526-S529 PolarHBondContact O-N 3.45Å; S526-S529 PolarHBondContact O-OG 2.84Å
530	L	47	Very low	57.1	Low	84 Å²	84	96.8 Å²	96.8	44%	0.44	54%	0.536	S	S	.	.			trans	-121.3	55.6	-170.9	-68	175.8	0	0	0	112	D532 T533 A536	L530-D532 PolarHBondContact O-N 3.11Å; L530-T533 HydrophobicContact CB-CG2 3.8Å; L530-T533 HydrophobicContact CD1-CG2 4.24Å; L530-T533 HydrophobicContact CD2-CG2 4.26Å; L530-T533 HydrophobicContact CG-CG2 4.33Å; L530-T533 PolarHBondContact O-N 3.31Å; L530-T533 PolarHBondContact O-OG1 3.48Å; L530-A536 WeakPolarHBondContact O-CB 3.37Å
531	V	56.4	Low	58.5	Low	102 Å²	102	93 Å²	93	62%	0.618	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.8	-172.5	-177.8	0	0	0	0	113.7
532	D	58.1	Low	60.4	Low	139 Å²	139	90.5 Å²	90.5	74%	0.743	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	16.4	-173.9	-61	-39.6	0	0	0	115.1	L530	L530-D532 PolarHBondContact O-N 3.11Å
533	T	73	Confident	62.2	Low	40 Å²	40	85 Å²	85	25%	0.245	49%	0.485	C	S	.	.	S	Bend	trans	-73	148.8	171.5	57.3	0	0	0	0	111	L530 E535 A536 L537	L530-T533 HydrophobicContact CB-CG2 3.8Å; L530-T533 HydrophobicContact CD1-CG2 4.24Å; L530-T533 HydrophobicContact CD2-CG2 4.26Å; L530-T533 HydrophobicContact CG-CG2 4.33Å; L530-T533 PolarHBondContact O-N 3.31Å; L530-T533 PolarHBondContact O-OG1 3.48Å; T533-E535 PolarHBondContact O-N 3.04Å; T533-E535 VanDerWaalsContact O-N 3.15Å; T533-A536 PolarHBondContact O-N 3.1Å; T533-A536 WeakPolarHBondContact OG1-CB 3.5Å; T533-A536 PolarHBondContact OG1-N 2.86Å; T533-L537 PolarHBondContact O-N 3.09Å
534	P	73.8	Confident	64.4	Low	105 Å²	105	83.9 Å²	83.9	68%	0.682	48%	0.478	S	S	*	.	H	α-helix	trans	-57.1	-30.3	176.7	22.9	-34	0	0	0	112.5	R538	P534-R538 WeakPolarHBondContact O-CB 3.25Å; P534-R538 PolarHBondContact O-N 2.86Å
535	E	72.6	Confident	66.5	Low	153 Å²	153	80.2 Å²	80.2	72%	0.715	45%	0.454	S	S	*	.	H	α-helix	trans	-66.9	-45.3	173.9	-66.8	166.9	-175.7	0	0	112.2	T533 L537 R538 L539	T533-E535 PolarHBondContact O-N 3.04Å; T533-E535 VanDerWaalsContact O-N 3.15Å; E535-L537 VanDerWaalsContact C-N 3.34Å; E535-L537 PolarHBondContact O-N 3.16Å; E535-R538 PolarHBondContact O-N 3.34Å; E535-L539 WeakPolarHBondContact O-CB 3.5Å; E535-L539 PolarHBondContact O-N 3.42Å
536	A	72.7	Confident	68.8	Low	17 Å²	17	71.6 Å²	71.6	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-64	-39.3	176.3	0	0	0	0	0	111.8	L530 T533 L539 N540	L530-A536 WeakPolarHBondContact O-CB 3.37Å; T533-A536 PolarHBondContact O-N 3.1Å; T533-A536 WeakPolarHBondContact OG1-CB 3.5Å; T533-A536 PolarHBondContact OG1-N 2.86Å; A536-L539 PolarHBondContact O-N 2.88Å; A536-N540 WeakPolarHBondContact O-CB 3.37Å; A536-N540 VanDerWaalsContact O-CG 3.27Å; A536-N540 PolarHBondContact O-N 3.37Å; A536-N540 PolarHBondContact O-ND2 3.4Å; A536-N540 VanDerWaalsContact O-ND2 3.1Å
537	L	77.7	Confident	71.1	Confident	102 Å²	102	70.2 Å²	70.2	53%	0.534	40%	0.399	S	S	.	.	H	α-helix	trans	-64.5	-42.6	174.9	-68.2	176.5	0	0	0	112.1	T533 E535 N540 A541	T533-L537 PolarHBondContact O-N 3.09Å; E535-L537 VanDerWaalsContact C-N 3.34Å; E535-L537 PolarHBondContact O-N 3.16Å; L537-N540 PolarHBondContact O-N 3.02Å; L537-A541 WeakPolarHBondContact O-CB 3.34Å; L537-A541 PolarHBondContact O-N 3.18Å
538	R	76.2	Confident	73.4	Confident	101 Å²	101	68.4 Å²	68.4	38%	0.381	38%	0.379	S	S	.	.	H	α-helix	trans	-62.4	-46.3	174.8	179.4	-178.7	178.2	164.4	-2.1	111.6	Y42 S45 P534 E535 N540 A541 D542	Y42-R538 VanDerWaalsContact C-NH2 3.26Å; Y42-R538 PolarHBondContact O-NH2 2.77Å; S45-R538 PolarHBondContact OG-NH2 3.07Å; P534-R538 WeakPolarHBondContact O-CB 3.25Å; P534-R538 PolarHBondContact O-N 2.86Å; E535-R538 PolarHBondContact O-N 3.34Å; R538-N540 PolarHBondContact O-N 2.87Å; R538-A541 PolarHBondContact O-N 3.18Å; R538-D542 PolarHBondContact O-N 3.34Å
539	L	77.8	Confident	75.6	Confident	40 Å²	40	62.4 Å²	62.4	21%	0.209	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-48	175.9	177.9	60.8	0	0	0	110.7	V517 E535 A536 A541 D542 V543	V517-L539 HydrophobicContact CB-CD1 4Å; V517-L539 HydrophobicContact CG1-CD1 3.46Å; V517-L539 VanDerWaalsContact CG1-CD1 3.46Å; V517-L539 VanDerWaalsContact O-CD1 3.27Å; V517-L539 WeakPolarHBondContact O-CD1 3.14Å; E535-L539 WeakPolarHBondContact O-CB 3.5Å; E535-L539 PolarHBondContact O-N 3.42Å; A536-L539 PolarHBondContact O-N 2.88Å; L539-A541 VanDerWaalsContact C-N 3.34Å; L539-A541 PolarHBondContact O-N 3.47Å; L539-D542 PolarHBondContact O-N 3.03Å; L539-V543 HydrophobicContact CD1-CG2 4.34Å; L539-V543 WeakPolarHBondContact O-CG2 2.91Å; L539-V543 PolarHBondContact O-N 3.21Å
540	N	78.9	Confident	77.8	Confident	85 Å²	85	58.2 Å²	58.2	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-42	177.4	-77.4	-36.5	0	0	0	112.5	A536 L537 R538 V543 I544	A536-N540 WeakPolarHBondContact O-CB 3.37Å; A536-N540 VanDerWaalsContact O-CG 3.27Å; A536-N540 PolarHBondContact O-N 3.37Å; A536-N540 PolarHBondContact O-ND2 3.4Å; A536-N540 VanDerWaalsContact O-ND2 3.1Å; L537-N540 PolarHBondContact O-N 3.02Å; R538-N540 PolarHBondContact O-N 2.87Å; N540-V543 PolarHBondContact O-N 2.84Å; N540-I544 WeakPolarHBondContact O-CG1 3.37Å; N540-I544 PolarHBondContact O-N 3.22Å
541	A	82	Confident	80	Confident	46 Å²	46	54.2 Å²	54.2	38%	0.38	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-43.5	175.6	0	0	0	0	0	111.8	L537 R538 L539 I544 R545	L537-A541 WeakPolarHBondContact O-CB 3.34Å; L537-A541 PolarHBondContact O-N 3.18Å; R538-A541 PolarHBondContact O-N 3.18Å; L539-A541 VanDerWaalsContact C-N 3.34Å; L539-A541 PolarHBondContact O-N 3.47Å; A541-I544 PolarHBondContact O-N 2.91Å; A541-R545 WeakPolarHBondContact O-CB 3.48Å; A541-R545 PolarHBondContact O-N 2.8Å
542	D	83.5	Confident	81.7	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-43.5	175.4	-91.1	-26.2	0	0	0	111.8	Y42 S43 V517 R538 L539 I544 R545 Q546	Y42-D542 WeakPolarHBondContact CB-OD1 3.38Å; Y42-D542 WeakPolarHBondContact CB-OD2 3.33Å; Y42-D542 WeakPolarHBondContact CD2-OD1 3.49Å; Y42-D542 PolarHBondContact N-OD1 3.44Å; Y42-D542 PolarHBondContact N-OD2 3.38Å; S43-D542 PolarHBondContact N-OD2 3.05Å; S43-D542 PolarHBondContact OG-OD2 2.88Å; V517-D542 HydrophobicContact CG1-CB 3.33Å; V517-D542 HydrophobicContact CG2-CB 4.46Å; R538-D542 PolarHBondContact O-N 3.34Å; L539-D542 PolarHBondContact O-N 3.03Å; D542-I544 PolarHBondContact O-N 3.45Å; D542-R545 PolarHBondContact O-N 2.86Å; D542-Q546 VanDerWaalsContact O-CB 3.29Å; D542-Q546 WeakPolarHBondContact O-CB 3.16Å; D542-Q546 PolarHBondContact O-N 3.38Å
543	V	83.4	Confident	83.5	Confident	22 Å²	22	42.8 Å²	42.8	13%	0.133	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-46.5	177.4	172	0	0	0	0	111.1	V514 L539 N540 Q546 K547	V514-V543 HydrophobicContact CB-CG2 4.42Å; V514-V543 HydrophobicContact CG1-CG2 3.48Å; V514-V543 VanDerWaalsContact CG1-CG2 3.48Å; V514-V543 HydrophobicContact CG2-CG1 3.83Å; V514-V543 HydrophobicContact CG2-CG2 4.1Å; L539-V543 HydrophobicContact CD1-CG2 4.34Å; L539-V543 WeakPolarHBondContact O-CG2 2.91Å; L539-V543 PolarHBondContact O-N 3.21Å; N540-V543 PolarHBondContact O-N 2.84Å; V543-Q546 PolarHBondContact O-N 3.33Å; V543-K547 HydrophobicContact CG1-CD 4.47Å; V543-K547 VanDerWaalsContact O-CG 3.31Å; V543-K547 WeakPolarHBondContact O-CG 3.46Å; V543-K547 PolarHBondContact O-N 3.27Å
544	I	83.7	Confident	84.5	Confident	102 Å²	102	40.9 Å²	40.9	52%	0.523	22%	0.216	S	C	.	.	H	α-helix	trans	-60.8	-50.6	177.3	-67.3	166.8	0	0	0	109.4	N540 A541 D542 Q546 K547 E548	N540-I544 WeakPolarHBondContact O-CG1 3.37Å; N540-I544 PolarHBondContact O-N 3.22Å; A541-I544 PolarHBondContact O-N 2.91Å; D542-I544 PolarHBondContact O-N 3.45Å; I544-Q546 VanDerWaalsContact C-N 3.34Å; I544-Q546 PolarHBondContact O-N 3.29Å; I544-K547 WeakPolarHBondContact O-CB 3.31Å; I544-K547 PolarHBondContact O-N 3.16Å; I544-K547 VanDerWaalsContact O-N 3.16Å; I544-E548 WeakPolarHBondContact O-CG 3.21Å; I544-E548 PolarHBondContact O-N 3.38Å
545	R	87.3	Confident	85.5	Confident	11 Å²	11	35.9 Å²	35.9	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-57.5	-44.5	179.4	-177.4	-179.6	177.6	-153.8	-3.4	112.2	N37 Y40 A541 D542 K547 E548 I549	N37-R545 VanDerWaalsContact C-NH2 3.32Å; N37-R545 PolarHBondContact O-NH2 3.42Å; N37-R545 PolarHBondContact OD1-NH2 3.46Å; Y40-R545 PolarHBondContact O-NH1 3.32Å; Y40-R545 VanDerWaalsContact O-NH1 3.14Å; A541-R545 WeakPolarHBondContact O-CB 3.48Å; A541-R545 PolarHBondContact O-N 2.8Å; D542-R545 PolarHBondContact O-N 2.86Å; R545-K547 VanDerWaalsContact C-N 3.34Å; R545-K547 PolarHBondContact O-N 3.31Å; R545-E548 WeakPolarHBondContact O-CB 3.28Å; R545-E548 PolarHBondContact O-N 3.47Å; R545-I549 HydrophobicContact CG-CD1 3.89Å; R545-I549 VanDerWaalsContact O-CG1 3.3Å; R545-I549 WeakPolarHBondContact O-CG1 3.38Å; R545-I549 PolarHBondContact O-N 2.66Å
546	Q	87.7	Confident	86.6	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.009	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-42.3	178.4	-169.3	-172	16.1	0	0	111.3	R260 I513 E516 V517 D542 V543 I544 E548 I549 I550	R260-Q546 HydrophobicContact CB-CG 4.29Å; I513-Q546 HydrophobicContact CG2-CG 4.28Å; I513-Q546 PolarHBondContact O-NE2 3.48Å; I513-Q546 PolarHBondContact O-OE1 3.19Å; E516-Q546 PolarHBondContact OE2-NE2 3.14Å; E516-Q546 VanDerWaalsContact OE2-NE2 3.15Å; V517-Q546 VanDerWaalsContact CG2-OE1 3.25Å; D542-Q546 VanDerWaalsContact O-CB 3.29Å; D542-Q546 WeakPolarHBondContact O-CB 3.16Å; D542-Q546 PolarHBondContact O-N 3.38Å; V543-Q546 PolarHBondContact O-N 3.33Å; I544-Q546 VanDerWaalsContact C-N 3.34Å; I544-Q546 PolarHBondContact O-N 3.29Å; Q546-E548 PolarHBondContact O-N 3.32Å; Q546-I549 PolarHBondContact O-N 3.38Å; Q546-I550 HydrophobicContact CG-CD1 3.91Å; Q546-I550 WeakPolarHBondContact O-CB 3.06Å; Q546-I550 WeakPolarHBondContact O-CG1 3.39Å; Q546-I550 PolarHBondContact O-N 3.29Å
547	K	89	Confident	87.7	Confident	40 Å²	40	27.9 Å²	27.9	17%	0.174	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-44.5	174.5	-73.1	-175.6	177.7	-169.5	0	111.8	S500 S504 V543 I544 R545 I550 A551	S500-K547 WeakPolarHBondContact CB-O 3.49Å; S500-K547 WeakPolarHBondContact O-CB 3.48Å; S504-K547 PolarHBondContact OG-NZ 2.88Å; V543-K547 HydrophobicContact CG1-CD 4.47Å; V543-K547 VanDerWaalsContact O-CG 3.31Å; V543-K547 WeakPolarHBondContact O-CG 3.46Å; V543-K547 PolarHBondContact O-N 3.27Å; I544-K547 WeakPolarHBondContact O-CB 3.31Å; I544-K547 PolarHBondContact O-N 3.16Å; I544-K547 VanDerWaalsContact O-N 3.16Å; R545-K547 VanDerWaalsContact C-N 3.34Å; R545-K547 PolarHBondContact O-N 3.31Å; K547-I550 PolarHBondContact O-N 2.99Å; K547-A551 WeakPolarHBondContact O-CB 3.39Å; K547-A551 PolarHBondContact O-N 3.35Å
548	E	89.6	Confident	88.5	Confident	27 Å²	27	23.3 Å²	23.3	13%	0.126	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-45.8	177.2	-61.2	-179.3	157.8	0	0	112.3	I544 R545 Q546 I550 A551 K552 R613 N614	I544-E548 WeakPolarHBondContact O-CG 3.21Å; I544-E548 PolarHBondContact O-N 3.38Å; R545-E548 WeakPolarHBondContact O-CB 3.28Å; R545-E548 PolarHBondContact O-N 3.47Å; Q546-E548 PolarHBondContact O-N 3.32Å; E548-I550 VanDerWaalsContact C-N 3.35Å; E548-I550 PolarHBondContact O-N 2.62Å; E548-A551 PolarHBondContact O-N 2.81Å; E548-K552 WeakPolarHBondContact O-CB 3.32Å; E548-K552 PolarHBondContact O-N 2.97Å; E548-R613 HydrophobicContact CB-CB 4.29Å; E548-R613 IonicContact OE2-CZ 3.71Å; E548-R613 IonicContact OE2-NE 2.78Å; E548-R613 PolarHBondContact OE2-NE 2.94Å; E548-R613 VanDerWaalsContact OE2-NE 3.08Å; E548-R613 IonicContact OE2-NH2 3.8Å; E548-R613 PolarHBondContact OE2-NH2 3.21Å; E548-N614 VanDerWaalsContact CG-OD1 3.3Å; E548-N614 WeakPolarHBondContact CG-OD1 3.44Å; E548-N614 PolarHBondContact OE1-ND2 3.32Å
549	I	92.1	Very high	89.4	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.8	-44.6	179	-67.4	165.8	0	0	0	110.4	E38 R260 L264 R545 Q546 K552 C553	E38-I549 HydrophobicContact CB-CD1 4.06Å; E38-I549 HydrophobicContact CB-CG1 4.35Å; E38-I549 HydrophobicContact CB-CG2 4.46Å; E38-I549 HydrophobicContact CG-CD1 4.02Å; E38-I549 HydrophobicContact CG-CG1 4Å; R260-I549 HydrophobicContact CG-CG2 4.07Å; L264-I549 HydrophobicContact CD1-CG2 4.12Å; L264-I549 HydrophobicContact CD2-CG2 4.06Å; L264-I549 HydrophobicContact CG-CG2 4.19Å; R545-I549 HydrophobicContact CG-CD1 3.89Å; R545-I549 VanDerWaalsContact O-CG1 3.3Å; R545-I549 WeakPolarHBondContact O-CG1 3.38Å; R545-I549 PolarHBondContact O-N 2.66Å; Q546-I549 PolarHBondContact O-N 3.38Å; I549-K552 WeakPolarHBondContact O-CB 3.11Å; I549-K552 PolarHBondContact O-N 3.2Å; I549-C553 PolarHBondContact O-N 2.88Å; I549-C553 PolarHBondContact O-SG 3.36Å
550	I	92	Very high	90.2	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-66.2	-41.4	179.1	-73.4	169.1	0	0	0	111.3	I259 R260 L263 V496 I513 Q546 K547 E548 K552 C553 V554	I259-I550 HydrophobicContact CG2-CD1 4.08Å; R260-I550 HydrophobicContact CB-CD1 4.29Å; R260-I550 HydrophobicContact CB-CG1 4.35Å; L263-I550 HydrophobicContact CD1-CG1 4.26Å; L263-I550 HydrophobicContact CD1-CG2 4Å; V496-I550 HydrophobicContact CG1-CG2 3.36Å; I513-I550 HydrophobicContact CB-CD1 4.46Å; I513-I550 HydrophobicContact CD1-CD1 4.37Å; I513-I550 HydrophobicContact CD1-CG2 4.4Å; I513-I550 HydrophobicContact CG2-CD1 3.13Å; Q546-I550 HydrophobicContact CG-CD1 3.91Å; Q546-I550 WeakPolarHBondContact O-CB 3.06Å; Q546-I550 WeakPolarHBondContact O-CG1 3.39Å; Q546-I550 PolarHBondContact O-N 3.29Å; K547-I550 PolarHBondContact O-N 2.99Å; E548-I550 VanDerWaalsContact C-N 3.35Å; E548-I550 PolarHBondContact O-N 2.62Å; I550-K552 VanDerWaalsContact C-N 3.31Å; I550-K552 PolarHBondContact O-N 2.91Å; I550-C553 PolarHBondContact O-N 3Å; I550-V554 HydrophobicContact CG2-CG2 4.17Å; I550-V554 WeakPolarHBondContact O-CB 3.31Å; I550-V554 VanDerWaalsContact O-CG2 3.31Å; I550-V554 WeakPolarHBondContact O-CG2 3.39Å; I550-V554 PolarHBondContact O-N 3.44Å
551	A	92.4	Very high	91	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.7	-41	174	0	0	0	0	0	111.8	L497 K547 E548 S555 Y592	L497-A551 HydrophobicContact CD1-CB 4.27Å; K547-A551 WeakPolarHBondContact O-CB 3.39Å; K547-A551 PolarHBondContact O-N 3.35Å; E548-A551 PolarHBondContact O-N 2.81Å; A551-S555 WeakPolarHBondContact O-CB 3.03Å; A551-S555 PolarHBondContact O-N 3.15Å; A551-S555 PolarHBondContact O-OG 3.03Å; A551-Y592 HydrophobicContact CB-CE2 4.32Å; A551-Y592 WeakPolarHBondContact CB-OH 3.05Å
552	K	93	Very high	91.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-59.1	-54.4	173.5	162.8	177.7	171.7	-172.7	0	111	E35 E38 W267 E548 I549 I550 S555 A556 W612 R613 F616 S617	E35-K552 VanDerWaalsContact CD-NZ 3.34Å; E35-K552 IonicContact OE1-NZ 3.77Å; E35-K552 PolarHBondContact OE1-NZ 2.84Å; E35-K552 IonicContact OE2-NZ 3.8Å; E35-K552 PolarHBondContact OE2-NZ 3.32Å; E38-K552 IonicContact OE1-NZ 3.02Å; E38-K552 PolarHBondContact OE1-NZ 2.98Å; E38-K552 WeakPolarHBondContact OE2-CE 3.47Å; E38-K552 IonicContact OE2-NZ 3.73Å; E38-K552 PolarHBondContact OE2-NZ 3.48Å; W267-K552 HydrophobicContact CH2-CD 4.46Å; W267-K552 HydrophobicContact CH2-CG 4.3Å; W267-K552 HydrophobicContact CZ3-CD 4.46Å; W267-K552 HydrophobicContact CZ3-CG 4.32Å; E548-K552 WeakPolarHBondContact O-CB 3.32Å; E548-K552 PolarHBondContact O-N 2.97Å; I549-K552 WeakPolarHBondContact O-CB 3.11Å; I549-K552 PolarHBondContact O-N 3.2Å; I550-K552 VanDerWaalsContact C-N 3.31Å; I550-K552 PolarHBondContact O-N 2.91Å; K552-S555 PolarHBondContact O-N 3.1Å; K552-S555 PolarHBondContact O-OG 3Å; K552-A556 VanDerWaalsContact O-CB 3.31Å; K552-A556 WeakPolarHBondContact O-CB 3.41Å; K552-A556 PolarHBondContact O-N 2.73Å; K552-W612 HydrophobicContact CD-CZ3 3.9Å; K552-R613 HydrophobicContact CD-CB 4.38Å; K552-R613 HydrophobicContact CD-CG 3.93Å; K552-F616 HydrophobicContact CB-CD1 4.32Å; K552-F616 HydrophobicContact CD-CD1 4.35Å; K552-F616 HydrophobicContact CG-CD1 3.72Å; K552-F616 HydrophobicContact CG-CE1 3.8Å; K552-S617 WeakPolarHBondContact CA-OG 3.38Å; K552-S617 PolarHBondContact N-OG 3.22Å
553	C	94.7	Very high	92.1	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-61.8	-52.6	-177.2	-64.2	0	0	0	0	111.9	L263 L264 W267 I549 I550 S555 A556 M557	L263-C553 HydrophobicContact CB-CB 4.22Å; L264-C553 WeakPolarHBondContact CD2-SG 3.49Å; W267-C553 HydrophobicContact CE3-CB 4.34Å; I549-C553 PolarHBondContact O-N 2.88Å; I549-C553 PolarHBondContact O-SG 3.36Å; I550-C553 PolarHBondContact O-N 3Å; C553-S555 VanDerWaalsContact C-N 3.34Å; C553-S555 PolarHBondContact O-N 3.33Å; C553-A556 PolarHBondContact O-N 3.48Å; C553-M557 WeakPolarHBondContact O-CB 3.3Å; C553-M557 VanDerWaalsContact O-CG 3.26Å; C553-M557 WeakPolarHBondContact O-CG 3.42Å; C553-M557 PolarHBondContact O-N 3.28Å
554	V	95	Very high	92.6	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.6	-42.7	-177.1	173.7	0	0	0	0	111.1	L263 L493 V496 L497 I550 L558	L263-V554 HydrophobicContact CD1-CG2 3.94Å; L263-V554 HydrophobicContact CD2-CG2 4.28Å; L493-V554 HydrophobicContact CB-CG1 4.1Å; L493-V554 HydrophobicContact CD2-CG1 4.16Å; L493-V554 HydrophobicContact CD2-CG2 4.13Å; V496-V554 HydrophobicContact CG1-CG2 4.13Å; L497-V554 HydrophobicContact CB-CG1 4.08Å; I550-V554 HydrophobicContact CG2-CG2 4.17Å; I550-V554 WeakPolarHBondContact O-CB 3.31Å; I550-V554 VanDerWaalsContact O-CG2 3.31Å; I550-V554 WeakPolarHBondContact O-CG2 3.39Å; I550-V554 PolarHBondContact O-N 3.44Å; V554-L558 HydrophobicContact CG1-CD1 3.87Å; V554-L558 HydrophobicContact CG1-CG 4.31Å; V554-L558 WeakPolarHBondContact O-CB 3.44Å; V554-L558 VanDerWaalsContact O-CG 3.28Å; V554-L558 WeakPolarHBondContact O-CG 3.33Å; V554-L558 PolarHBondContact O-N 2.81Å
555	S	94.9	Very high	93.1	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-66.6	-38.1	178.7	70.3	0	0	0	0	112.3	A551 K552 C553 L559 N620 I624	A551-S555 WeakPolarHBondContact O-CB 3.03Å; A551-S555 PolarHBondContact O-N 3.15Å; A551-S555 PolarHBondContact O-OG 3.03Å; K552-S555 PolarHBondContact O-N 3.1Å; K552-S555 PolarHBondContact O-OG 3Å; C553-S555 VanDerWaalsContact C-N 3.34Å; C553-S555 PolarHBondContact O-N 3.33Å; S555-L559 VanDerWaalsContact O-CB 3.23Å; S555-L559 WeakPolarHBondContact O-CB 3.48Å; S555-L559 PolarHBondContact O-N 2.99Å; S555-L559 VanDerWaalsContact O-N 3.14Å; S555-N620 WeakPolarHBondContact OG-CB 3.3Å; S555-N620 PolarHBondContact OG-ND2 3.42Å; S555-I624 WeakPolarHBondContact O-CD1 3.4Å
556	A	95.5	Very high	93.3	Very high	3 Å²	3	8.1 Å²	8.1	3%	0.025	4%	0.037	C	C	.	.	H	α-helix	trans	-67.3	-49.6	175.7	0	0	0	0	0	112	W267 K552 C553 L558 L559 L560 F616	W267-A556 HydrophobicContact CD2-CB 4.33Å; W267-A556 HydrophobicContact CZ2-CB 3.74Å; K552-A556 VanDerWaalsContact O-CB 3.31Å; K552-A556 WeakPolarHBondContact O-CB 3.41Å; K552-A556 PolarHBondContact O-N 2.73Å; C553-A556 PolarHBondContact O-N 3.48Å; A556-L558 PolarHBondContact O-N 2.69Å; A556-L559 PolarHBondContact O-N 3.45Å; A556-L560 WeakPolarHBondContact O-CB 3.48Å; A556-L560 PolarHBondContact O-N 2.92Å; A556-F616 HydrophobicContact CB-CE1 3.9Å; A556-F616 HydrophobicContact CB-CZ 4.1Å
557	M	94.5	Very high	93.5	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-57.5	-51.1	178.5	-73.2	174.3	60.5	0	0	111.8	L263 L266 W267 L270 L493 C553 L559 L560 I561	L263-M557 HydrophobicContact CD2-CE 4.47Å; L263-M557 HydrophobicContact CD2-SD 4.08Å; L266-M557 HydrophobicContact CB-CE 4.37Å; L266-M557 HydrophobicContact CD2-CE 3.47Å; L266-M557 VanDerWaalsContact CD2-CE 3.47Å; L266-M557 HydrophobicContact CG-CE 3.63Å; W267-M557 HydrophobicContact CB-CG 3.63Å; W267-M557 HydrophobicContact CB-SD 3.96Å; W267-M557 HydrophobicContact CG-CG 3.91Å; L270-M557 HydrophobicContact CD1-CE 4.04Å; L270-M557 HydrophobicContact CD1-CG 4.32Å; L493-M557 HydrophobicContact CD2-CE 4.43Å; C553-M557 WeakPolarHBondContact O-CB 3.3Å; C553-M557 VanDerWaalsContact O-CG 3.26Å; C553-M557 WeakPolarHBondContact O-CG 3.42Å; C553-M557 PolarHBondContact O-N 3.28Å; M557-L559 VanDerWaalsContact C-N 3.28Å; M557-L559 PolarHBondContact O-N 2.94Å; M557-L560 PolarHBondContact O-N 2.8Å; M557-I561 VanDerWaalsContact O-CG1 3.3Å; M557-I561 WeakPolarHBondContact O-CG1 3.34Å; M557-I561 PolarHBondContact O-N 3.13Å
558	L	95.1	Very high	93.6	Very high	6 Å²	6	7.1 Å²	7.1	3%	0.031	3%	0.034	C	C	.	.	H	α-helix	trans	-59	-42.5	178.4	-75.6	176.3	0	0	0	111.3	L493 V554 A556 L562 L580 I624	L493-L558 HydrophobicContact CB-CD2 4.33Å; L493-L558 HydrophobicContact CD1-CD2 3.63Å; L493-L558 HydrophobicContact CD1-CG 4.21Å; V554-L558 HydrophobicContact CG1-CD1 3.87Å; V554-L558 HydrophobicContact CG1-CG 4.31Å; V554-L558 WeakPolarHBondContact O-CB 3.44Å; V554-L558 VanDerWaalsContact O-CG 3.28Å; V554-L558 WeakPolarHBondContact O-CG 3.33Å; V554-L558 PolarHBondContact O-N 2.81Å; A556-L558 PolarHBondContact O-N 2.69Å; L558-L562 VanDerWaalsContact O-CB 3.27Å; L558-L562 WeakPolarHBondContact O-CB 3.5Å; L558-L562 WeakPolarHBondContact O-CG 3.33Å; L558-L562 PolarHBondContact O-N 3.32Å; L558-L580 HydrophobicContact CD1-CD2 4.31Å; L558-L580 HydrophobicContact CD2-CD2 4.03Å; L558-I624 HydrophobicContact CB-CD1 3.79Å
559	L	95.8	Very high	93.7	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-69.1	-38.6	-179.3	-175.9	56.5	0	0	0	112.6	S555 A556 M557 K563 N620 R623 I624 K627	S555-L559 VanDerWaalsContact O-CB 3.23Å; S555-L559 WeakPolarHBondContact O-CB 3.48Å; S555-L559 PolarHBondContact O-N 2.99Å; S555-L559 VanDerWaalsContact O-N 3.14Å; A556-L559 PolarHBondContact O-N 3.45Å; M557-L559 VanDerWaalsContact C-N 3.28Å; M557-L559 PolarHBondContact O-N 2.94Å; L559-K563 HydrophobicContact CD1-CD 4.35Å; L559-K563 HydrophobicContact CD1-CG 4.39Å; L559-K563 HydrophobicContact CG-CD 4.2Å; L559-K563 WeakPolarHBondContact O-CB 3.36Å; L559-K563 VanDerWaalsContact O-CG 3.24Å; L559-K563 WeakPolarHBondContact O-CG 3.46Å; L559-K563 PolarHBondContact O-N 3.2Å; L559-N620 HydrophobicContact CD2-CB 4.05Å; L559-N620 WeakPolarHBondContact CD2-OD1 3.46Å; L559-R623 HydrophobicContact CD1-CB 3.92Å; L559-R623 HydrophobicContact CD2-CB 3.86Å; L559-I624 HydrophobicContact CB-CD1 4.19Å; L559-I624 HydrophobicContact CB-CG1 3.97Å; L559-I624 HydrophobicContact CD1-CG1 4.03Å; L559-K627 HydrophobicContact CD1-CD 3.8Å
560	L	94.9	Very high	93.7	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.2	-54.3	176.1	-173.2	68.5	0	0	0	110.2	L270 L271 L274 A556 M557 L562 K563 H564	L270-L560 HydrophobicContact CB-CD2 4.01Å; L271-L560 HydrophobicContact CD2-CD1 4.24Å; L271-L560 HydrophobicContact CD2-CD2 3.85Å; L271-L560 HydrophobicContact CG-CD2 4.24Å; L274-L560 HydrophobicContact CD1-CD2 4.04Å; L274-L560 HydrophobicContact CD1-CG 4.06Å; A556-L560 WeakPolarHBondContact O-CB 3.48Å; A556-L560 PolarHBondContact O-N 2.92Å; M557-L560 PolarHBondContact O-N 2.8Å; L560-L562 VanDerWaalsContact C-N 3.34Å; L560-L562 PolarHBondContact O-N 3.12Å; L560-K563 PolarHBondContact O-N 2.86Å; L560-H564 PolarHBondContact O-CD2 2.92Å; L560-H564 PolarHBondContact O-N 3.43Å
561	I	94.1	Very high	93.7	Very high	6 Å²	6	12 Å²	12	3%	0.031	5%	0.054	C	C	.	.	H	α-helix	trans	-55	-49.3	177.4	-66.1	167.1	0	0	0	110.3	L270 I482 M557 K563 H564 L565 I576	L270-I561 HydrophobicContact CD1-CD1 4.32Å; L270-I561 HydrophobicContact CD1-CG1 4.5Å; I482-I561 HydrophobicContact CD1-CD1 4.25Å; M557-I561 VanDerWaalsContact O-CG1 3.3Å; M557-I561 WeakPolarHBondContact O-CG1 3.34Å; M557-I561 PolarHBondContact O-N 3.13Å; I561-K563 PolarHBondContact O-N 3.21Å; I561-H564 PolarHBondContact O-N 3.31Å; I561-L565 HydrophobicContact CG2-CD1 3.71Å; I561-L565 HydrophobicContact CG2-CG 4.21Å; I561-L565 WeakPolarHBondContact O-CB 3.14Å; I561-L565 WeakPolarHBondContact O-CG 3.26Å; I561-L565 PolarHBondContact O-N 3.48Å; I561-I576 HydrophobicContact CG2-CD1 3.82Å
562	L	95.5	Very high	93.7	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-64.7	-22.8	178.7	-73.3	176.3	0	0	0	114.2	L558 L560 K566 F573 I576 C577 L580 I624 K627	L558-L562 VanDerWaalsContact O-CB 3.27Å; L558-L562 WeakPolarHBondContact O-CB 3.5Å; L558-L562 WeakPolarHBondContact O-CG 3.33Å; L558-L562 PolarHBondContact O-N 3.32Å; L560-L562 VanDerWaalsContact C-N 3.34Å; L560-L562 PolarHBondContact O-N 3.12Å; L562-K566 VanDerWaalsContact O-CB 3.32Å; L562-K566 WeakPolarHBondContact O-CB 3.33Å; L562-F573 HydrophobicContact CB-CD2 4.4Å; L562-F573 HydrophobicContact CB-CE2 4.26Å; L562-F573 HydrophobicContact CD2-CD2 3.99Å; L562-F573 HydrophobicContact CD2-CE2 3.99Å; L562-F573 WeakPolarHBondContact O-CD2 3.38Å; L562-I576 HydrophobicContact CD2-CB 4.36Å; L562-I576 HydrophobicContact CD2-CG2 3.93Å; L562-C577 VanDerWaalsContact CD2-SG 3.59Å; L562-L580 HydrophobicContact CD1-CD1 3.86Å; L562-L580 HydrophobicContact CD2-CD1 4.14Å; L562-L580 HydrophobicContact CG-CD1 4.35Å; L562-I624 HydrophobicContact CD1-CG1 4.33Å; L562-I624 HydrophobicContact CD1-CG2 4.04Å; L562-K627 HydrophobicContact CB-CD 4.33Å
563	K	94.3	Very high	93.8	Very high	28 Å²	28	13 Å²	13	12%	0.122	6%	0.058	C	C	.	.	H	α-helix	trans	-83.5	-48.4	175.5	-76.1	167.1	122.7	-160.1	0	110.9	W277 L280 L559 L560 I561 K566 V567	W277-K563 VanDerWaalsContact CE3-NZ 3.3Å; L280-K563 HydrophobicContact CD2-CB 3.34Å; L280-K563 HydrophobicContact CD2-CD 3.7Å; L280-K563 HydrophobicContact CD2-CG 4.05Å; L280-K563 HydrophobicContact CG-CB 4.46Å; L559-K563 HydrophobicContact CD1-CD 4.35Å; L559-K563 HydrophobicContact CD1-CG 4.39Å; L559-K563 HydrophobicContact CG-CD 4.2Å; L559-K563 WeakPolarHBondContact O-CB 3.36Å; L559-K563 VanDerWaalsContact O-CG 3.24Å; L559-K563 WeakPolarHBondContact O-CG 3.46Å; L559-K563 PolarHBondContact O-N 3.2Å; L560-K563 PolarHBondContact O-N 2.86Å; I561-K563 PolarHBondContact O-N 3.21Å; K563-K566 PolarHBondContact O-N 2.97Å; K563-V567 WeakPolarHBondContact O-CG2 3.18Å; K563-V567 PolarHBondContact O-N 3.49Å; K563-V567 VanDerWaalsContact O-N 3.11Å
564	H	93.8	Very high	93.8	Very high	3 Å²	3	14.8 Å²	14.8	1%	0.014	7%	0.067	C	C	.	.	H	α-helix	trans	-61.5	-49.5	179.7	-82.7	-86.3	0	0	0	111.4	L274 S475 L560 I561 K566 V567 N568	L274-H564 HydrophobicContact CD1-CB 4.34Å; L274-H564 PolarHBondContact O-CE1 3.34Å; S475-H564 PolarHBondContact OG-ND1 3.35Å; L560-H564 PolarHBondContact O-CD2 2.92Å; L560-H564 PolarHBondContact O-N 3.43Å; I561-H564 PolarHBondContact O-N 3.31Å; H564-K566 PolarHBondContact O-N 3.4Å; H564-V567 CarbonylContact O-C 3.4Å; H564-V567 PolarHBondContact O-N 2.89Å; H564-N568 WeakPolarHBondContact O-CB 3.14Å; H564-N568 PolarHBondContact O-N 2.98Å
565	L	93	Very high	93.8	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-62	-32.3	177.9	-64.4	-177.7	0	0	0	112.6	Y479 I561 V567 N568 H569 Q572 F573 I576	Y479-L565 HydrophobicContact CD2-CD1 4.06Å; Y479-L565 HydrophobicContact CD2-CD2 3.78Å; Y479-L565 HydrophobicContact CG-CD2 4.13Å; I561-L565 HydrophobicContact CG2-CD1 3.71Å; I561-L565 HydrophobicContact CG2-CG 4.21Å; I561-L565 WeakPolarHBondContact O-CB 3.14Å; I561-L565 WeakPolarHBondContact O-CG 3.26Å; I561-L565 PolarHBondContact O-N 3.48Å; L565-V567 VanDerWaalsContact C-N 3.35Å; L565-N568 PolarHBondContact O-N 3.22Å; L565-H569 CarbonylContact O-C 3.6Å; L565-H569 VanDerWaalsContact O-C 3.29Å; L565-H569 PolarHBondContact O-N 3.39Å; L565-Q572 HydrophobicContact CB-CB 4.37Å; L565-Q572 HydrophobicContact CD2-CB 4.43Å; L565-F573 HydrophobicContact CB-CB 4.4Å; L565-I576 HydrophobicContact CD1-CD1 3.22Å; L565-I576 HydrophobicContact CD1-CG1 3.91Å
566	K	93.1	Very high	93.8	Very high	50 Å²	50	18.7 Å²	18.7	22%	0.217	9%	0.085	C	C	.	.	H	α-helix	trans	-69.3	-34.2	176.2	-175.6	167.5	-174.9	137.8	0	112.8	L562 K563 H564 F573	L562-K566 VanDerWaalsContact O-CB 3.32Å; L562-K566 WeakPolarHBondContact O-CB 3.33Å; K563-K566 PolarHBondContact O-N 2.97Å; H564-K566 PolarHBondContact O-N 3.4Å; K566-F573 HydrophobicContact CB-CB 3.98Å; K566-F573 HydrophobicContact CB-CD2 3.72Å; K566-F573 HydrophobicContact CB-CE2 4.38Å; K566-F573 HydrophobicContact CB-CG 3.85Å; K566-F573 HydrophobicContact CD-CD1 4.46Å; K566-F573 HydrophobicContact CD-CD2 4.25Å; K566-F573 HydrophobicContact CD-CE1 4.4Å; K566-F573 HydrophobicContact CD-CE2 4.16Å; K566-F573 HydrophobicContact CD-CG 4.37Å; K566-F573 HydrophobicContact CD-CZ 4.24Å; K566-F573 HydrophobicContact CG-CD2 4.33Å; K566-F573 HydrophobicContact CG-CG 4.2Å
567	V	91.2	Very high	93.8	Very high	9 Å²	9	18.5 Å²	18.5	6%	0.055	8%	0.084	C	C	.	.	H	α-helix	trans	-76.3	-33.6	175.3	174.4	0	0	0	0	110.1	L280 L283 K284 K287 Q451 K563 H564 L565	L280-V567 HydrophobicContact CD1-CB 4.36Å; L280-V567 HydrophobicContact CD1-CG2 3.9Å; L283-V567 HydrophobicContact CD2-CG1 4.29Å; L283-V567 HydrophobicContact CG-CG1 4.16Å; K284-V567 HydrophobicContact CB-CG1 4.29Å; K284-V567 HydrophobicContact CB-CG2 3.83Å; K284-V567 HydrophobicContact CD-CG2 4.19Å; K284-V567 HydrophobicContact CG-CG2 4.01Å; K287-V567 HydrophobicContact CD-CG1 3.82Å; K287-V567 WeakPolarHBondContact CD-O 3.4Å; K287-V567 HydrophobicContact CG-CG1 4.49Å; Q451-V567 PolarHBondContact NE2-O 2.95Å; K563-V567 WeakPolarHBondContact O-CG2 3.18Å; K563-V567 PolarHBondContact O-N 3.49Å; K563-V567 VanDerWaalsContact O-N 3.11Å; H564-V567 CarbonylContact O-C 3.4Å; H564-V567 PolarHBondContact O-N 2.89Å; L565-V567 VanDerWaalsContact C-N 3.35Å
568	N	90.4	Very high	93.8	Very high	11 Å²	11	21.4 Å²	21.4	6%	0.059	10%	0.097	C	C	.	.	H	α-helix	trans	-68.9	-70.3	174.7	-162.5	43	0	0	0	111.7	Q451 E476 H564 L565 Q572	Q451-N568 PolarHBondContact NE2-O 3.41Å; E476-N568 PolarHBondContact OE2-ND2 3.08Å; H564-N568 WeakPolarHBondContact O-CB 3.14Å; H564-N568 PolarHBondContact O-N 2.98Å; L565-N568 PolarHBondContact O-N 3.22Å; N568-Q572 PolarHBondContact ND2-OE1 3.17Å
569	H	91.3	Very high	93.8	Very high	26 Å²	26	22.3 Å²	22.3	12%	0.12	10%	0.101	C	C	.	.			trans	-148.7	131.9	176.5	-156.3	-112.7	0	0	0	113.8	E455 L565 Y571 Q572 F573	E455-H569 IonicContact OE2-CE1 3.47Å; E455-H569 IonicContact OE2-NE2 3.18Å; L565-H569 CarbonylContact O-C 3.6Å; L565-H569 VanDerWaalsContact O-C 3.29Å; L565-H569 PolarHBondContact O-N 3.39Å; H569-Y571 VanDerWaalsContact C-N 3.27Å; H569-Y571 AromaticContact CE1-CD2 3.32Å; H569-Y571 WeakPolarHBondContact CE1-CD2 3.47Å; H569-Y571 AromaticContact CE1-CE2 3.9Å; H569-Y571 AromaticContact ND1-CD2 3.76Å; H569-Y571 PolarHBondContact O-N 3.24Å; H569-Q572 HydrophobicContact CB-CB 4.42Å; H569-Q572 HydrophobicContact CB-CG 3.94Å; H569-Q572 PolarHBondContact O-N 3.26Å; H569-F573 PolarHBondContact O-N 3.33Å; H569-F573 VanDerWaalsContact O-N 3.16Å
570	I	92.2	Very high	93.8	Very high	14 Å²	14	22.3 Å²	22.3	7%	0.072	10%	0.101	C	C	.	.	H	α-helix	trans	-58.5	-33.3	-177.7	-173.8	55.7	0	0	0	114.1	Q451 I452 F573 E574	Q451-I570 HydrophobicContact CB-CB 4.39Å; Q451-I570 HydrophobicContact CB-CG2 3.77Å; I452-I570 HydrophobicContact CD1-CG1 4.33Å; I452-I570 HydrophobicContact CG1-CG1 4.42Å; I452-I570 HydrophobicContact CG1-CG2 3.77Å; I570-F573 HydrophobicContact CD1-CD1 3.79Å; I570-F573 HydrophobicContact CD1-CE1 4.4Å; I570-E574 WeakPolarHBondContact O-CB 3.47Å; I570-E574 PolarHBondContact O-N 3.11Å
571	Y	92.7	Very high	93.8	Very high	91 Å²	91	23.2 Å²	23.2	36%	0.357	11%	0.107	S	C	.	.	H	α-helix	trans	-75.2	-35.3	178.5	-61.3	-46.1	0	0	0	113.2	I452 E455 H569 F573 E574 Q575	I452-Y571 HydrophobicContact CG1-CE1 4.46Å; E455-Y571 HydrophobicContact CB-CE2 3.81Å; E455-Y571 HydrophobicContact CG-CE2 3.59Å; H569-Y571 VanDerWaalsContact C-N 3.27Å; H569-Y571 AromaticContact CE1-CD2 3.32Å; H569-Y571 WeakPolarHBondContact CE1-CD2 3.47Å; H569-Y571 AromaticContact CE1-CE2 3.9Å; H569-Y571 AromaticContact ND1-CD2 3.76Å; H569-Y571 PolarHBondContact O-N 3.24Å; Y571-F573 VanDerWaalsContact C-N 3.31Å; Y571-F573 PolarHBondContact O-N 2.97Å; Y571-E574 PolarHBondContact O-N 2.95Å; Y571-Q575 WeakPolarHBondContact O-CB 2.99Å; Y571-Q575 PolarHBondContact O-N 2.83Å
572	Q	93.5	Very high	93.8	Very high	16 Å²	16	28.6 Å²	28.6	8%	0.075	13%	0.13	C	C	.	.	H	α-helix	trans	-60.8	-44.5	172.2	-63.2	173.8	-13.2	0	0	110.4	E476 Y479 L565 N568 H569 Q575 I576	E476-Q572 PolarHBondContact OE1-NE2 3.14Å; E476-Q572 PolarHBondContact OE2-NE2 3.28Å; Y479-Q572 HydrophobicContact CD1-CG 3.94Å; Y479-Q572 HydrophobicContact CD2-CB 4Å; Y479-Q572 HydrophobicContact CD2-CG 4.13Å; Y479-Q572 HydrophobicContact CE1-CB 4.45Å; Y479-Q572 HydrophobicContact CE1-CG 3.68Å; Y479-Q572 HydrophobicContact CE2-CB 3.71Å; Y479-Q572 HydrophobicContact CE2-CG 3.88Å; Y479-Q572 HydrophobicContact CG-CB 4.47Å; Y479-Q572 HydrophobicContact CG-CG 4.15Å; L565-Q572 HydrophobicContact CB-CB 4.37Å; L565-Q572 HydrophobicContact CD2-CB 4.43Å; N568-Q572 PolarHBondContact ND2-OE1 3.17Å; H569-Q572 HydrophobicContact CB-CB 4.42Å; H569-Q572 HydrophobicContact CB-CG 3.94Å; H569-Q572 PolarHBondContact O-N 3.26Å; Q572-Q575 PolarHBondContact O-N 2.97Å; Q572-I576 PolarHBondContact O-N 3.42Å
573	F	94.8	Very high	93.6	Very high	4 Å²	4	29 Å²	29	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-58.9	-47.8	172.6	163.7	-95	0	0	0	112.6	L562 L565 K566 H569 I570 Y571 Q575 I576 C577 K627	L562-F573 HydrophobicContact CB-CD2 4.4Å; L562-F573 HydrophobicContact CB-CE2 4.26Å; L562-F573 HydrophobicContact CD2-CD2 3.99Å; L562-F573 HydrophobicContact CD2-CE2 3.99Å; L562-F573 WeakPolarHBondContact O-CD2 3.38Å; L565-F573 HydrophobicContact CB-CB 4.4Å; K566-F573 HydrophobicContact CB-CB 3.98Å; K566-F573 HydrophobicContact CB-CD2 3.72Å; K566-F573 HydrophobicContact CB-CE2 4.38Å; K566-F573 HydrophobicContact CB-CG 3.85Å; K566-F573 HydrophobicContact CD-CD1 4.46Å; K566-F573 HydrophobicContact CD-CD2 4.25Å; K566-F573 HydrophobicContact CD-CE1 4.4Å; K566-F573 HydrophobicContact CD-CE2 4.16Å; K566-F573 HydrophobicContact CD-CG 4.37Å; K566-F573 HydrophobicContact CD-CZ 4.24Å; K566-F573 HydrophobicContact CG-CD2 4.33Å; K566-F573 HydrophobicContact CG-CG 4.2Å; H569-F573 PolarHBondContact O-N 3.33Å; H569-F573 VanDerWaalsContact O-N 3.16Å; I570-F573 HydrophobicContact CD1-CD1 3.79Å; I570-F573 HydrophobicContact CD1-CE1 4.4Å; Y571-F573 VanDerWaalsContact C-N 3.31Å; Y571-F573 PolarHBondContact O-N 2.97Å; F573-Q575 VanDerWaalsContact C-N 3.29Å; F573-Q575 PolarHBondContact O-N 3.44Å; F573-I576 PolarHBondContact O-N 3.08Å; F573-C577 WeakPolarHBondContact CE2-SG 3.22Å; F573-C577 WeakPolarHBondContact CZ-SG 3.41Å; F573-C577 WeakPolarHBondContact O-CB 3.25Å; F573-C577 PolarHBondContact O-N 3.44Å; F573-C577 PolarHBondContact O-SG 3.11Å; F573-K627 HydrophobicContact CE2-CB 4.32Å; F573-K627 HydrophobicContact CZ-CB 4.22Å
574	E	94.5	Very high	93.5	Very high	39 Å²	39	32.2 Å²	32.2	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-65.9	-35.2	-177.4	-174.1	64	-166.4	0	0	111.5	I570 Y571 C577 Q578 K632 R635	I570-E574 WeakPolarHBondContact O-CB 3.47Å; I570-E574 PolarHBondContact O-N 3.11Å; Y571-E574 PolarHBondContact O-N 2.95Å; E574-C577 WeakPolarHBondContact O-CB 3.33Å; E574-C577 PolarHBondContact O-N 3.26Å; E574-Q578 WeakPolarHBondContact O-CB 3.32Å; E574-Q578 PolarHBondContact O-N 3.24Å; E574-K632 WeakPolarHBondContact OE1-CE 3.4Å; E574-K632 IonicContact OE1-NZ 2.71Å; E574-K632 PolarHBondContact OE1-NZ 3.36Å; E574-K632 WeakPolarHBondContact OE2-CE 3.48Å; E574-K632 IonicContact OE2-NZ 3.61Å; E574-K632 PolarHBondContact OE2-NZ 3.19Å; E574-R635 IonicContact OE1-CZ 2.74Å; E574-R635 IonicContact OE1-NH1 2.81Å; E574-R635 PolarHBondContact OE1-NH1 3.36Å; E574-R635 IonicContact OE1-NH2 3.97Å; E574-R635 PolarHBondContact OE1-NH2 2.8Å; E574-R635 IonicContact OE2-NH1 3.15Å
575	Q	94.2	Very high	93.5	Very high	76 Å²	76	32.1 Å²	32.1	36%	0.355	15%	0.152	S	C	.	.	H	α-helix	trans	-62.3	-48.8	177.9	-174.9	171.3	-13.5	0	0	111.7	Y479 M486 Y571 Q572 F573 Q578 Q579	Y479-Q575 PolarHBondContact OH-OE1 3.38Å; M486-Q575 HydrophobicContact CE-CG 3.64Å; M486-Q575 VanDerWaalsContact CE-NE2 3.31Å; M486-Q575 HydrophobicContact SD-CG 3.73Å; Y571-Q575 WeakPolarHBondContact O-CB 2.99Å; Y571-Q575 PolarHBondContact O-N 2.83Å; Q572-Q575 PolarHBondContact O-N 2.97Å; F573-Q575 VanDerWaalsContact C-N 3.29Å; F573-Q575 PolarHBondContact O-N 3.44Å; Q575-Q578 PolarHBondContact O-N 3.04Å; Q575-Q579 WeakPolarHBondContact O-CG 3.49Å; Q575-Q579 PolarHBondContact O-N 2.84Å; Q575-Q579 VanDerWaalsContact O-N 3.14Å
576	I	95.2	Very high	93.5	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-65.2	-41.4	174.2	-63.4	-159.2	0	0	0	111.3	M486 I561 L562 L565 Q572 F573 Q578 Q579 L580	M486-I576 HydrophobicContact CG-CD1 4.36Å; M486-I576 HydrophobicContact CG-CG1 4.04Å; M486-I576 HydrophobicContact SD-CG1 3.72Å; I561-I576 HydrophobicContact CG2-CD1 3.82Å; L562-I576 HydrophobicContact CD2-CB 4.36Å; L562-I576 HydrophobicContact CD2-CG2 3.93Å; L565-I576 HydrophobicContact CD1-CD1 3.22Å; L565-I576 HydrophobicContact CD1-CG1 3.91Å; Q572-I576 PolarHBondContact O-N 3.42Å; F573-I576 PolarHBondContact O-N 3.08Å; I576-Q578 VanDerWaalsContact C-N 3.25Å; I576-Q578 PolarHBondContact O-N 3.42Å; I576-Q579 PolarHBondContact O-N 3.44Å; I576-Q579 VanDerWaalsContact O-N 3.16Å; I576-L580 HydrophobicContact CG2-CD1 4.22Å; I576-L580 HydrophobicContact CG2-CG 4.46Å; I576-L580 PolarHBondContact O-N 3.5Å
577	C	95.4	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58	-40.5	176.2	-72.7	0	0	0	0	112.1	L562 F573 E574 L580 V581 L628	L562-C577 VanDerWaalsContact CD2-SG 3.59Å; F573-C577 WeakPolarHBondContact CE2-SG 3.22Å; F573-C577 WeakPolarHBondContact CZ-SG 3.41Å; F573-C577 WeakPolarHBondContact O-CB 3.25Å; F573-C577 PolarHBondContact O-N 3.44Å; F573-C577 PolarHBondContact O-SG 3.11Å; E574-C577 WeakPolarHBondContact O-CB 3.33Å; E574-C577 PolarHBondContact O-N 3.26Å; C577-L580 PolarHBondContact O-N 3.4Å; C577-V581 WeakPolarHBondContact O-CG2 3.27Å; C577-V581 PolarHBondContact O-N 2.97Å; C577-L628 HydrophobicContact CB-CD2 3.78Å
578	Q	94.7	Very high	93.5	Very high	61 Å²	61	31.6 Å²	31.6	29%	0.285	15%	0.153	S	C	.	.	H	α-helix	trans	-65.9	-41.7	178	-170.2	62.4	28.7	0	0	111.1	E574 Q575 I576 L580 V581 F582	E574-Q578 WeakPolarHBondContact O-CB 3.32Å; E574-Q578 PolarHBondContact O-N 3.24Å; Q575-Q578 PolarHBondContact O-N 3.04Å; I576-Q578 VanDerWaalsContact C-N 3.25Å; I576-Q578 PolarHBondContact O-N 3.42Å; Q578-L580 VanDerWaalsContact C-N 3.35Å; Q578-L580 PolarHBondContact O-N 2.88Å; Q578-V581 PolarHBondContact O-N 3.27Å; Q578-F582 HydrophobicContact CG-CD2 3.94Å; Q578-F582 HydrophobicContact CG-CE2 3.48Å; Q578-F582 VanDerWaalsContact CG-CE2 3.48Å; Q578-F582 HydrophobicContact CG-CZ 3.92Å; Q578-F582 VanDerWaalsContact O-CD2 3.31Å; Q578-F582 WeakPolarHBondContact O-CD2 3.25Å; Q578-F582 WeakPolarHBondContact O-CG 3.41Å; Q578-F582 PolarHBondContact O-N 2.86Å
579	Q	95	Very high	93.6	Very high	24 Å²	24	31.1 Å²	31.1	11%	0.112	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-40.4	173.8	-60.5	-46.6	-60	0	0	112.1	M486 T490 Q575 I576 V581 F582 A583	M486-Q579 HydrophobicContact CE-CG 3.73Å; M486-Q579 HydrophobicContact SD-CG 4.31Å; T490-Q579 HydrophobicContact CG2-CB 3.89Å; Q575-Q579 WeakPolarHBondContact O-CG 3.49Å; Q575-Q579 PolarHBondContact O-N 2.84Å; Q575-Q579 VanDerWaalsContact O-N 3.14Å; I576-Q579 PolarHBondContact O-N 3.44Å; I576-Q579 VanDerWaalsContact O-N 3.16Å; Q579-V581 VanDerWaalsContact C-N 3.34Å; Q579-V581 PolarHBondContact O-N 3.1Å; Q579-F582 PolarHBondContact O-N 3.31Å; Q579-A583 WeakPolarHBondContact O-CB 3.46Å; Q579-A583 PolarHBondContact O-N 2.97Å
580	L	96.1	Very high	93.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.1	-77.1	169.2	0	0	0	112.1	T490 V494 L558 L562 I576 C577 Q578 A583 C585 L628	T490-L580 HydrophobicContact CG2-CB 4.2Å; T490-L580 HydrophobicContact CG2-CD2 3.35Å; T490-L580 HydrophobicContact CG2-CG 3.48Å; T490-L580 VanDerWaalsContact CG2-CG 3.48Å; V494-L580 HydrophobicContact CG2-CD2 3.75Å; L558-L580 HydrophobicContact CD1-CD2 4.31Å; L558-L580 HydrophobicContact CD2-CD2 4.03Å; L562-L580 HydrophobicContact CD1-CD1 3.86Å; L562-L580 HydrophobicContact CD2-CD1 4.14Å; L562-L580 HydrophobicContact CG-CD1 4.35Å; I576-L580 HydrophobicContact CG2-CD1 4.22Å; I576-L580 HydrophobicContact CG2-CG 4.46Å; I576-L580 PolarHBondContact O-N 3.5Å; C577-L580 PolarHBondContact O-N 3.4Å; Q578-L580 VanDerWaalsContact C-N 3.35Å; Q578-L580 PolarHBondContact O-N 2.88Å; L580-A583 PolarHBondContact O-N 3.14Å; L580-C585 HydrophobicContact CB-CB 4.14Å; L580-C585 HydrophobicContact CD2-CB 4.34Å; L580-C585 WeakPolarHBondContact O-CB 3.43Å; L580-C585 PolarHBondContact O-N 2.91Å; L580-L628 HydrophobicContact CB-CD2 4.16Å; L580-L628 HydrophobicContact CD1-CD2 4.09Å
581	V	94.6	Very high	93.5	Very high	20 Å²	20	34.7 Å²	34.7	12%	0.121	17%	0.165	C	C	.	.	H	α-helix	trans	-67.1	-43.4	177.3	173.1	0	0	0	0	110.7	C577 Q578 Q579 A583 N584 I586 L628 M638	C577-V581 WeakPolarHBondContact O-CG2 3.27Å; C577-V581 PolarHBondContact O-N 2.97Å; Q578-V581 PolarHBondContact O-N 3.27Å; Q579-V581 VanDerWaalsContact C-N 3.34Å; Q579-V581 PolarHBondContact O-N 3.1Å; V581-A583 PolarHBondContact O-N 3.27Å; V581-N584 PolarHBondContact O-N 3Å; V581-N584 VanDerWaalsContact O-N 3.1Å; V581-I586 HydrophobicContact CG2-CD1 4.06Å; V581-L628 HydrophobicContact CG2-CD2 4.42Å; V581-M638 HydrophobicContact CG1-SD 4.37Å
582	F	93.7	Very high	93.3	Very high	119 Å²	119	30.5 Å²	30.5	52%	0.522	15%	0.149	S	C	.	.	H	α-helix	trans	-63.2	-30.6	173.6	-69.1	-37.1	0	0	0	113.1	Q578 Q579 N584	Q578-F582 HydrophobicContact CG-CD2 3.94Å; Q578-F582 HydrophobicContact CG-CE2 3.48Å; Q578-F582 VanDerWaalsContact CG-CE2 3.48Å; Q578-F582 HydrophobicContact CG-CZ 3.92Å; Q578-F582 VanDerWaalsContact O-CD2 3.31Å; Q578-F582 WeakPolarHBondContact O-CD2 3.25Å; Q578-F582 WeakPolarHBondContact O-CG 3.41Å; Q578-F582 PolarHBondContact O-N 2.86Å; Q579-F582 PolarHBondContact O-N 3.31Å; F582-N584 PolarHBondContact O-N 3.41Å
583	A	91.7	Very high	93	Very high	8 Å²	8	29.8 Å²	29.8	7%	0.066	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	8	174.1	0	0	0	0	0	114	F491 V494 Q579 L580 V581 C585	F491-A583 HydrophobicContact CD2-CB 3.55Å; F491-A583 HydrophobicContact CE2-CB 4.18Å; F491-A583 HydrophobicContact CG-CB 4.42Å; V494-A583 HydrophobicContact CB-CB 4.13Å; V494-A583 HydrophobicContact CG1-CB 4.27Å; V494-A583 WeakPolarHBondContact CG1-O 3.5Å; V494-A583 HydrophobicContact CG2-CB 3.91Å; Q579-A583 WeakPolarHBondContact O-CB 3.46Å; Q579-A583 PolarHBondContact O-N 2.97Å; L580-A583 PolarHBondContact O-N 3.14Å; V581-A583 PolarHBondContact O-N 3.27Å; A583-C585 VanDerWaalsContact C-N 3.27Å; A583-C585 PolarHBondContact O-N 3.45Å
584	N	91.6	Very high	92.5	Very high	97 Å²	97	32.5 Å²	32.5	52%	0.519	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	31.5	-176.4	-67.1	-40.1	0	0	0	114.2	V581 F582 I586 P587 L588	V581-N584 PolarHBondContact O-N 3Å; V581-N584 VanDerWaalsContact O-N 3.1Å; F582-N584 PolarHBondContact O-N 3.41Å; N584-I586 VanDerWaalsContact C-N 3.33Å; N584-I586 PolarHBondContact O-N 3.27Å; N584-P587 HydrophobicContact CB-CG 3.96Å; N584-P587 VanDerWaalsContact O-CD 3.27Å; N584-P587 WeakPolarHBondContact O-CD 3.31Å; N584-P587 WeakPolarHBondContact O-CG 3.43Å; N584-L588 WeakPolarHBondContact O-CB 2.98Å; N584-L588 PolarHBondContact O-N 3.21Å
585	C	94	Very high	91.9	Very high	1 Å²	1	32 Å²	32	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-37.1	178.5	-172.9	0	0	0	0	112.9	V494 L580 A583 L588 I589	V494-C585 HydrophobicContact CG2-CB 4.12Å; L580-C585 HydrophobicContact CB-CB 4.14Å; L580-C585 HydrophobicContact CD2-CB 4.34Å; L580-C585 WeakPolarHBondContact O-CB 3.43Å; L580-C585 PolarHBondContact O-N 2.91Å; A583-C585 VanDerWaalsContact C-N 3.27Å; A583-C585 PolarHBondContact O-N 3.45Å; C585-L588 PolarHBondContact O-N 3.4Å; C585-I589 VanDerWaalsContact O-CG1 3.28Å; C585-I589 WeakPolarHBondContact O-CG1 3.2Å; C585-I589 PolarHBondContact O-N 3.31Å
586	I	94	Very high	91	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.015	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-58.9	-179.8	-67	177.3	0	0	0	112.1	V581 N584 L588 I589 L590 L625 L628 T629 R635 L639 Y642	V581-I586 HydrophobicContact CG2-CD1 4.06Å; N584-I586 VanDerWaalsContact C-N 3.33Å; N584-I586 PolarHBondContact O-N 3.27Å; I586-L588 VanDerWaalsContact C-N 3.26Å; I586-L588 PolarHBondContact O-N 3.29Å; I586-I589 PolarHBondContact O-N 3.49Å; I586-L590 HydrophobicContact CG2-CD1 4.3Å; I586-L590 WeakPolarHBondContact O-CG 3.32Å; I586-L590 PolarHBondContact O-N 2.76Å; I586-L590 VanDerWaalsContact O-N 3.12Å; I586-L625 HydrophobicContact CB-CD1 4.35Å; I586-L625 HydrophobicContact CG1-CD1 3.98Å; I586-L625 HydrophobicContact CG2-CD1 4.13Å; I586-L628 HydrophobicContact CG1-CD1 4.16Å; I586-T629 HydrophobicContact CD1-CG2 4.38Å; I586-R635 HydrophobicContact CD1-CB 4.42Å; I586-L639 HydrophobicContact CG2-CD2 3.74Å; I586-Y642 HydrophobicContact CG2-CD2 4.15Å; I586-Y642 HydrophobicContact CG2-CE2 4.44Å
587	P	92.8	Very high	89.6	Confident	34 Å²	34	29.8 Å²	29.8	22%	0.221	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-33.4	178.5	24.3	-34	0	0	0	112.1	N584 L590 K591 Y642	N584-P587 HydrophobicContact CB-CG 3.96Å; N584-P587 VanDerWaalsContact O-CD 3.27Å; N584-P587 WeakPolarHBondContact O-CD 3.31Å; N584-P587 WeakPolarHBondContact O-CG 3.43Å; P587-L590 PolarHBondContact O-N 2.89Å; P587-K591 WeakPolarHBondContact O-CB 3.15Å; P587-K591 PolarHBondContact O-N 3.17Å; P587-Y642 HydrophobicContact CB-CD1 4.25Å; P587-Y642 HydrophobicContact CB-CD2 4.45Å; P587-Y642 HydrophobicContact CB-CE1 4Å; P587-Y642 HydrophobicContact CB-CE2 4.23Å; P587-Y642 HydrophobicContact CB-CG 4.48Å; P587-Y642 HydrophobicContact CG-CE1 4.45Å; P587-Y642 HydrophobicContact CG-CE2 4.24Å
588	L	91	Very high	87.8	Confident	14 Å²	14	31.9 Å²	31.9	7%	0.073	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-52.1	173.6	170.3	62.9	0	0	0	111.9	V494 L497 L498 N584 C585 I586 L590 K591 Y592	V494-L588 HydrophobicContact CG1-CD2 3.54Å; V494-L588 WeakPolarHBondContact O-CD2 3.42Å; L497-L588 HydrophobicContact CB-CD2 4.1Å; L497-L588 HydrophobicContact CD2-CD2 3.96Å; L497-L588 HydrophobicContact CG-CD2 4.04Å; L498-L588 HydrophobicContact CB-CD1 3.68Å; L498-L588 HydrophobicContact CB-CD2 4.13Å; L498-L588 HydrophobicContact CD1-CD1 3.4Å; L498-L588 VanDerWaalsContact CD1-CD1 3.4Å; L498-L588 HydrophobicContact CG-CD1 4.06Å; N584-L588 WeakPolarHBondContact O-CB 2.98Å; N584-L588 PolarHBondContact O-N 3.21Å; C585-L588 PolarHBondContact O-N 3.4Å; I586-L588 VanDerWaalsContact C-N 3.26Å; I586-L588 PolarHBondContact O-N 3.29Å; L588-L590 VanDerWaalsContact C-N 3.28Å; L588-L590 PolarHBondContact O-N 3.2Å; L588-K591 PolarHBondContact O-N 3.41Å; L588-Y592 WeakPolarHBondContact O-CB 3.39Å; L588-Y592 PolarHBondContact O-N 3.06Å
589	I	92.9	Very high	85.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-46.4	179.2	-71.4	172.1	0	0	0	109.4	C585 I586 K591 Y592 F593 L621 I624 L625	C585-I589 VanDerWaalsContact O-CG1 3.28Å; C585-I589 WeakPolarHBondContact O-CG1 3.2Å; C585-I589 PolarHBondContact O-N 3.31Å; I586-I589 PolarHBondContact O-N 3.49Å; I589-K591 VanDerWaalsContact C-N 3.33Å; I589-K591 PolarHBondContact O-N 2.96Å; I589-Y592 WeakPolarHBondContact O-CB 3.39Å; I589-Y592 PolarHBondContact O-N 3.27Å; I589-Y592 VanDerWaalsContact O-N 3.14Å; I589-F593 HydrophobicContact CG2-CD2 3.71Å; I589-F593 HydrophobicContact CG2-CE2 3.7Å; I589-F593 VanDerWaalsContact O-CD2 3.26Å; I589-F593 WeakPolarHBondContact O-CD2 3.25Å; I589-F593 PolarHBondContact O-N 3.44Å; I589-L621 HydrophobicContact CD1-CD2 4.36Å; I589-L621 HydrophobicContact CG1-CB 4.48Å; I589-L621 HydrophobicContact CG1-CD2 4.16Å; I589-L621 HydrophobicContact CG2-CB 4.09Å; I589-I624 HydrophobicContact CD1-CG2 4.16Å; I589-L625 HydrophobicContact CD1-CB 4.43Å; I589-L625 HydrophobicContact CG2-CB 4.44Å; I589-L625 HydrophobicContact CG2-CD2 4Å
590	L	91.8	Very high	83.3	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-42.3	179	-66.2	175.9	0	0	0	112.5	I586 P587 L588 F593 D594 L625 L639 Y642 S644 I647	I586-L590 HydrophobicContact CG2-CD1 4.3Å; I586-L590 WeakPolarHBondContact O-CG 3.32Å; I586-L590 PolarHBondContact O-N 2.76Å; I586-L590 VanDerWaalsContact O-N 3.12Å; P587-L590 PolarHBondContact O-N 2.89Å; L588-L590 VanDerWaalsContact C-N 3.28Å; L588-L590 PolarHBondContact O-N 3.2Å; L590-F593 PolarHBondContact O-N 3.16Å; L590-D594 WeakPolarHBondContact O-CB 3.37Å; L590-D594 PolarHBondContact O-N 3.45Å; L590-L625 HydrophobicContact CD2-CD2 4.05Å; L590-L639 HydrophobicContact CD1-CD2 4.14Å; L590-L639 HydrophobicContact CD2-CD2 4.46Å; L590-Y642 HydrophobicContact CD1-CG 4.37Å; L590-S644 VanDerWaalsContact CD2-CB 3.42Å; L590-I647 HydrophobicContact CB-CD1 4.13Å
591	K	88.6	Confident	80.6	Confident	110 Å²	110	45.7 Å²	45.7	48%	0.478	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-40.8	174.6	-173.8	178.9	-179.5	-178.1	0	111.9	P587 L588 I589 F593 D594 Q595	P587-K591 WeakPolarHBondContact O-CB 3.15Å; P587-K591 PolarHBondContact O-N 3.17Å; L588-K591 PolarHBondContact O-N 3.41Å; I589-K591 VanDerWaalsContact C-N 3.33Å; I589-K591 PolarHBondContact O-N 2.96Å; K591-F593 VanDerWaalsContact C-N 3.34Å; K591-F593 PolarHBondContact O-N 3.26Å; K591-D594 PolarHBondContact O-N 2.93Å; K591-Q595 WeakPolarHBondContact O-CG 3.28Å; K591-Q595 PolarHBondContact O-N 2.71Å; K591-Q595 VanDerWaalsContact O-N 3.09Å
592	Y	88.2	Confident	77.7	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-43.3	174.9	-170.6	-88.1	0	0	0	111.3	A501 A551 L588 I589 N596 L618 L621	A501-Y592 HydrophobicContact CB-CD2 4.07Å; A551-Y592 HydrophobicContact CB-CE2 4.32Å; A551-Y592 WeakPolarHBondContact CB-OH 3.05Å; L588-Y592 WeakPolarHBondContact O-CB 3.39Å; L588-Y592 PolarHBondContact O-N 3.06Å; I589-Y592 WeakPolarHBondContact O-CB 3.39Å; I589-Y592 PolarHBondContact O-N 3.27Å; I589-Y592 VanDerWaalsContact O-N 3.14Å; Y592-N596 VanDerWaalsContact CD1-ND2 3.26Å; Y592-N596 WeakPolarHBondContact CD1-ND2 3.36Å; Y592-N596 WeakPolarHBondContact CE1-ND2 3.17Å; Y592-N596 VanDerWaalsContact CZ-ND2 3.33Å; Y592-N596 PolarHBondContact O-N 3.27Å; Y592-N596 VanDerWaalsContact O-N 3.14Å; Y592-N596 PolarHBondContact O-ND2 3.08Å; Y592-L618 HydrophobicContact CD1-CD2 3.98Å; Y592-L618 HydrophobicContact CE1-CD2 3.81Å; Y592-L621 HydrophobicContact CD1-CD1 3.47Å; Y592-L621 VanDerWaalsContact CD1-CD1 3.47Å; Y592-L621 HydrophobicContact CE1-CD1 3.72Å; Y592-L621 HydrophobicContact CG-CD1 4.01Å
593	F	87.3	Confident	75	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-42.4	174.8	-88	-83.5	0	0	0	113.1	I589 L590 K591 Q595 N596 V597 L618 L621 L622 I647 T651 L659	I589-F593 HydrophobicContact CG2-CD2 3.71Å; I589-F593 HydrophobicContact CG2-CE2 3.7Å; I589-F593 VanDerWaalsContact O-CD2 3.26Å; I589-F593 WeakPolarHBondContact O-CD2 3.25Å; I589-F593 PolarHBondContact O-N 3.44Å; L590-F593 PolarHBondContact O-N 3.16Å; K591-F593 VanDerWaalsContact C-N 3.34Å; K591-F593 PolarHBondContact O-N 3.26Å; F593-Q595 VanDerWaalsContact C-N 3.29Å; F593-Q595 PolarHBondContact O-N 3.31Å; F593-N596 PolarHBondContact O-N 3.46Å; F593-V597 HydrophobicContact CD1-CG2 4.35Å; F593-V597 WeakPolarHBondContact O-CB 3.41Å; F593-V597 VanDerWaalsContact O-CG2 3.24Å; F593-V597 WeakPolarHBondContact O-CG2 3.44Å; F593-V597 PolarHBondContact O-N 3.24Å; F593-L618 HydrophobicContact CD1-CD2 3.84Å; F593-L618 HydrophobicContact CE1-CB 4Å; F593-L618 HydrophobicContact CE1-CD2 3.43Å; F593-L618 VanDerWaalsContact CE1-CD2 3.43Å; F593-L618 HydrophobicContact CE1-CG 4.24Å; F593-L618 HydrophobicContact CE2-CD2 4.25Å; F593-L618 HydrophobicContact CG-CD2 4.37Å; F593-L618 HydrophobicContact CZ-CB 3.95Å; F593-L618 HydrophobicContact CZ-CD2 3.6Å; F593-L618 HydrophobicContact CZ-CG 4.38Å; F593-L618 WeakPolarHBondContact CZ-O 3.17Å; F593-L621 HydrophobicContact CE2-CB 3.87Å; F593-L621 HydrophobicContact CZ-CB 4.38Å; F593-L622 HydrophobicContact CD2-CD2 4.39Å; F593-L622 HydrophobicContact CE1-CD1 4.27Å; F593-L622 HydrophobicContact CE1-CD2 3.87Å; F593-L622 HydrophobicContact CE1-CG 3.86Å; F593-L622 HydrophobicContact CE2-CD2 3.76Å; F593-L622 HydrophobicContact CE2-CG 4.05Å; F593-L622 HydrophobicContact CZ-CB 4.49Å; F593-L622 HydrophobicContact CZ-CD1 4.26Å; F593-L622 HydrophobicContact CZ-CD2 3.52Å; F593-L622 HydrophobicContact CZ-CG 3.4Å; F593-L622 VanDerWaalsContact CZ-CG 3.4Å; F593-I647 HydrophobicContact CB-CG2 3.62Å; F593-T651 HydrophobicContact CD1-CG2 4Å; F593-T651 HydrophobicContact CE1-CG2 3.89Å; F593-L659 HydrophobicContact CE1-CD1 4.42Å
594	D	85.1	Confident	72.2	Confident	61 Å²	61	53.7 Å²	53.7	33%	0.326	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-41.2	-179.7	-168.8	23.2	0	0	0	111.8	L590 K591 S598 I647 R650	L590-D594 WeakPolarHBondContact O-CB 3.37Å; L590-D594 PolarHBondContact O-N 3.45Å; K591-D594 PolarHBondContact O-N 2.93Å; D594-S598 VanDerWaalsContact O-CB 3.32Å; D594-S598 WeakPolarHBondContact O-CB 3.36Å; D594-S598 PolarHBondContact O-N 3.48Å; D594-S598 PolarHBondContact O-OG 2.84Å; D594-I647 HydrophobicContact CB-CD1 4.29Å; D594-I647 HydrophobicContact CB-CG1 4.45Å; D594-I647 HydrophobicContact CB-CG2 4.44Å; D594-R650 IonicContact OD1-CZ 3.79Å; D594-R650 IonicContact OD1-NH1 3.13Å; D594-R650 PolarHBondContact OD1-NH1 2.69Å; D594-R650 IonicContact OD1-NH2 2.8Å; D594-R650 PolarHBondContact OD1-NH2 3.02Å
595	Q	81.3	Confident	69.7	Low	28 Å²	28	53.7 Å²	53.7	13%	0.131	30%	0.301	C	S	.	.	H	α-helix	trans	-70.9	-47.8	179	-68.6	176	3.4	0	0	112.7	C503 K591 F593	C503-Q595 HydrophobicContact CB-CG 4.26Å; K591-Q595 WeakPolarHBondContact O-CG 3.28Å; K591-Q595 PolarHBondContact O-N 2.71Å; K591-Q595 VanDerWaalsContact O-N 3.09Å; F593-Q595 VanDerWaalsContact C-N 3.29Å; F593-Q595 PolarHBondContact O-N 3.31Å
596	N	75.1	Confident	67	Low	29 Å²	29	58.9 Å²	58.9	16%	0.155	33%	0.333	C	S	.	.	H	α-helix	trans	-71	-36.7	-176.3	-75.8	-70.4	0	0	0	112.9	P502 Y592 F593 L618	P502-N596 VanDerWaalsContact CG-OD1 3.31Å; P502-N596 WeakPolarHBondContact CG-OD1 3.42Å; Y592-N596 VanDerWaalsContact CD1-ND2 3.26Å; Y592-N596 WeakPolarHBondContact CD1-ND2 3.36Å; Y592-N596 WeakPolarHBondContact CE1-ND2 3.17Å; Y592-N596 VanDerWaalsContact CZ-ND2 3.33Å; Y592-N596 PolarHBondContact O-N 3.27Å; Y592-N596 VanDerWaalsContact O-N 3.14Å; Y592-N596 PolarHBondContact O-ND2 3.08Å; F593-N596 PolarHBondContact O-N 3.46Å; N596-L618 HydrophobicContact CB-CD2 4.34Å
597	V	67.4	Low	64.5	Low	7 Å²	7	62 Å²	62	4%	0.042	37%	0.365	C	S	.	.	H	α-helix	trans	-79.6	-24.5	-178.2	-178.8	0	0	0	0	112.2	F593 Y599 R650	F593-V597 HydrophobicContact CD1-CG2 4.35Å; F593-V597 WeakPolarHBondContact O-CB 3.41Å; F593-V597 VanDerWaalsContact O-CG2 3.24Å; F593-V597 WeakPolarHBondContact O-CG2 3.44Å; F593-V597 PolarHBondContact O-N 3.24Å; V597-Y599 VanDerWaalsContact C-N 3.31Å; V597-Y599 PolarHBondContact O-N 3.04Å; V597-R650 HydrophobicContact CG1-CB 3.68Å
598	S	56.7	Low	62.2	Low	44 Å²	44	69.3 Å²	69.3	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-68.5	-31.7	177.9	-62.6	0	0	0	0	112.4	D594 D600 T601 R650	D594-S598 VanDerWaalsContact O-CB 3.32Å; D594-S598 WeakPolarHBondContact O-CB 3.36Å; D594-S598 PolarHBondContact O-N 3.48Å; D594-S598 PolarHBondContact O-OG 2.84Å; S598-D600 VanDerWaalsContact C-N 3.27Å; S598-D600 PolarHBondContact O-N 2.78Å; S598-T601 PolarHBondContact O-N 3.42Å; S598-T601 VanDerWaalsContact O-N 3.12Å; S598-T601 PolarHBondContact O-OG1 2.74Å; S598-R650 PolarHBondContact OG-NH1 3Å
599	Y	49.3	Very low	60.6	Low	178 Å²	178	74.3 Å²	74.3	70%	0.698	42%	0.422	S	S	*	.	H	α-helix	trans	-61.7	-32.6	179.5	-109.7	-89.7	0	0	0	113.2	V597 T601	V597-Y599 VanDerWaalsContact C-N 3.31Å; V597-Y599 PolarHBondContact O-N 3.04Å; Y599-T601 VanDerWaalsContact C-N 3.28Å; Y599-T601 PolarHBondContact O-N 3.48Å
600	D	46.8	Very low	59.5	Low	126 Å²	126	79.1 Å²	79.1	67%	0.674	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.4	178.3	-76.2	-15.9	0	0	0	113.9	S598	S598-D600 VanDerWaalsContact C-N 3.27Å; S598-D600 PolarHBondContact O-N 2.78Å
601	T	38.5	Very low	59	Low	71 Å²	71	81.5 Å²	81.5	44%	0.436	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.9	-175.6	60.2	0	0	0	0	115	S598 Y599 E603 R653	S598-T601 PolarHBondContact O-N 3.42Å; S598-T601 VanDerWaalsContact O-N 3.12Å; S598-T601 PolarHBondContact O-OG1 2.74Å; Y599-T601 VanDerWaalsContact C-N 3.28Å; Y599-T601 PolarHBondContact O-N 3.48Å; T601-E603 PolarHBondContact O-N 3.42Å; T601-R653 VanDerWaalsContact CG2-NH1 3.29Å
602	G	34.4	Very low	58.8	Low	49 Å²	49	78 Å²	78	51%	0.505	44%	0.439	S	S	.	.	S	Bend	trans	-89.2	81.8	-178.7	0	0	0	0	0	112.2	S604	G602-S604 PolarHBondContact O-N 3.09Å; G602-S604 PolarHBondContact O-OG 2.92Å; G602-S604 VanDerWaalsContact O-OG 3.12Å
603	E	37.1	Very low	58.8	Low	196 Å²	196	80.3 Å²	80.3	92%	0.916	45%	0.448	S	S	*	.	S	Bend	trans	41.3	2.3	160.6	-75.4	-179.9	162.2	0	0	120.2	T601 A605	T601-E603 PolarHBondContact O-N 3.42Å; E603-A605 PolarHBondContact O-N 3.5Å; E603-A605 VanDerWaalsContact O-N 3.15Å
604	S	33.2	Very low	58.7	Low	69 Å²	69	81.9 Å²	81.9	48%	0.483	46%	0.456	S	S	.	.			trans	-94.5	50	177.7	-52	0	0	0	0	108.2	G602 T606	G602-S604 PolarHBondContact O-N 3.09Å; G602-S604 PolarHBondContact O-OG 2.92Å; G602-S604 VanDerWaalsContact O-OG 3.12Å; S604-T606 PolarHBondContact O-N 2.79Å
605	A	38.6	Very low	58.9	Low	98 Å²	98	79.5 Å²	79.5	81%	0.81	44%	0.444	S	S	*	.			trans	-70.2	15.4	168.6	0	0	0	0	0	112	E603 G607	E603-A605 PolarHBondContact O-N 3.5Å; E603-A605 VanDerWaalsContact O-N 3.15Å; A605-G607 VanDerWaalsContact C-N 3.27Å; A605-G607 PolarHBondContact O-N 3.4Å
606	T	36.6	Very low	59.3	Low	109 Å²	109	78.2 Å²	78.2	67%	0.669	44%	0.437	S	S	*	.	S	Bend	trans	-76.3	79.9	171.7	55	0	0	0	0	108.8	S604 R608	S604-T606 PolarHBondContact O-N 2.79Å; T606-R608 PolarHBondContact O-N 2.75Å
607	G	42.3	Very low	60.1	Low	68 Å²	68	76.8 Å²	76.8	70%	0.701	43%	0.43	S	S	*	.			trans	37.8	34.6	154.3	0	0	0	0	0	118	A605	A605-G607 VanDerWaalsContact C-N 3.27Å; A605-G607 PolarHBondContact O-N 3.4Å
608	R	43.5	Very low	61.3	Low	188 Å²	188	77.3 Å²	77.3	71%	0.709	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-64.6	127.8	178.7	-83.8	-173.3	179.3	174.8	0.7	106.6	T606 Y610	T606-R608 PolarHBondContact O-N 2.75Å; R608-Y610 PolarHBondContact O-N 3.22Å
609	P	58.3	Low	63	Low	119 Å²	119	75.2 Å²	75.2	77%	0.773	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-55	129.4	173.7	23.3	-31.8	0	0	0	107.7
610	Y	70.5	Confident	65.1	Low	101 Å²	101	66.8 Å²	66.8	40%	0.396	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-65.6	146.4	175.8	70.7	-86	0	0	0	108.4	I22 E23 F24 R608 W612 L615	I22-Y610 HydrophobicContact CG2-CD1 3.49Å; I22-Y610 VanDerWaalsContact CG2-CD1 3.49Å; I22-Y610 HydrophobicContact CG2-CD2 3.87Å; I22-Y610 HydrophobicContact CG2-CE1 3.56Å; I22-Y610 HydrophobicContact CG2-CE2 3.98Å; I22-Y610 HydrophobicContact CG2-CG 3.64Å; E23-Y610 PolarHBondContact O-OH 3.39Å; F24-Y610 HydrophobicContact CD2-CE2 4.1Å; R608-Y610 PolarHBondContact O-N 3.22Å; Y610-W612 HydrophobicContact CE2-CB 4.36Å; Y610-L615 HydrophobicContact CD2-CD2 4.07Å; Y610-L615 HydrophobicContact CE2-CD2 4.36Å
611	V	79.8	Confident	67.5	Low	55 Å²	55	60.8 Å²	60.8	33%	0.333	35%	0.353	S	S	.	.			trans	-91.8	114.7	175.4	-179.5	0	0	0	0	108.8	R613 N614 L615	V611-R613 VanDerWaalsContact C-N 3.29Å; V611-R613 HydrophobicContact CG1-CB 4.18Å; V611-R613 PolarHBondContact O-N 2.87Å; V611-N614 HydrophobicContact CB-CB 4.32Å; V611-N614 PolarHBondContact O-N 3.47Å; V611-N614 VanDerWaalsContact O-N 3.11Å; V611-L615 PolarHBondContact O-N 3.18Å
612	W	84.1	Confident	70.1	Confident	36 Å²	36	57.4 Å²	57.4	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-52	-45.6	-178.6	-173.5	101.3	0	0	0	112.2	F24 E25 D30 K552 Y610 N614 L615 F616	F24-W612 AromaticContact CD2-CD1 3.44Å; F24-W612 VanDerWaalsContact CD2-CD1 3.44Å; F24-W612 HydrophobicContact CD2-CG 4.22Å; F24-W612 AromaticContact CD2-NE1 3.63Å; F24-W612 AromaticContact CE2-CD1 3.37Å; F24-W612 HydrophobicContact CE2-CD2 4.12Å; F24-W612 AromaticContact CE2-CE2 3.82Å; F24-W612 AromaticContact CE2-CG 3.84Å; F24-W612 HydrophobicContact CE2-CG 3.84Å; F24-W612 AromaticContact CE2-NE1 3.31Å; F24-W612 VanDerWaalsContact CE2-NE1 3.31Å; E25-W612 PolarHBondContact O-NE1 3.42Å; D30-W612 HydrophobicContact CB-CH2 4.35Å; D30-W612 HydrophobicContact CB-CZ3 4.36Å; K552-W612 HydrophobicContact CD-CZ3 3.9Å; Y610-W612 HydrophobicContact CE2-CB 4.36Å; W612-N614 VanDerWaalsContact C-N 3.32Å; W612-N614 PolarHBondContact O-N 3.16Å; W612-L615 PolarHBondContact O-N 2.8Å; W612-F616 HydrophobicContact CD2-CB 4.35Å; W612-F616 HydrophobicContact CE3-CB 3.97Å; W612-F616 HydrophobicContact CE3-CG 4.41Å; W612-F616 HydrophobicContact CH2-CB 4Å; W612-F616 HydrophobicContact CH2-CD1 4.25Å; W612-F616 AromaticContact CH2-CD2 3.43Å; W612-F616 HydrophobicContact CH2-CD2 3.43Å; W612-F616 VanDerWaalsContact CH2-CD2 3.43Å; W612-F616 AromaticContact CH2-CE2 3.89Å; W612-F616 HydrophobicContact CH2-CE2 3.89Å; W612-F616 AromaticContact CH2-CG 3.64Å; W612-F616 HydrophobicContact CH2-CG 3.64Å; W612-F616 HydrophobicContact CH2-CZ 4.42Å; W612-F616 HydrophobicContact CZ2-CB 4.38Å; W612-F616 AromaticContact CZ2-CD2 3.83Å; W612-F616 HydrophobicContact CZ2-CD2 3.83Å; W612-F616 HydrophobicContact CZ2-CE2 4.45Å; W612-F616 HydrophobicContact CZ2-CG 4.28Å; W612-F616 HydrophobicContact CZ3-CB 3.76Å; W612-F616 HydrophobicContact CZ3-CD1 4.1Å; W612-F616 HydrophobicContact CZ3-CD2 4.02Å; W612-F616 AromaticContact CZ3-CG 3.71Å; W612-F616 HydrophobicContact CZ3-CG 3.71Å; W612-F616 VanDerWaalsContact O-CB 3.29Å; W612-F616 WeakPolarHBondContact O-CB 3.46Å; W612-F616 PolarHBondContact O-N 2.71Å
613	R	88.6	Confident	73	Confident	54 Å²	54	56 Å²	56	20%	0.204	31%	0.311	C	S	.	.	H	α-helix	trans	-55.4	-43.1	178.7	-65.1	-177.5	-72.1	-87.9	-2.4	113.2	E38 E548 K552 V611 S617	E38-R613 VanDerWaalsContact OE1-CD 3.3Å; E38-R613 WeakPolarHBondContact OE1-CD 3.47Å; E38-R613 WeakPolarHBondContact OE1-CG 3.36Å; E548-R613 HydrophobicContact CB-CB 4.29Å; E548-R613 IonicContact OE2-CZ 3.71Å; E548-R613 IonicContact OE2-NE 2.78Å; E548-R613 PolarHBondContact OE2-NE 2.94Å; E548-R613 VanDerWaalsContact OE2-NE 3.08Å; E548-R613 IonicContact OE2-NH2 3.8Å; E548-R613 PolarHBondContact OE2-NH2 3.21Å; K552-R613 HydrophobicContact CD-CB 4.38Å; K552-R613 HydrophobicContact CD-CG 3.93Å; V611-R613 VanDerWaalsContact C-N 3.29Å; V611-R613 HydrophobicContact CG1-CB 4.18Å; V611-R613 PolarHBondContact O-N 2.87Å; R613-S617 VanDerWaalsContact O-CB 3.3Å; R613-S617 WeakPolarHBondContact O-CB 3.33Å; R613-S617 PolarHBondContact O-N 3.04Å; R613-S617 PolarHBondContact O-OG 3.43Å
614	N	86.5	Confident	75.9	Confident	34 Å²	34	46.6 Å²	46.6	18%	0.182	27%	0.268	C	S	.	.	H	α-helix	trans	-69.6	-46	-179.1	-71.3	-23	0	0	0	110.4	E548 V611 W612 S617 L618	E548-N614 VanDerWaalsContact CG-OD1 3.3Å; E548-N614 WeakPolarHBondContact CG-OD1 3.44Å; E548-N614 PolarHBondContact OE1-ND2 3.32Å; V611-N614 HydrophobicContact CB-CB 4.32Å; V611-N614 PolarHBondContact O-N 3.47Å; V611-N614 VanDerWaalsContact O-N 3.11Å; W612-N614 VanDerWaalsContact C-N 3.32Å; W612-N614 PolarHBondContact O-N 3.16Å; N614-S617 PolarHBondContact O-N 2.92Å; N614-L618 WeakPolarHBondContact O-CB 3.4Å; N614-L618 WeakPolarHBondContact O-CG 3.43Å; N614-L618 PolarHBondContact O-N 2.9Å
615	L	87.7	Confident	78.8	Confident	11 Å²	11	43.3 Å²	43.3	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-44.8	178.1	-175.8	56.6	0	0	0	111.9	I22 F24 Y610 V611 W612 S617 L618 V619 Q656 L659	I22-L615 HydrophobicContact CG2-CD2 3.89Å; F24-L615 HydrophobicContact CB-CD2 3.96Å; F24-L615 HydrophobicContact CD1-CD2 3.88Å; F24-L615 HydrophobicContact CD1-CG 4.29Å; F24-L615 HydrophobicContact CD2-CD2 3.52Å; F24-L615 HydrophobicContact CD2-CG 4.15Å; F24-L615 HydrophobicContact CE1-CD2 4.14Å; F24-L615 HydrophobicContact CE1-CG 4.04Å; F24-L615 HydrophobicContact CE2-CB 4.09Å; F24-L615 HydrophobicContact CE2-CD2 3.82Å; F24-L615 HydrophobicContact CE2-CG 3.92Å; F24-L615 HydrophobicContact CG-CD2 3.52Å; F24-L615 HydrophobicContact CG-CG 4.3Å; F24-L615 HydrophobicContact CZ-CB 4.29Å; F24-L615 HydrophobicContact CZ-CD2 4.1Å; F24-L615 HydrophobicContact CZ-CG 3.84Å; Y610-L615 HydrophobicContact CD2-CD2 4.07Å; Y610-L615 HydrophobicContact CE2-CD2 4.36Å; V611-L615 PolarHBondContact O-N 3.18Å; W612-L615 PolarHBondContact O-N 2.8Å; L615-S617 PolarHBondContact O-N 3.1Å; L615-L618 PolarHBondContact O-N 3.09Å; L615-V619 WeakPolarHBondContact O-CG2 3.45Å; L615-V619 PolarHBondContact O-N 2.71Å; L615-Q656 HydrophobicContact CD1-CB 4.34Å; L615-Q656 HydrophobicContact CD1-CG 4.24Å; L615-Q656 HydrophobicContact CD2-CG 4.14Å; L615-L659 HydrophobicContact CD1-CD2 4.37Å
616	F	90.7	Very high	81.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-48	174.4	177.5	-97.2	0	0	0	112	F24 Y26 D27 W267 K552 A556 W612 L618 V619 N620	F24-F616 HydrophobicContact CZ-CB 4.24Å; Y26-F616 AromaticContact CD2-CD2 3.82Å; Y26-F616 HydrophobicContact CD2-CD2 3.82Å; Y26-F616 HydrophobicContact CD2-CE2 4.39Å; Y26-F616 AromaticContact CE2-CD2 3.47Å; Y26-F616 HydrophobicContact CE2-CD2 3.47Å; Y26-F616 VanDerWaalsContact CE2-CD2 3.47Å; Y26-F616 AromaticContact CE2-CE2 3.89Å; Y26-F616 HydrophobicContact CE2-CE2 3.89Å; Y26-F616 HydrophobicContact CE2-CG 4.32Å; D27-F616 VanDerWaalsContact O-CE2 3.29Å; D27-F616 WeakPolarHBondContact O-CE2 3.26Å; W267-F616 HydrophobicContact CZ2-CZ 4.41Å; K552-F616 HydrophobicContact CB-CD1 4.32Å; K552-F616 HydrophobicContact CD-CD1 4.35Å; K552-F616 HydrophobicContact CG-CD1 3.72Å; K552-F616 HydrophobicContact CG-CE1 3.8Å; A556-F616 HydrophobicContact CB-CE1 3.9Å; A556-F616 HydrophobicContact CB-CZ 4.1Å; W612-F616 HydrophobicContact CD2-CB 4.35Å; W612-F616 HydrophobicContact CE3-CB 3.97Å; W612-F616 HydrophobicContact CE3-CG 4.41Å; W612-F616 HydrophobicContact CH2-CB 4Å; W612-F616 HydrophobicContact CH2-CD1 4.25Å; W612-F616 AromaticContact CH2-CD2 3.43Å; W612-F616 HydrophobicContact CH2-CD2 3.43Å; W612-F616 VanDerWaalsContact CH2-CD2 3.43Å; W612-F616 AromaticContact CH2-CE2 3.89Å; W612-F616 HydrophobicContact CH2-CE2 3.89Å; W612-F616 AromaticContact CH2-CG 3.64Å; W612-F616 HydrophobicContact CH2-CG 3.64Å; W612-F616 HydrophobicContact CH2-CZ 4.42Å; W612-F616 HydrophobicContact CZ2-CB 4.38Å; W612-F616 AromaticContact CZ2-CD2 3.83Å; W612-F616 HydrophobicContact CZ2-CD2 3.83Å; W612-F616 HydrophobicContact CZ2-CE2 4.45Å; W612-F616 HydrophobicContact CZ2-CG 4.28Å; W612-F616 HydrophobicContact CZ3-CB 3.76Å; W612-F616 HydrophobicContact CZ3-CD1 4.1Å; W612-F616 HydrophobicContact CZ3-CD2 4.02Å; W612-F616 AromaticContact CZ3-CG 3.71Å; W612-F616 HydrophobicContact CZ3-CG 3.71Å; W612-F616 VanDerWaalsContact O-CB 3.29Å; W612-F616 WeakPolarHBondContact O-CB 3.46Å; W612-F616 PolarHBondContact O-N 2.71Å; F616-L618 PolarHBondContact O-N 3.13Å; F616-V619 PolarHBondContact O-N 3.24Å; F616-N620 WeakPolarHBondContact CD1-ND2 3.47Å; F616-N620 WeakPolarHBondContact CE1-ND2 3.39Å; F616-N620 VanDerWaalsContact CZ-ND2 3.28Å; F616-N620 WeakPolarHBondContact CZ-ND2 3.33Å; F616-N620 PolarHBondContact O-N 2.79Å
617	S	92.5	Very high	84.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-46.1	176.5	-59.2	0	0	0	0	111.8	K552 R613 N614 L615 V619 N620 L621	K552-S617 WeakPolarHBondContact CA-OG 3.38Å; K552-S617 PolarHBondContact N-OG 3.22Å; R613-S617 VanDerWaalsContact O-CB 3.3Å; R613-S617 WeakPolarHBondContact O-CB 3.33Å; R613-S617 PolarHBondContact O-N 3.04Å; R613-S617 PolarHBondContact O-OG 3.43Å; N614-S617 PolarHBondContact O-N 2.92Å; L615-S617 PolarHBondContact O-N 3.1Å; S617-V619 PolarHBondContact O-N 3.37Å; S617-N620 PolarHBondContact O-N 3.14Å; S617-L621 WeakPolarHBondContact O-CB 3.37Å; S617-L621 VanDerWaalsContact O-CG 3.25Å; S617-L621 WeakPolarHBondContact O-CG 3.48Å; S617-L621 PolarHBondContact O-N 3.21Å
618	L	92.1	Very high	86.8	Confident	18 Å²	18	33.2 Å²	33.2	9%	0.094	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-46.5	178.6	-68.9	169.5	0	0	0	111.1	Y592 F593 N596 N614 L615 F616 N620 L621 L622 L659	Y592-L618 HydrophobicContact CD1-CD2 3.98Å; Y592-L618 HydrophobicContact CE1-CD2 3.81Å; F593-L618 HydrophobicContact CD1-CD2 3.84Å; F593-L618 HydrophobicContact CE1-CB 4Å; F593-L618 HydrophobicContact CE1-CD2 3.43Å; F593-L618 VanDerWaalsContact CE1-CD2 3.43Å; F593-L618 HydrophobicContact CE1-CG 4.24Å; F593-L618 HydrophobicContact CE2-CD2 4.25Å; F593-L618 HydrophobicContact CG-CD2 4.37Å; F593-L618 HydrophobicContact CZ-CB 3.95Å; F593-L618 HydrophobicContact CZ-CD2 3.6Å; F593-L618 HydrophobicContact CZ-CG 4.38Å; F593-L618 WeakPolarHBondContact CZ-O 3.17Å; N596-L618 HydrophobicContact CB-CD2 4.34Å; N614-L618 WeakPolarHBondContact O-CB 3.4Å; N614-L618 WeakPolarHBondContact O-CG 3.43Å; N614-L618 PolarHBondContact O-N 2.9Å; L615-L618 PolarHBondContact O-N 3.09Å; F616-L618 PolarHBondContact O-N 3.13Å; L618-N620 VanDerWaalsContact C-N 3.31Å; L618-N620 PolarHBondContact O-N 3.36Å; L618-L621 PolarHBondContact O-N 3.26Å; L618-L622 PolarHBondContact O-N 2.81Å; L618-L659 HydrophobicContact CB-CD1 3.84Å
619	V	91.8	Very high	89.1	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-45.3	176.1	174.7	0	0	0	0	110.6	Y26 L615 F616 S617 L621 L622 R623 L658 L659 F662	Y26-V619 HydrophobicContact CD2-CG1 4.34Å; Y26-V619 HydrophobicContact CE1-CG1 4.29Å; Y26-V619 HydrophobicContact CE2-CB 3.74Å; Y26-V619 HydrophobicContact CE2-CG1 3.56Å; Y26-V619 HydrophobicContact CE2-CG2 4.39Å; Y26-V619 VanDerWaalsContact CZ-CG1 3.44Å; Y26-V619 WeakPolarHBondContact OH-CG1 3.46Å; L615-V619 WeakPolarHBondContact O-CG2 3.45Å; L615-V619 PolarHBondContact O-N 2.71Å; F616-V619 PolarHBondContact O-N 3.24Å; S617-V619 PolarHBondContact O-N 3.37Å; V619-L621 PolarHBondContact O-N 3.34Å; V619-L622 PolarHBondContact O-N 2.83Å; V619-R623 HydrophobicContact CG1-CG 4.46Å; V619-R623 WeakPolarHBondContact O-CG 3.39Å; V619-R623 PolarHBondContact O-N 3.21Å; V619-L658 HydrophobicContact CG1-CD2 3.48Å; V619-L658 VanDerWaalsContact CG1-CD2 3.48Å; V619-L658 HydrophobicContact CG1-CG 3.92Å; V619-L658 HydrophobicContact CG2-CD2 4.39Å; V619-L659 HydrophobicContact CG2-CB 4.14Å; V619-L659 HydrophobicContact CG2-CD1 3.97Å; V619-F662 HydrophobicContact CG1-CD2 4.43Å
620	N	94.6	Very high	90.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-47.7	178.3	-73.4	-17.9	0	0	0	112.2	Y26 S555 L559 F616 S617 L618 L622 R623 I624	Y26-N620 PolarHBondContact OH-OD1 3.19Å; S555-N620 WeakPolarHBondContact OG-CB 3.3Å; S555-N620 PolarHBondContact OG-ND2 3.42Å; L559-N620 HydrophobicContact CD2-CB 4.05Å; L559-N620 WeakPolarHBondContact CD2-OD1 3.46Å; F616-N620 WeakPolarHBondContact CD1-ND2 3.47Å; F616-N620 WeakPolarHBondContact CE1-ND2 3.39Å; F616-N620 VanDerWaalsContact CZ-ND2 3.28Å; F616-N620 WeakPolarHBondContact CZ-ND2 3.33Å; F616-N620 PolarHBondContact O-N 2.79Å; S617-N620 PolarHBondContact O-N 3.14Å; L618-N620 VanDerWaalsContact C-N 3.31Å; L618-N620 PolarHBondContact O-N 3.36Å; N620-L622 PolarHBondContact O-N 2.81Å; N620-R623 WeakPolarHBondContact O-CB 3.4Å; N620-R623 PolarHBondContact O-N 3.03Å; N620-I624 WeakPolarHBondContact O-CG1 3.39Å; N620-I624 PolarHBondContact O-N 3.31Å
621	L	95.9	Very high	90.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-63.5	-39.5	179.6	-66.2	178.2	0	0	0	112.1	L497 I589 Y592 F593 S617 L618 V619 R623 I624 L625	L497-L621 HydrophobicContact CD1-CD2 4.48Å; L497-L621 HydrophobicContact CD2-CD2 3.74Å; I589-L621 HydrophobicContact CD1-CD2 4.36Å; I589-L621 HydrophobicContact CG1-CB 4.48Å; I589-L621 HydrophobicContact CG1-CD2 4.16Å; I589-L621 HydrophobicContact CG2-CB 4.09Å; Y592-L621 HydrophobicContact CD1-CD1 3.47Å; Y592-L621 VanDerWaalsContact CD1-CD1 3.47Å; Y592-L621 HydrophobicContact CE1-CD1 3.72Å; Y592-L621 HydrophobicContact CG-CD1 4.01Å; F593-L621 HydrophobicContact CE2-CB 3.87Å; F593-L621 HydrophobicContact CZ-CB 4.38Å; S617-L621 WeakPolarHBondContact O-CB 3.37Å; S617-L621 VanDerWaalsContact O-CG 3.25Å; S617-L621 WeakPolarHBondContact O-CG 3.48Å; S617-L621 PolarHBondContact O-N 3.21Å; L618-L621 PolarHBondContact O-N 3.26Å; V619-L621 PolarHBondContact O-N 3.34Å; L621-R623 VanDerWaalsContact C-N 3.29Å; L621-R623 PolarHBondContact O-N 2.99Å; L621-I624 HydrophobicContact CD2-CD1 4.3Å; L621-I624 PolarHBondContact O-N 3.13Å; L621-L625 WeakPolarHBondContact O-CB 3.43Å; L621-L625 PolarHBondContact O-N 3.01Å
622	L	94.1	Very high	91.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-35.5	172.5	-72.7	-173.9	0	0	0	112.2	F593 L618 V619 N620 L625 N626 L648 T651 L659 F662 A663 L666	F593-L622 HydrophobicContact CD2-CD2 4.39Å; F593-L622 HydrophobicContact CE1-CD1 4.27Å; F593-L622 HydrophobicContact CE1-CD2 3.87Å; F593-L622 HydrophobicContact CE1-CG 3.86Å; F593-L622 HydrophobicContact CE2-CD2 3.76Å; F593-L622 HydrophobicContact CE2-CG 4.05Å; F593-L622 HydrophobicContact CZ-CB 4.49Å; F593-L622 HydrophobicContact CZ-CD1 4.26Å; F593-L622 HydrophobicContact CZ-CD2 3.52Å; F593-L622 HydrophobicContact CZ-CG 3.4Å; F593-L622 VanDerWaalsContact CZ-CG 3.4Å; L618-L622 PolarHBondContact O-N 2.81Å; V619-L622 PolarHBondContact O-N 2.83Å; N620-L622 PolarHBondContact O-N 2.81Å; L622-L625 PolarHBondContact O-N 3.46Å; L622-N626 WeakPolarHBondContact O-CB 3.18Å; L622-N626 PolarHBondContact O-N 3.32Å; L622-N626 PolarHBondContact O-ND2 3.35Å; L622-L648 HydrophobicContact CD2-CD2 3.95Å; L622-T651 HydrophobicContact CD1-CG2 4.45Å; L622-L659 HydrophobicContact CD1-CD1 3.49Å; L622-L659 VanDerWaalsContact CD1-CD1 3.49Å; L622-L659 HydrophobicContact CD1-CG 3.97Å; L622-L659 WeakPolarHBondContact CD1-O 3.24Å; L622-L659 HydrophobicContact CG-CD1 4.25Å; L622-F662 HydrophobicContact CB-CB 3.73Å; L622-F662 HydrophobicContact CD1-CB 4.03Å; L622-A663 HydrophobicContact CD1-CB 4.05Å; L622-L666 HydrophobicContact CD2-CD1 3.96Å
623	R	94.7	Very high	91.6	Very high	18 Å²	18	31 Å²	31	7%	0.068	13%	0.134	C	C	.	.	H	α-helix	trans	-69.8	-40.8	177.9	-71.5	171.7	79.5	-151.7	11.6	111.6	Y26 W277 L559 V619 N620 L621 N626 K627 F662	Y26-R623 PolarHBondContact OH-NH1 3.39Å; W277-R623 VanDerWaalsContact CZ3-CZ 3.49Å; L559-R623 HydrophobicContact CD1-CB 3.92Å; L559-R623 HydrophobicContact CD2-CB 3.86Å; V619-R623 HydrophobicContact CG1-CG 4.46Å; V619-R623 WeakPolarHBondContact O-CG 3.39Å; V619-R623 PolarHBondContact O-N 3.21Å; N620-R623 WeakPolarHBondContact O-CB 3.4Å; N620-R623 PolarHBondContact O-N 3.03Å; L621-R623 VanDerWaalsContact C-N 3.29Å; L621-R623 PolarHBondContact O-N 2.99Å; R623-N626 PolarHBondContact O-N 3.15Å; R623-K627 WeakPolarHBondContact O-CG 3.28Å; R623-K627 PolarHBondContact O-N 2.87Å; R623-F662 VanDerWaalsContact CD-CE2 3.48Å; R623-F662 HydrophobicContact CG-CD1 3.8Å; R623-F662 HydrophobicContact CG-CD2 3.56Å; R623-F662 HydrophobicContact CG-CE1 3.64Å; R623-F662 HydrophobicContact CG-CE2 3.39Å; R623-F662 HydrophobicContact CG-CG 3.81Å; R623-F662 HydrophobicContact CG-CZ 3.46Å; R623-F662 VanDerWaalsContact CG-CZ 3.46Å
624	I	97.1	Very high	91.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.2	-52	170.9	-67.1	166	0	0	0	109.3	S555 L558 L559 L562 I589 N620 L621 N626 K627 L628	S555-I624 WeakPolarHBondContact O-CD1 3.4Å; L558-I624 HydrophobicContact CB-CD1 3.79Å; L559-I624 HydrophobicContact CB-CD1 4.19Å; L559-I624 HydrophobicContact CB-CG1 3.97Å; L559-I624 HydrophobicContact CD1-CG1 4.03Å; L562-I624 HydrophobicContact CD1-CG1 4.33Å; L562-I624 HydrophobicContact CD1-CG2 4.04Å; I589-I624 HydrophobicContact CD1-CG2 4.16Å; N620-I624 WeakPolarHBondContact O-CG1 3.39Å; N620-I624 PolarHBondContact O-N 3.31Å; L621-I624 HydrophobicContact CD2-CD1 4.3Å; L621-I624 PolarHBondContact O-N 3.13Å; I624-N626 VanDerWaalsContact C-N 3.27Å; I624-N626 PolarHBondContact O-N 3.5Å; I624-K627 WeakPolarHBondContact O-CA 3.43Å; I624-K627 WeakPolarHBondContact O-CB 3.4Å; I624-K627 PolarHBondContact O-N 3.34Å; I624-L628 HydrophobicContact CG2-CD1 4.03Å; I624-L628 HydrophobicContact CG2-CG 4.21Å; I624-L628 WeakPolarHBondContact O-CG 3.44Å; I624-L628 PolarHBondContact O-N 3.05Å
625	L	95.8	Very high	92	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-38.8	-179.3	-168.6	57.9	0	0	0	112.4	I586 I589 L590 L621 L622 L628 T629 L639 L666	I586-L625 HydrophobicContact CB-CD1 4.35Å; I586-L625 HydrophobicContact CG1-CD1 3.98Å; I586-L625 HydrophobicContact CG2-CD1 4.13Å; I589-L625 HydrophobicContact CD1-CB 4.43Å; I589-L625 HydrophobicContact CG2-CB 4.44Å; I589-L625 HydrophobicContact CG2-CD2 4Å; L590-L625 HydrophobicContact CD2-CD2 4.05Å; L621-L625 WeakPolarHBondContact O-CB 3.43Å; L621-L625 PolarHBondContact O-N 3.01Å; L622-L625 PolarHBondContact O-N 3.46Å; L625-L628 PolarHBondContact O-N 2.83Å; L625-T629 PolarHBondContact O-N 3.41Å; L625-T629 VanDerWaalsContact O-N 3.15Å; L625-T629 PolarHBondContact O-OG1 3.19Å; L625-L639 HydrophobicContact CD1-CD2 4Å; L625-L639 HydrophobicContact CD2-CD2 4.19Å; L625-L639 HydrophobicContact CG-CD2 4.32Å; L625-L666 HydrophobicContact CB-CD1 4.21Å; L625-L666 HydrophobicContact CD2-CD1 3.61Å; L625-L666 HydrophobicContact CG-CD1 3.9Å; L625-L666 HydrophobicContact CG-CD2 4.13Å
626	N	94.3	Very high	92.2	Very high	23 Å²	23	29.9 Å²	29.9	12%	0.123	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-42.6	172.3	-88	-70.2	0	0	0	112.2	L622 R623 I624 K630 F662 K665 L666	L622-N626 WeakPolarHBondContact O-CB 3.18Å; L622-N626 PolarHBondContact O-N 3.32Å; L622-N626 PolarHBondContact O-ND2 3.35Å; R623-N626 PolarHBondContact O-N 3.15Å; I624-N626 VanDerWaalsContact C-N 3.27Å; I624-N626 PolarHBondContact O-N 3.5Å; N626-K630 VanDerWaalsContact O-CB 3.25Å; N626-K630 WeakPolarHBondContact O-CB 3.29Å; N626-K630 PolarHBondContact O-N 2.91Å; N626-F662 WeakPolarHBondContact ND2-CB 3.49Å; N626-F662 PolarHBondContact ND2-O 2.89Å; N626-K665 WeakPolarHBondContact OD1-CB 3.29Å; N626-L666 HydrophobicContact CB-CD2 4.47Å; N626-L666 WeakPolarHBondContact OD1-CD2 3.39Å
627	K	94.4	Very high	92.3	Very high	40 Å²	40	33 Å²	33	17%	0.174	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-42.3	177.8	-77.9	168.4	171.9	-84	0	112.1	L559 L562 F573 R623 I624 T629	L559-K627 HydrophobicContact CD1-CD 3.8Å; L562-K627 HydrophobicContact CB-CD 4.33Å; F573-K627 HydrophobicContact CE2-CB 4.32Å; F573-K627 HydrophobicContact CZ-CB 4.22Å; R623-K627 WeakPolarHBondContact O-CG 3.28Å; R623-K627 PolarHBondContact O-N 2.87Å; I624-K627 WeakPolarHBondContact O-CA 3.43Å; I624-K627 WeakPolarHBondContact O-CB 3.4Å; I624-K627 PolarHBondContact O-N 3.34Å; K627-T629 VanDerWaalsContact C-N 3.32Å; K627-T629 PolarHBondContact O-N 2.9Å
628	L	94.9	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-38.8	178.7	-66.4	179.1	0	0	0	112.3	C577 L580 V581 I586 I624 L625 R635	C577-L628 HydrophobicContact CB-CD2 3.78Å; L580-L628 HydrophobicContact CB-CD2 4.16Å; L580-L628 HydrophobicContact CD1-CD2 4.09Å; V581-L628 HydrophobicContact CG2-CD2 4.42Å; I586-L628 HydrophobicContact CG1-CD1 4.16Å; I624-L628 HydrophobicContact CG2-CD1 4.03Å; I624-L628 HydrophobicContact CG2-CG 4.21Å; I624-L628 WeakPolarHBondContact O-CG 3.44Å; I624-L628 PolarHBondContact O-N 3.05Å; L625-L628 PolarHBondContact O-N 2.83Å; L628-R635 WeakPolarHBondContact O-CD 3.22Å; L628-R635 PolarHBondContact O-NH1 3.07Å; L628-R635 VanDerWaalsContact O-NH1 3.12Å
629	T	92.9	Very high	92.3	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-97.9	-14.1	-173.5	59.5	0	0	0	0	115.2	I586 L625 K627 W631 K632 R635 T636 L639 L666	I586-T629 HydrophobicContact CD1-CG2 4.38Å; L625-T629 PolarHBondContact O-N 3.41Å; L625-T629 VanDerWaalsContact O-N 3.15Å; L625-T629 PolarHBondContact O-OG1 3.19Å; K627-T629 VanDerWaalsContact C-N 3.32Å; K627-T629 PolarHBondContact O-N 2.9Å; T629-W631 PolarHBondContact O-N 2.69Å; T629-K632 PolarHBondContact O-N 3.05Å; T629-K632 VanDerWaalsContact O-N 3.09Å; T629-R635 HydrophobicContact CG2-CB 4.09Å; T629-T636 PolarHBondContact O-OG1 3Å; T629-L639 HydrophobicContact CG2-CD1 3.64Å; T629-L639 HydrophobicContact CG2-CD2 4.48Å; T629-L639 HydrophobicContact CG2-CG 3.97Å; T629-L666 WeakPolarHBondContact OG1-CD2 3.45Å
630	K	88.2	Confident	92.4	Very high	108 Å²	108	36.9 Å²	36.9	47%	0.47	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	123	-178.5	-166.9	-176.5	-177.9	-174.1	0	111.6	N626 K632	N626-K630 VanDerWaalsContact O-CB 3.25Å; N626-K630 WeakPolarHBondContact O-CB 3.29Å; N626-K630 PolarHBondContact O-N 2.91Å; K630-K632 PolarHBondContact O-N 3.36Å; K630-K632 VanDerWaalsContact O-N 3.13Å
631	W	78.5	Confident	92.3	Very high	160 Å²	160	40.2 Å²	40.2	61%	0.606	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	14.2	-179.2	-57.3	118.4	0	0	0	115.3	T397 T629	T397-W631 HydrophobicContact CG2-CH2 3.95Å; T397-W631 HydrophobicContact CG2-CZ2 4.29Å; T629-W631 PolarHBondContact O-N 2.69Å
632	K	87.7	Confident	92.2	Very high	77 Å²	77	45 Å²	45	34%	0.335	22%	0.219	S	C	.	.			trans	-111.6	96.1	178.2	-62.2	-74	175.4	158.7	0	108.9	E574 T629 K630 G634 R635 T636	E574-K632 WeakPolarHBondContact OE1-CE 3.4Å; E574-K632 IonicContact OE1-NZ 2.71Å; E574-K632 PolarHBondContact OE1-NZ 3.36Å; E574-K632 WeakPolarHBondContact OE2-CE 3.48Å; E574-K632 IonicContact OE2-NZ 3.61Å; E574-K632 PolarHBondContact OE2-NZ 3.19Å; T629-K632 PolarHBondContact O-N 3.05Å; T629-K632 VanDerWaalsContact O-N 3.09Å; K630-K632 PolarHBondContact O-N 3.36Å; K630-K632 VanDerWaalsContact O-N 3.13Å; K632-G634 PolarHBondContact O-N 2.78Å; K632-R635 HydrophobicContact CB-CB 4.02Å; K632-R635 HydrophobicContact CB-CG 4.14Å; K632-R635 PolarHBondContact O-N 2.86Å; K632-T636 PolarHBondContact O-N 3.41Å; K632-T636 PolarHBondContact O-OG1 3.38Å
633	H	89.7	Confident	92.2	Very high	105 Å²	105	53 Å²	53	49%	0.486	25%	0.253	S	S	.	.	H	α-helix	trans	-59.5	-43.7	-176.7	-66	-39.3	0	0	0	112.5	R635 T636 M637 K672 Y673	H633-R635 PolarHBondContact O-N 3.38Å; H633-T636 PolarHBondContact O-N 3.42Å; H633-M637 WeakPolarHBondContact O-CG 3.31Å; H633-M637 PolarHBondContact O-N 3.41Å; H633-K672 PolarHBondContact CE1-NZ 3.27Å; H633-K672 PolarHBondContact ND1-NZ 3.48Å; H633-K672 VanDerWaalsContact ND1-NZ 3.19Å; H633-Y673 WeakPolarHBondContact CB-OH 3.47Å; H633-Y673 PolarHBondContact ND1-OH 3.28Å
634	G	91.1	Very high	92.1	Very high	52 Å²	52	52.2 Å²	52.2	54%	0.536	25%	0.25	S	S	.	.	H	α-helix	trans	-58.8	-47.1	176.3	0	0	0	0	0	113	K632 T636 M637 M638	K632-G634 PolarHBondContact O-N 2.78Å; G634-T636 VanDerWaalsContact C-N 3.33Å; G634-T636 PolarHBondContact O-N 3.44Å; G634-M637 WeakPolarHBondContact O-CB 3.28Å; G634-M637 PolarHBondContact O-N 3.49Å; G634-M638 WeakPolarHBondContact O-CG 3.41Å; G634-M638 PolarHBondContact O-N 3.01Å
635	R	93.9	Very high	91.8	Very high	17 Å²	17	52.4 Å²	52.4	6%	0.064	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-30.8	177.2	-61.5	176.8	-174.6	158.7	4.2	112.7	E574 I586 L628 T629 K632 H633 M638 L639	E574-R635 IonicContact OE1-CZ 2.74Å; E574-R635 IonicContact OE1-NH1 2.81Å; E574-R635 PolarHBondContact OE1-NH1 3.36Å; E574-R635 IonicContact OE1-NH2 3.97Å; E574-R635 PolarHBondContact OE1-NH2 2.8Å; E574-R635 IonicContact OE2-NH1 3.15Å; I586-R635 HydrophobicContact CD1-CB 4.42Å; L628-R635 WeakPolarHBondContact O-CD 3.22Å; L628-R635 PolarHBondContact O-NH1 3.07Å; L628-R635 VanDerWaalsContact O-NH1 3.12Å; T629-R635 HydrophobicContact CG2-CB 4.09Å; K632-R635 HydrophobicContact CB-CB 4.02Å; K632-R635 HydrophobicContact CB-CG 4.14Å; K632-R635 PolarHBondContact O-N 2.86Å; H633-R635 PolarHBondContact O-N 3.38Å; R635-M638 WeakPolarHBondContact O-CB 3.44Å; R635-M638 PolarHBondContact O-N 3.32Å; R635-L639 PolarHBondContact O-N 2.82Å
636	T	91.7	Very high	91.5	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-70.1	-36.8	172.8	-52.3	0	0	0	0	111.3	T629 K632 H633 G634 M638 L639 V640 S669 Q670 Y673	T629-T636 PolarHBondContact O-OG1 3Å; K632-T636 PolarHBondContact O-N 3.41Å; K632-T636 PolarHBondContact O-OG1 3.38Å; H633-T636 PolarHBondContact O-N 3.42Å; G634-T636 VanDerWaalsContact C-N 3.33Å; G634-T636 PolarHBondContact O-N 3.44Å; T636-M638 VanDerWaalsContact C-N 3.35Å; T636-L639 WeakPolarHBondContact O-CB 3.39Å; T636-L639 PolarHBondContact O-N 2.81Å; T636-V640 PolarHBondContact O-N 3.48Å; T636-S669 WeakPolarHBondContact CG2-O 3.22Å; T636-Q670 HydrophobicContact CG2-CG 4.29Å; T636-Y673 HydrophobicContact CG2-CD2 4Å; T636-Y673 HydrophobicContact CG2-CE2 3.63Å
637	M	91.8	Very high	91.3	Very high	65 Å²	65	55.6 Å²	55.6	32%	0.32	27%	0.273	S	S	.	.	H	α-helix	trans	-63.5	-40.6	172.2	-78.3	-68.1	-73.7	0	0	111.4	H633 G634 L639 V640 V641 Y673	H633-M637 WeakPolarHBondContact O-CG 3.31Å; H633-M637 PolarHBondContact O-N 3.41Å; G634-M637 WeakPolarHBondContact O-CB 3.28Å; G634-M637 PolarHBondContact O-N 3.49Å; M637-L639 VanDerWaalsContact C-N 3.25Å; M637-L639 PolarHBondContact O-N 3.09Å; M637-V640 WeakPolarHBondContact O-CA 3.4Å; M637-V640 WeakPolarHBondContact O-CB 3.3Å; M637-V640 PolarHBondContact O-N 3.3Å; M637-V641 WeakPolarHBondContact O-CG2 3.39Å; M637-V641 PolarHBondContact O-N 3.28Å; M637-Y673 HydrophobicContact CG-CD1 4.18Å; M637-Y673 HydrophobicContact CG-CE1 3.84Å; M637-Y673 HydrophobicContact CG-CE2 4.45Å; M637-Y673 HydrophobicContact SD-CD1 3.14Å; M637-Y673 WeakPolarHBondContact SD-CD1 3.34Å; M637-Y673 HydrophobicContact SD-CD2 4.16Å; M637-Y673 HydrophobicContact SD-CE1 3.4Å; M637-Y673 WeakPolarHBondContact SD-CE1 3.32Å; M637-Y673 HydrophobicContact SD-CE2 4.38Å; M637-Y673 HydrophobicContact SD-CG 3.53Å; M637-Y673 VanDerWaalsContact SD-CG 3.53Å
638	M	92.9	Very high	91.2	Very high	67 Å²	67	53.8 Å²	53.8	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-54.1	-41.1	172.8	-68.7	172.6	172.1	0	0	112.1	V581 G634 R635 T636 V640 V641 Y642	V581-M638 HydrophobicContact CG1-SD 4.37Å; G634-M638 WeakPolarHBondContact O-CG 3.41Å; G634-M638 PolarHBondContact O-N 3.01Å; R635-M638 WeakPolarHBondContact O-CB 3.44Å; R635-M638 PolarHBondContact O-N 3.32Å; T636-M638 VanDerWaalsContact C-N 3.35Å; M638-V640 PolarHBondContact O-N 3.44Å; M638-V641 PolarHBondContact O-N 3.49Å; M638-Y642 HydrophobicContact CB-CD2 4.27Å; M638-Y642 HydrophobicContact CB-CE2 4.17Å; M638-Y642 WeakPolarHBondContact O-CB 3.41Å; M638-Y642 WeakPolarHBondContact O-CD2 3.2Å; M638-Y642 PolarHBondContact O-N 3.05Å
639	L	93.4	Very high	90.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.2	-34.2	175.4	-69.6	179.2	0	0	0	113.4	I586 L590 L625 T629 R635 T636 M637 S644 L666 Q670	I586-L639 HydrophobicContact CG2-CD2 3.74Å; L590-L639 HydrophobicContact CD1-CD2 4.14Å; L590-L639 HydrophobicContact CD2-CD2 4.46Å; L625-L639 HydrophobicContact CD1-CD2 4Å; L625-L639 HydrophobicContact CD2-CD2 4.19Å; L625-L639 HydrophobicContact CG-CD2 4.32Å; T629-L639 HydrophobicContact CG2-CD1 3.64Å; T629-L639 HydrophobicContact CG2-CD2 4.48Å; T629-L639 HydrophobicContact CG2-CG 3.97Å; R635-L639 PolarHBondContact O-N 2.82Å; T636-L639 WeakPolarHBondContact O-CB 3.39Å; T636-L639 PolarHBondContact O-N 2.81Å; M637-L639 VanDerWaalsContact C-N 3.25Å; M637-L639 PolarHBondContact O-N 3.09Å; L639-S644 WeakPolarHBondContact CB-OG 3.42Å; L639-S644 VanDerWaalsContact O-CB 3.25Å; L639-S644 WeakPolarHBondContact O-CB 3.46Å; L639-S644 PolarHBondContact O-N 3.04Å; L639-S644 PolarHBondContact O-OG 3.06Å; L639-L666 HydrophobicContact CD1-CD2 4.02Å; L639-Q670 HydrophobicContact CB-CG 4.15Å; L639-Q670 HydrophobicContact CD1-CG 4.38Å
640	V	92.7	Very high	90.5	Very high	33 Å²	33	57.8 Å²	57.8	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-74.5	-44.1	178.2	178.6	0	0	0	0	109.9	T636 M637 M638 Y642 K643 Q670 Y673 L674	T636-V640 PolarHBondContact O-N 3.48Å; M637-V640 WeakPolarHBondContact O-CA 3.4Å; M637-V640 WeakPolarHBondContact O-CB 3.3Å; M637-V640 PolarHBondContact O-N 3.3Å; M638-V640 PolarHBondContact O-N 3.44Å; V640-Y642 VanDerWaalsContact C-N 3.3Å; V640-Y642 PolarHBondContact O-N 3.15Å; V640-K643 PolarHBondContact O-N 3.08Å; V640-Q670 HydrophobicContact CG2-CB 4.15Å; V640-Q670 HydrophobicContact CG2-CG 4.06Å; V640-Y673 HydrophobicContact CG2-CD2 4.35Å; V640-Y673 HydrophobicContact CG2-CG 4.43Å; V640-L674 HydrophobicContact CG1-CD2 4.06Å
641	V	93.2	Very high	90.4	Very high	69 Å²	69	52.7 Å²	52.7	42%	0.418	26%	0.258	S	S	.	.	H	α-helix	trans	-58.5	-43.1	175.2	174.7	0	0	0	0	110.8	V338 M637 M638 K643	V338-V641 HydrophobicContact CG1-CG2 4.08Å; M637-V641 WeakPolarHBondContact O-CG2 3.39Å; M637-V641 PolarHBondContact O-N 3.28Å; M638-V641 PolarHBondContact O-N 3.49Å; V641-K643 PolarHBondContact O-N 3.24Å; V641-K643 VanDerWaalsContact O-N 3.13Å
642	Y	93.5	Very high	90.6	Very high	103 Å²	103	45.2 Å²	45.2	40%	0.404	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	12.2	175.1	-67.9	-55.3	0	0	0	114.6	I586 P587 L590 M638 V640 S644	I586-Y642 HydrophobicContact CG2-CD2 4.15Å; I586-Y642 HydrophobicContact CG2-CE2 4.44Å; P587-Y642 HydrophobicContact CB-CD1 4.25Å; P587-Y642 HydrophobicContact CB-CD2 4.45Å; P587-Y642 HydrophobicContact CB-CE1 4Å; P587-Y642 HydrophobicContact CB-CE2 4.23Å; P587-Y642 HydrophobicContact CB-CG 4.48Å; P587-Y642 HydrophobicContact CG-CE1 4.45Å; P587-Y642 HydrophobicContact CG-CE2 4.24Å; L590-Y642 HydrophobicContact CD1-CG 4.37Å; M638-Y642 HydrophobicContact CB-CD2 4.27Å; M638-Y642 HydrophobicContact CB-CE2 4.17Å; M638-Y642 WeakPolarHBondContact O-CB 3.41Å; M638-Y642 WeakPolarHBondContact O-CD2 3.2Å; M638-Y642 PolarHBondContact O-N 3.05Å; V640-Y642 VanDerWaalsContact C-N 3.3Å; V640-Y642 PolarHBondContact O-N 3.15Å; Y642-S644 PolarHBondContact O-N 3.19Å; Y642-S644 VanDerWaalsContact O-N 3.14Å
643	K	93	Very high	90.3	Very high	168 Å²	168	46.8 Å²	46.8	73%	0.73	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	43	178.1	-58.9	-179.1	-179.9	176.5	0	112.8	V640 V641 A645 P646	V640-K643 PolarHBondContact O-N 3.08Å; V641-K643 PolarHBondContact O-N 3.24Å; V641-K643 VanDerWaalsContact O-N 3.13Å; K643-A645 VanDerWaalsContact C-N 3.33Å; K643-A645 PolarHBondContact O-N 3.41Å; K643-P646 WeakPolarHBondContact O-CD 3.47Å
644	S	93.4	Very high	89.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.4	-23.5	-176.2	65.1	0	0	0	0	114.3	L590 L639 Y642 I647 L648 Q670	L590-S644 VanDerWaalsContact CD2-CB 3.42Å; L639-S644 WeakPolarHBondContact CB-OG 3.42Å; L639-S644 VanDerWaalsContact O-CB 3.25Å; L639-S644 WeakPolarHBondContact O-CB 3.46Å; L639-S644 PolarHBondContact O-N 3.04Å; L639-S644 PolarHBondContact O-OG 3.06Å; Y642-S644 PolarHBondContact O-N 3.19Å; Y642-S644 VanDerWaalsContact O-N 3.14Å; S644-I647 WeakPolarHBondContact O-CB 3.39Å; S644-I647 PolarHBondContact O-N 2.78Å; S644-I647 VanDerWaalsContact O-N 3.11Å; S644-L648 WeakPolarHBondContact O-CG 3.33Å; S644-L648 PolarHBondContact O-N 2.95Å; S644-Q670 PolarHBondContact OG-NE2 2.97Å; S644-Q670 PolarHBondContact OG-OE1 2.86Å
645	A	91.3	Very high	89.1	Confident	4 Å²	4	43.3 Å²	43.3	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-45.7	-175	0	0	0	0	0	114.1	K643 I647 L648 K649 L667 L674 W678	K643-A645 VanDerWaalsContact C-N 3.33Å; K643-A645 PolarHBondContact O-N 3.41Å; A645-I647 PolarHBondContact O-N 3.2Å; A645-L648 PolarHBondContact O-N 2.85Å; A645-K649 VanDerWaalsContact O-CB 3.3Å; A645-K649 WeakPolarHBondContact O-CB 3.21Å; A645-K649 PolarHBondContact O-N 3.15Å; A645-L667 HydrophobicContact CB-CD2 3.99Å; A645-L674 HydrophobicContact CB-CD1 3.85Å; A645-L674 HydrophobicContact CB-CD2 4.21Å; A645-W678 HydrophobicContact CB-CZ2 4.38Å
646	P	89.7	Confident	88.6	Confident	74 Å²	74	43.4 Å²	43.4	48%	0.481	21%	0.206	S	C	.	.	H	α-helix	trans	-58.4	-39.7	170.8	-27	33.1	0	0	0	114.8	K643 K649 R650	K643-P646 WeakPolarHBondContact O-CD 3.47Å; P646-K649 PolarHBondContact O-N 3.02Å; P646-R650 PolarHBondContact O-N 3.32Å; P646-R650 VanDerWaalsContact O-N 3.11Å
647	I	90.3	Very high	88.2	Confident	17 Å²	17	43.9 Å²	43.9	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-52.4	178.6	-58	171.1	0	0	0	109.1	L590 F593 D594 S644 A645 K649 R650 T651	L590-I647 HydrophobicContact CB-CD1 4.13Å; F593-I647 HydrophobicContact CB-CG2 3.62Å; D594-I647 HydrophobicContact CB-CD1 4.29Å; D594-I647 HydrophobicContact CB-CG1 4.45Å; D594-I647 HydrophobicContact CB-CG2 4.44Å; S644-I647 WeakPolarHBondContact O-CB 3.39Å; S644-I647 PolarHBondContact O-N 2.78Å; S644-I647 VanDerWaalsContact O-N 3.11Å; A645-I647 PolarHBondContact O-N 3.2Å; I647-K649 VanDerWaalsContact C-N 3.27Å; I647-K649 PolarHBondContact O-N 2.89Å; I647-R650 WeakPolarHBondContact O-CB 3.47Å; I647-R650 PolarHBondContact O-N 2.78Å; I647-T651 PolarHBondContact O-N 3.2Å; I647-T651 PolarHBondContact O-OG1 3.2Å; I647-T651 VanDerWaalsContact O-OG1 3.12Å
648	L	90.7	Very high	87.8	Confident	1 Å²	1	41 Å²	41	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-34.7	178.9	-65.7	170.2	0	0	0	112.5	L622 S644 A645 R650 T651 L652 A663 L666 L667 Q670	L622-L648 HydrophobicContact CD2-CD2 3.95Å; S644-L648 WeakPolarHBondContact O-CG 3.33Å; S644-L648 PolarHBondContact O-N 2.95Å; A645-L648 PolarHBondContact O-N 2.85Å; L648-R650 VanDerWaalsContact C-N 3.34Å; L648-T651 WeakPolarHBondContact O-CB 3.46Å; L648-T651 PolarHBondContact O-N 3.48Å; L648-L652 WeakPolarHBondContact O-CG 3.37Å; L648-L652 PolarHBondContact O-N 3.36Å; L648-A663 HydrophobicContact CD2-CB 4.44Å; L648-L666 HydrophobicContact CD1-CB 3.55Å; L648-L666 HydrophobicContact CD1-CD1 4.29Å; L648-L666 HydrophobicContact CD2-CB 4.45Å; L648-L666 HydrophobicContact CD2-CD1 3.85Å; L648-L667 HydrophobicContact CB-CD1 4.04Å; L648-L667 HydrophobicContact CB-CD2 3.93Å; L648-L667 HydrophobicContact CB-CG 3.87Å; L648-L667 HydrophobicContact CD1-CD2 4.22Å; L648-L667 HydrophobicContact CD1-CG 4.15Å; L648-Q670 VanDerWaalsContact CD1-NE2 3.3Å
649	K	87.6	Confident	87.5	Confident	34 Å²	34	37.9 Å²	37.9	15%	0.148	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-37.6	175	-172.4	179.8	-179.6	178.5	0	111.7	F314 A645 P646 I647 L652 N682	F314-K649 HydrophobicContact CD1-CD 4.07Å; F314-K649 HydrophobicContact CD1-CG 3.98Å; F314-K649 HydrophobicContact CD2-CG 4.16Å; F314-K649 HydrophobicContact CE1-CD 4.15Å; F314-K649 HydrophobicContact CE1-CG 3.78Å; F314-K649 HydrophobicContact CE2-CG 4.01Å; F314-K649 HydrophobicContact CG-CD 4.42Å; F314-K649 VanDerWaalsContact CG-CE 3.44Å; F314-K649 HydrophobicContact CG-CG 4.12Å; F314-K649 HydrophobicContact CZ-CG 3.8Å; A645-K649 VanDerWaalsContact O-CB 3.3Å; A645-K649 WeakPolarHBondContact O-CB 3.21Å; A645-K649 PolarHBondContact O-N 3.15Å; P646-K649 PolarHBondContact O-N 3.02Å; I647-K649 VanDerWaalsContact C-N 3.27Å; I647-K649 PolarHBondContact O-N 2.89Å; K649-L652 PolarHBondContact O-N 3.11Å; K649-N682 PolarHBondContact NZ-OD1 3.02Å
650	R	87.1	Confident	87.3	Confident	54 Å²	54	38 Å²	38	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-39.5	172.8	-76.2	-176.9	-75.2	160.5	-4.1	111.7	D594 V597 S598 P646 I647 L648 L652 R653	D594-R650 IonicContact OD1-CZ 3.79Å; D594-R650 IonicContact OD1-NH1 3.13Å; D594-R650 PolarHBondContact OD1-NH1 2.69Å; D594-R650 IonicContact OD1-NH2 2.8Å; D594-R650 PolarHBondContact OD1-NH2 3.02Å; V597-R650 HydrophobicContact CG1-CB 3.68Å; S598-R650 PolarHBondContact OG-NH1 3Å; P646-R650 PolarHBondContact O-N 3.32Å; P646-R650 VanDerWaalsContact O-N 3.11Å; I647-R650 WeakPolarHBondContact O-CB 3.47Å; I647-R650 PolarHBondContact O-N 2.78Å; L648-R650 VanDerWaalsContact C-N 3.34Å; R650-L652 PolarHBondContact O-N 3.3Å; R650-L652 VanDerWaalsContact O-N 3.13Å; R650-R653 VanDerWaalsContact O-CB 3.25Å; R650-R653 WeakPolarHBondContact O-CB 3.49Å; R650-R653 WeakPolarHBondContact O-CG 3.35Å; R650-R653 PolarHBondContact O-N 2.83Å
651	T	85.2	Confident	86.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.2	-29.1	176.4	-47.1	0	0	0	0	112.7	F593 L622 I647 L648 R653 V654 L659	F593-T651 HydrophobicContact CD1-CG2 4Å; F593-T651 HydrophobicContact CE1-CG2 3.89Å; L622-T651 HydrophobicContact CD1-CG2 4.45Å; I647-T651 PolarHBondContact O-N 3.2Å; I647-T651 PolarHBondContact O-OG1 3.2Å; I647-T651 VanDerWaalsContact O-OG1 3.12Å; L648-T651 WeakPolarHBondContact O-CB 3.46Å; L648-T651 PolarHBondContact O-N 3.48Å; T651-R653 PolarHBondContact O-N 3.16Å; T651-V654 PolarHBondContact O-N 2.99Å; T651-L659 HydrophobicContact CG2-CD1 4.3Å; T651-L659 HydrophobicContact CG2-CD2 3.75Å; T651-L659 HydrophobicContact CG2-CG 3.9Å
652	L	84	Confident	86.7	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.016	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.7	175.8	-62.8	176.1	0	0	0	114.3	L312 F314 L648 K649 R650 V654 Q660 A663 L664 L667 L685	L312-L652 HydrophobicContact CD1-CB 4.43Å; L312-L652 HydrophobicContact CD1-CD1 4.34Å; F314-L652 HydrophobicContact CE2-CB 3.93Å; F314-L652 HydrophobicContact CE2-CD1 4.16Å; F314-L652 HydrophobicContact CZ-CB 4.4Å; F314-L652 HydrophobicContact CZ-CD1 3.77Å; L648-L652 WeakPolarHBondContact O-CG 3.37Å; L648-L652 PolarHBondContact O-N 3.36Å; K649-L652 PolarHBondContact O-N 3.11Å; R650-L652 PolarHBondContact O-N 3.3Å; R650-L652 VanDerWaalsContact O-N 3.13Å; L652-V654 VanDerWaalsContact C-N 3.3Å; L652-Q660 HydrophobicContact CD2-CB 3.98Å; L652-Q660 HydrophobicContact CD2-CG 4.04Å; L652-Q660 PolarHBondContact O-NE2 2.93Å; L652-A663 HydrophobicContact CD2-CB 3.8Å; L652-A663 HydrophobicContact CG-CB 4.49Å; L652-L664 HydrophobicContact CD1-CD2 3.88Å; L652-L664 HydrophobicContact CD2-CD2 4.08Å; L652-L664 HydrophobicContact CD2-CG 3.9Å; L652-L667 HydrophobicContact CD1-CD1 3.82Å; L652-L685 HydrophobicContact CD1-CD1 3.38Å
653	R	79.8	Confident	86.6	Confident	111 Å²	111	29.2 Å²	29.2	42%	0.419	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-27	173.9	-66.2	179.2	173.5	-174.5	-4.5	112.5	L316 T601 R650 T651 K655	L316-R653 VanDerWaalsContact CD1-NH2 3.32Å; T601-R653 VanDerWaalsContact CG2-NH1 3.29Å; R650-R653 VanDerWaalsContact O-CB 3.25Å; R650-R653 WeakPolarHBondContact O-CB 3.49Å; R650-R653 WeakPolarHBondContact O-CG 3.35Å; R650-R653 PolarHBondContact O-N 2.83Å; T651-R653 PolarHBondContact O-N 3.16Å; R653-K655 PolarHBondContact O-N 2.92Å
654	V	78.7	Confident	86.4	Confident	26 Å²	26	21.2 Å²	21.2	16%	0.158	10%	0.103	C	C	.	.	S	Bend	trans	-69.8	121.2	174.4	-178.4	0	0	0	0	108.1	I22 T651 L652 Q656 L659 Q660	I22-V654 HydrophobicContact CD1-CG1 4.04Å; T651-V654 PolarHBondContact O-N 2.99Å; L652-V654 VanDerWaalsContact C-N 3.3Å; V654-Q656 HydrophobicContact CG1-CB 4.24Å; V654-Q656 PolarHBondContact O-N 2.93Å; V654-L659 HydrophobicContact CB-CD2 3.82Å; V654-L659 HydrophobicContact CG1-CD2 3.86Å; V654-L659 HydrophobicContact CG2-CD2 4.3Å; V654-Q660 PolarHBondContact O-NE2 3.34Å
655	K	78.3	Confident	86.1	Confident	58 Å²	58	23.8 Å²	23.8	25%	0.252	11%	0.114	S	C	.	.			trans	-79.4	58.2	-176.2	-65.6	-177.4	179.2	179.4	0	111.9	S18 P308 R653	S18-K655 PolarHBondContact O-NZ 3.22Å; P308-K655 HydrophobicContact CB-CB 4.24Å; P308-K655 HydrophobicContact CG-CB 4.38Å; R653-K655 PolarHBondContact O-N 2.92Å
656	Q	82.4	Confident	86	Confident	18 Å²	18	23.6 Å²	23.6	8%	0.084	11%	0.113	C	C	.	.			trans	-129.4	119.8	177.3	-160.1	-80.7	-23.8	0	0	110.5	F24 L615 V654 L658 L659 Q660	F24-Q656 HydrophobicContact CD1-CG 4.28Å; L615-Q656 HydrophobicContact CD1-CB 4.34Å; L615-Q656 HydrophobicContact CD1-CG 4.24Å; L615-Q656 HydrophobicContact CD2-CG 4.14Å; V654-Q656 HydrophobicContact CG1-CB 4.24Å; V654-Q656 PolarHBondContact O-N 2.93Å; Q656-L658 VanDerWaalsContact NE2-CB 3.3Å; Q656-L658 PolarHBondContact O-N 2.8Å; Q656-L658 VanDerWaalsContact OE1-N 3.17Å; Q656-L659 HydrophobicContact CB-CB 4.36Å; Q656-L659 PolarHBondContact O-N 3.14Å; Q656-Q660 WeakPolarHBondContact O-CB 3.5Å; Q656-Q660 VanDerWaalsContact O-CG 3.31Å; Q656-Q660 WeakPolarHBondContact O-CG 3.4Å; Q656-Q660 PolarHBondContact O-N 3.25Å
657	A	82.8	Confident	86.1	Confident	17 Å²	17	20.1 Å²	20.1	14%	0.14	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-40	-166.6	0	0	0	0	0	113.5	M306 L661	M306-A657 HydrophobicContact CB-CB 4Å; M306-A657 VanDerWaalsContact O-CB 3.29Å; M306-A657 WeakPolarHBondContact O-CB 3.38Å; A657-L661 VanDerWaalsContact O-CB 3.28Å; A657-L661 WeakPolarHBondContact O-CB 3.31Å; A657-L661 PolarHBondContact O-N 2.67Å
658	L	84.8	Confident	85.9	Confident	5 Å²	5	21.6 Å²	21.6	3%	0.026	10%	0.096	C	C	.	.	H	α-helix	trans	-66.9	-43.9	-178.3	-168.4	71.3	0	0	0	112	Y26 A303 V619 Q656 L661 F662	Y26-L658 HydrophobicContact CD1-CD2 3.34Å; Y26-L658 HydrophobicContact CD2-CD2 4.1Å; Y26-L658 HydrophobicContact CE1-CD2 3.83Å; Y26-L658 HydrophobicContact CE2-CD2 4.34Å; Y26-L658 HydrophobicContact CG-CD2 3.53Å; A303-L658 HydrophobicContact CB-CB 4.46Å; A303-L658 HydrophobicContact CB-CD1 3.38Å; V619-L658 HydrophobicContact CG1-CD2 3.48Å; V619-L658 VanDerWaalsContact CG1-CD2 3.48Å; V619-L658 HydrophobicContact CG1-CG 3.92Å; V619-L658 HydrophobicContact CG2-CD2 4.39Å; Q656-L658 VanDerWaalsContact NE2-CB 3.3Å; Q656-L658 PolarHBondContact O-N 2.8Å; Q656-L658 VanDerWaalsContact OE1-N 3.17Å; L658-L661 WeakPolarHBondContact O-CB 3.36Å; L658-L661 PolarHBondContact O-N 3.04Å; L658-F662 HydrophobicContact CD1-CD2 4.42Å; L658-F662 HydrophobicContact CD1-CE2 3.68Å; L658-F662 HydrophobicContact CG-CD2 4.17Å; L658-F662 HydrophobicContact CG-CE2 3.81Å; L658-F662 WeakPolarHBondContact O-CD2 3.33Å; L658-F662 PolarHBondContact O-N 2.86Å; L658-F662 VanDerWaalsContact O-N 3.1Å
659	L	86.6	Confident	85.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64	-49.2	177.4	-173.6	78.5	0	0	0	109.5	F593 L615 L618 V619 L622 T651 V654 Q656 L661 F662 A663	F593-L659 HydrophobicContact CE1-CD1 4.42Å; L615-L659 HydrophobicContact CD1-CD2 4.37Å; L618-L659 HydrophobicContact CB-CD1 3.84Å; V619-L659 HydrophobicContact CG2-CB 4.14Å; V619-L659 HydrophobicContact CG2-CD1 3.97Å; L622-L659 HydrophobicContact CD1-CD1 3.49Å; L622-L659 VanDerWaalsContact CD1-CD1 3.49Å; L622-L659 HydrophobicContact CD1-CG 3.97Å; L622-L659 WeakPolarHBondContact CD1-O 3.24Å; L622-L659 HydrophobicContact CG-CD1 4.25Å; T651-L659 HydrophobicContact CG2-CD1 4.3Å; T651-L659 HydrophobicContact CG2-CD2 3.75Å; T651-L659 HydrophobicContact CG2-CG 3.9Å; V654-L659 HydrophobicContact CB-CD2 3.82Å; V654-L659 HydrophobicContact CG1-CD2 3.86Å; V654-L659 HydrophobicContact CG2-CD2 4.3Å; Q656-L659 HydrophobicContact CB-CB 4.36Å; Q656-L659 PolarHBondContact O-N 3.14Å; L659-L661 VanDerWaalsContact C-N 3.3Å; L659-L661 PolarHBondContact O-N 3.15Å; L659-F662 PolarHBondContact O-N 2.88Å; L659-A663 WeakPolarHBondContact O-CB 3.39Å; L659-A663 PolarHBondContact O-N 3.25Å
660	Q	87.4	Confident	85.8	Confident	3 Å²	3	21.8 Å²	21.8	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-59.4	-42.2	175.8	-71.6	-176.4	-3.4	0	0	111.4	I309 L652 V654 Q656 F662 A663 L664	I309-Q660 PolarHBondContact O-NE2 3.34Å; L652-Q660 HydrophobicContact CD2-CB 3.98Å; L652-Q660 HydrophobicContact CD2-CG 4.04Å; L652-Q660 PolarHBondContact O-NE2 2.93Å; V654-Q660 PolarHBondContact O-NE2 3.34Å; Q656-Q660 WeakPolarHBondContact O-CB 3.5Å; Q656-Q660 VanDerWaalsContact O-CG 3.31Å; Q656-Q660 WeakPolarHBondContact O-CG 3.4Å; Q656-Q660 PolarHBondContact O-N 3.25Å; Q660-F662 PolarHBondContact O-N 3.23Å; Q660-A663 PolarHBondContact O-N 3.34Å; Q660-L664 WeakPolarHBondContact O-CB 3.37Å; Q660-L664 WeakPolarHBondContact O-CG 3.19Å; Q660-L664 PolarHBondContact O-N 3.32Å
661	L	85.5	Confident	85.8	Confident	6 Å²	6	19.3 Å²	19.3	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-55.7	-50.9	176	174.2	66.3	0	0	0	111.3	T299 A303 W392 A657 L658 L659 L664 K665 R693	T299-L661 HydrophobicContact CG2-CD2 3.92Å; A303-L661 HydrophobicContact CB-CD2 4.05Å; W392-L661 HydrophobicContact CH2-CD1 3.31Å; W392-L661 HydrophobicContact CH2-CD2 3.52Å; W392-L661 HydrophobicContact CH2-CG 4.01Å; W392-L661 HydrophobicContact CZ2-CD1 3.48Å; W392-L661 VanDerWaalsContact CZ2-CD1 3.48Å; W392-L661 HydrophobicContact CZ2-CD2 4.49Å; W392-L661 HydrophobicContact CZ3-CD1 4.3Å; W392-L661 HydrophobicContact CZ3-CD2 4.12Å; A657-L661 VanDerWaalsContact O-CB 3.28Å; A657-L661 WeakPolarHBondContact O-CB 3.31Å; A657-L661 PolarHBondContact O-N 2.67Å; L658-L661 WeakPolarHBondContact O-CB 3.36Å; L658-L661 PolarHBondContact O-N 3.04Å; L659-L661 VanDerWaalsContact C-N 3.3Å; L659-L661 PolarHBondContact O-N 3.15Å; L661-L664 PolarHBondContact O-N 2.94Å; L661-K665 WeakPolarHBondContact O-CG 3.43Å; L661-K665 PolarHBondContact O-N 3.39Å; L661-K665 VanDerWaalsContact O-N 3.09Å; L661-R693 PolarHBondContact O-NH2 3.24Å
662	F	89.7	Confident	85.8	Confident	14 Å²	14	24.8 Å²	24.8	6%	0.061	12%	0.116	C	C	.	.	H	α-helix	trans	-70.9	-34.2	-178.6	-71.8	-66.5	0	0	0	112.9	T299 V619 L622 R623 N626 L658 L659 Q660 K665 L666	T299-F662 HydrophobicContact CG2-CE1 4.48Å; T299-F662 HydrophobicContact CG2-CZ 3.95Å; V619-F662 HydrophobicContact CG1-CD2 4.43Å; L622-F662 HydrophobicContact CB-CB 3.73Å; L622-F662 HydrophobicContact CD1-CB 4.03Å; R623-F662 VanDerWaalsContact CD-CE2 3.48Å; R623-F662 HydrophobicContact CG-CD1 3.8Å; R623-F662 HydrophobicContact CG-CD2 3.56Å; R623-F662 HydrophobicContact CG-CE1 3.64Å; R623-F662 HydrophobicContact CG-CE2 3.39Å; R623-F662 HydrophobicContact CG-CG 3.81Å; R623-F662 HydrophobicContact CG-CZ 3.46Å; R623-F662 VanDerWaalsContact CG-CZ 3.46Å; N626-F662 WeakPolarHBondContact ND2-CB 3.49Å; N626-F662 PolarHBondContact ND2-O 2.89Å; L658-F662 HydrophobicContact CD1-CD2 4.42Å; L658-F662 HydrophobicContact CD1-CE2 3.68Å; L658-F662 HydrophobicContact CG-CD2 4.17Å; L658-F662 HydrophobicContact CG-CE2 3.81Å; L658-F662 WeakPolarHBondContact O-CD2 3.33Å; L658-F662 PolarHBondContact O-N 2.86Å; L658-F662 VanDerWaalsContact O-N 3.1Å; L659-F662 PolarHBondContact O-N 2.88Å; Q660-F662 PolarHBondContact O-N 3.23Å; F662-K665 HydrophobicContact CD1-CD 3.73Å; F662-K665 HydrophobicContact CE1-CD 4Å; F662-K665 WeakPolarHBondContact O-CA 3.48Å; F662-K665 WeakPolarHBondContact O-CB 3.45Å; F662-K665 PolarHBondContact O-N 2.94Å; F662-L666 PolarHBondContact O-N 3.49Å
663	A	90.3	Very high	86	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.9	-44.5	173.5	0	0	0	0	0	111.2	L622 L648 L652 L659 Q660 K665 L666 L667	L622-A663 HydrophobicContact CD1-CB 4.05Å; L648-A663 HydrophobicContact CD2-CB 4.44Å; L652-A663 HydrophobicContact CD2-CB 3.8Å; L652-A663 HydrophobicContact CG-CB 4.49Å; L659-A663 WeakPolarHBondContact O-CB 3.39Å; L659-A663 PolarHBondContact O-N 3.25Å; Q660-A663 PolarHBondContact O-N 3.34Å; A663-K665 PolarHBondContact O-N 3.04Å; A663-K665 VanDerWaalsContact O-N 3.16Å; A663-L666 PolarHBondContact O-N 3.33Å; A663-L667 WeakPolarHBondContact O-CG 3.21Å; A663-L667 PolarHBondContact O-N 3.16Å
664	L	88.3	Confident	86.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-60.6	-24.2	171.4	-67.7	171.8	0	0	0	111.7	I309 L652 Q660 L661 K668 L685 I689 N692 R693	I309-L664 HydrophobicContact CD1-CD1 3.85Å; L652-L664 HydrophobicContact CD1-CD2 3.88Å; L652-L664 HydrophobicContact CD2-CD2 4.08Å; L652-L664 HydrophobicContact CD2-CG 3.9Å; Q660-L664 WeakPolarHBondContact O-CB 3.37Å; Q660-L664 WeakPolarHBondContact O-CG 3.19Å; Q660-L664 PolarHBondContact O-N 3.32Å; L661-L664 PolarHBondContact O-N 2.94Å; L664-K668 WeakPolarHBondContact O-CB 3.27Å; L664-K668 PolarHBondContact O-N 3.42Å; L664-L685 HydrophobicContact CD2-CD1 3.64Å; L664-I689 HydrophobicContact CB-CG1 4.35Å; L664-I689 HydrophobicContact CD2-CG1 3.68Å; L664-N692 HydrophobicContact CD1-CB 4.26Å; L664-R693 PolarHBondContact O-NE 3.19Å; L664-R693 PolarHBondContact O-NH2 3.45Å
665	K	87.1	Confident	86.6	Confident	54 Å²	54	24.8 Å²	24.8	24%	0.235	13%	0.127	C	C	.	.	H	α-helix	trans	-70.2	-41.7	-178.3	-73.1	-178.8	177.6	158.1	0	110.2	N626 L661 F662 A663 S669 R693	N626-K665 WeakPolarHBondContact OD1-CB 3.29Å; L661-K665 WeakPolarHBondContact O-CG 3.43Å; L661-K665 PolarHBondContact O-N 3.39Å; L661-K665 VanDerWaalsContact O-N 3.09Å; F662-K665 HydrophobicContact CD1-CD 3.73Å; F662-K665 HydrophobicContact CE1-CD 4Å; F662-K665 WeakPolarHBondContact O-CA 3.48Å; F662-K665 WeakPolarHBondContact O-CB 3.45Å; F662-K665 PolarHBondContact O-N 2.94Å; A663-K665 PolarHBondContact O-N 3.04Å; A663-K665 VanDerWaalsContact O-N 3.16Å; K665-S669 PolarHBondContact O-N 3.05Å; K665-R693 VanDerWaalsContact CG-CZ 3.43Å; K665-R693 VanDerWaalsContact N-CZ 3.34Å
666	L	90.5	Very high	87	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.9	-40.6	175.9	-61.7	169.9	0	0	0	111.6	L622 L625 N626 T629 L639 L648 F662 A663 K668 S669 Q670	L622-L666 HydrophobicContact CD2-CD1 3.96Å; L625-L666 HydrophobicContact CB-CD1 4.21Å; L625-L666 HydrophobicContact CD2-CD1 3.61Å; L625-L666 HydrophobicContact CG-CD1 3.9Å; L625-L666 HydrophobicContact CG-CD2 4.13Å; N626-L666 HydrophobicContact CB-CD2 4.47Å; N626-L666 WeakPolarHBondContact OD1-CD2 3.39Å; T629-L666 WeakPolarHBondContact OG1-CD2 3.45Å; L639-L666 HydrophobicContact CD1-CD2 4.02Å; L648-L666 HydrophobicContact CD1-CB 3.55Å; L648-L666 HydrophobicContact CD1-CD1 4.29Å; L648-L666 HydrophobicContact CD2-CB 4.45Å; L648-L666 HydrophobicContact CD2-CD1 3.85Å; F662-L666 PolarHBondContact O-N 3.49Å; A663-L666 PolarHBondContact O-N 3.33Å; L666-K668 VanDerWaalsContact C-N 3.34Å; L666-K668 PolarHBondContact O-N 3.02Å; L666-S669 PolarHBondContact O-N 3.41Å; L666-S669 PolarHBondContact O-OG 3.42Å; L666-Q670 VanDerWaalsContact O-CG 3.27Å; L666-Q670 WeakPolarHBondContact O-CG 3.48Å; L666-Q670 PolarHBondContact O-N 3.03Å; L666-Q670 VanDerWaalsContact O-N 3.08Å; L666-Q670 PolarHBondContact O-NE2 3.34Å
667	L	90.7	Very high	87	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-39.7	176.9	-72	165.1	0	0	0	112.1	A645 L648 L652 A663 Q670 A671 W678 L685 I689	A645-L667 HydrophobicContact CB-CD2 3.99Å; L648-L667 HydrophobicContact CB-CD1 4.04Å; L648-L667 HydrophobicContact CB-CD2 3.93Å; L648-L667 HydrophobicContact CB-CG 3.87Å; L648-L667 HydrophobicContact CD1-CD2 4.22Å; L648-L667 HydrophobicContact CD1-CG 4.15Å; L652-L667 HydrophobicContact CD1-CD1 3.82Å; A663-L667 WeakPolarHBondContact O-CG 3.21Å; A663-L667 PolarHBondContact O-N 3.16Å; L667-Q670 PolarHBondContact O-N 3.22Å; L667-A671 WeakPolarHBondContact O-CB 3.46Å; L667-A671 PolarHBondContact O-N 3.44Å; L667-W678 HydrophobicContact CD2-CZ2 4.47Å; L667-L685 HydrophobicContact CD1-CD1 3.95Å; L667-L685 HydrophobicContact CD1-CD2 4.05Å; L667-L685 HydrophobicContact CD2-CD2 4.37Å; L667-I689 HydrophobicContact CB-CD1 4.18Å
668	K	86.9	Confident	87.2	Confident	48 Å²	48	38.4 Å²	38.4	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-43.6	174.5	-175.9	-179.1	173.1	-173	0	112	L664 L666 Q670 A671 I689 V694 S696	L664-K668 WeakPolarHBondContact O-CB 3.27Å; L664-K668 PolarHBondContact O-N 3.42Å; L666-K668 VanDerWaalsContact C-N 3.34Å; L666-K668 PolarHBondContact O-N 3.02Å; K668-Q670 VanDerWaalsContact C-N 3.28Å; K668-Q670 PolarHBondContact O-N 3.44Å; K668-A671 PolarHBondContact O-N 3.46Å; K668-I689 HydrophobicContact CB-CD1 4.29Å; K668-I689 HydrophobicContact CB-CG2 3.85Å; K668-I689 HydrophobicContact CD-CG2 3.91Å; K668-I689 HydrophobicContact CG-CG2 3.9Å; K668-V694 PolarHBondContact NZ-O 2.89Å; K668-S696 PolarHBondContact NZ-OG 3.46Å
669	S	87.3	Confident	87.2	Confident	39 Å²	39	40.7 Å²	40.7	27%	0.273	19%	0.187	S	C	.	.	H	α-helix	trans	-67.1	-31.7	-179	64.1	0	0	0	0	112.3	T636 K665 L666	T636-S669 WeakPolarHBondContact CG2-O 3.22Å; K665-S669 PolarHBondContact O-N 3.05Å; L666-S669 PolarHBondContact O-N 3.41Å; L666-S669 PolarHBondContact O-OG 3.42Å
670	Q	89.5	Confident	87.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-79.3	-25.3	177	-67.2	175.3	50.1	0	0	114.2	T636 L639 V640 S644 L648 L666 L667 K668 K672 Y673 L674	T636-Q670 HydrophobicContact CG2-CG 4.29Å; L639-Q670 HydrophobicContact CB-CG 4.15Å; L639-Q670 HydrophobicContact CD1-CG 4.38Å; V640-Q670 HydrophobicContact CG2-CB 4.15Å; V640-Q670 HydrophobicContact CG2-CG 4.06Å; S644-Q670 PolarHBondContact OG-NE2 2.97Å; S644-Q670 PolarHBondContact OG-OE1 2.86Å; L648-Q670 VanDerWaalsContact CD1-NE2 3.3Å; L666-Q670 VanDerWaalsContact O-CG 3.27Å; L666-Q670 WeakPolarHBondContact O-CG 3.48Å; L666-Q670 PolarHBondContact O-N 3.03Å; L666-Q670 VanDerWaalsContact O-N 3.08Å; L666-Q670 PolarHBondContact O-NE2 3.34Å; L667-Q670 PolarHBondContact O-N 3.22Å; K668-Q670 VanDerWaalsContact C-N 3.28Å; K668-Q670 PolarHBondContact O-N 3.44Å; Q670-K672 PolarHBondContact O-N 3.46Å; Q670-Y673 WeakPolarHBondContact O-CB 3.3Å; Q670-Y673 PolarHBondContact O-N 3.12Å; Q670-L674 HydrophobicContact CB-CD1 4.04Å; Q670-L674 HydrophobicContact CB-CG 4.43Å; Q670-L674 PolarHBondContact O-N 2.99Å
671	A	86.7	Confident	86.9	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.017	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.6	-169.1	0	0	0	0	0	114.9	L667 K668 Y673 W678 F702	L667-A671 WeakPolarHBondContact O-CB 3.46Å; L667-A671 PolarHBondContact O-N 3.44Å; K668-A671 PolarHBondContact O-N 3.46Å; A671-Y673 VanDerWaalsContact C-N 3.31Å; A671-W678 HydrophobicContact CB-CZ3 4.33Å; A671-F702 HydrophobicContact CB-CE2 3.81Å; A671-F702 HydrophobicContact CB-CZ 4.25Å
672	K	83.8	Confident	86.8	Confident	115 Å²	115	53.7 Å²	53.7	50%	0.5	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-21.5	176.2	68.1	179.5	-170.9	164.2	0	113.9	H633 Q670	H633-K672 PolarHBondContact CE1-NZ 3.27Å; H633-K672 PolarHBondContact ND1-NZ 3.48Å; H633-K672 VanDerWaalsContact ND1-NZ 3.19Å; Q670-K672 PolarHBondContact O-N 3.46Å
673	Y	87.8	Confident	86.4	Confident	66 Å²	66	55 Å²	55	26%	0.259	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-18	-176.8	-58	-67.3	0	0	0	113.6	H633 T636 M637 V640 Q670 A671 G675	H633-Y673 WeakPolarHBondContact CB-OH 3.47Å; H633-Y673 PolarHBondContact ND1-OH 3.28Å; T636-Y673 HydrophobicContact CG2-CD2 4Å; T636-Y673 HydrophobicContact CG2-CE2 3.63Å; M637-Y673 HydrophobicContact CG-CD1 4.18Å; M637-Y673 HydrophobicContact CG-CE1 3.84Å; M637-Y673 HydrophobicContact CG-CE2 4.45Å; M637-Y673 HydrophobicContact SD-CD1 3.14Å; M637-Y673 WeakPolarHBondContact SD-CD1 3.34Å; M637-Y673 HydrophobicContact SD-CD2 4.16Å; M637-Y673 HydrophobicContact SD-CE1 3.4Å; M637-Y673 WeakPolarHBondContact SD-CE1 3.32Å; M637-Y673 HydrophobicContact SD-CE2 4.38Å; M637-Y673 HydrophobicContact SD-CG 3.53Å; M637-Y673 VanDerWaalsContact SD-CG 3.53Å; V640-Y673 HydrophobicContact CG2-CD2 4.35Å; V640-Y673 HydrophobicContact CG2-CG 4.43Å; Q670-Y673 WeakPolarHBondContact O-CB 3.3Å; Q670-Y673 PolarHBondContact O-N 3.12Å; A671-Y673 VanDerWaalsContact C-N 3.31Å; Y673-G675 PolarHBondContact O-N 3.25Å; Y673-G675 VanDerWaalsContact O-N 3.17Å
674	L	86.3	Confident	85.8	Confident	38 Å²	38	60.6 Å²	60.6	20%	0.199	28%	0.282	C	S	.	.	S	Bend	trans	-78.5	9.2	-177.1	-66.1	167.8	0	0	0	114.4	V640 A645 Q670 W678	V640-L674 HydrophobicContact CG1-CD2 4.06Å; A645-L674 HydrophobicContact CB-CD1 3.85Å; A645-L674 HydrophobicContact CB-CD2 4.21Å; Q670-L674 HydrophobicContact CB-CD1 4.04Å; Q670-L674 HydrophobicContact CB-CG 4.43Å; Q670-L674 PolarHBondContact O-N 2.99Å; L674-W678 HydrophobicContact CB-CB 4.04Å; L674-W678 HydrophobicContact CB-CD2 3.79Å; L674-W678 HydrophobicContact CB-CE3 3.84Å; L674-W678 HydrophobicContact CB-CG 3.87Å; L674-W678 HydrophobicContact CD1-CD2 3.68Å; L674-W678 HydrophobicContact CD1-CE3 3.78Å; L674-W678 HydrophobicContact CD1-CG 4.39Å; L674-W678 HydrophobicContact CD1-CH2 3.75Å; L674-W678 HydrophobicContact CD1-CZ2 3.65Å; L674-W678 HydrophobicContact CD1-CZ3 3.81Å; L674-W678 HydrophobicContact CG-CD2 4.31Å; L674-W678 HydrophobicContact CG-CE3 4.47Å; L674-W678 WeakPolarHBondContact O-CB 3.47Å
675	G	86.1	Confident	85.5	Confident	36 Å²	36	60.6 Å²	60.6	37%	0.371	28%	0.282	S	S	.	.	H	α-helix	trans	74.9	-177.3	179.2	0	0	0	0	0	114.9	Y673 R679	Y673-G675 PolarHBondContact O-N 3.25Å; Y673-G675 VanDerWaalsContact O-N 3.17Å; G675-R679 PolarHBondContact O-NE 3.44Å
676	R	85.9	Confident	85.2	Confident	190 Å²	190	58.3 Å²	58.3	72%	0.717	27%	0.272	S	S	*	.	H	α-helix	trans	-84.1	-38	-177.7	-70.5	-179.2	-177.9	-179.7	2	112.7	R679 R680	R676-R679 PolarHBondContact O-N 3.31Å; R676-R680 PolarHBondContact O-N 2.97Å; R676-R680 VanDerWaalsContact O-N 3.14Å
677	Q	82.7	Confident	84.5	Confident	143 Å²	143	60.1 Å²	60.1	67%	0.668	28%	0.284	S	S	*	.	H	α-helix	trans	-62	-46.4	-178.5	-176.8	173.6	-8.8	0	0	111.7	R679 R680 S681	Q677-R679 VanDerWaalsContact C-N 3.28Å; Q677-R679 PolarHBondContact O-N 3.33Å; Q677-R680 WeakPolarHBondContact O-CB 3.23Å; Q677-R680 PolarHBondContact O-N 3Å; Q677-R680 VanDerWaalsContact O-N 3.11Å; Q677-S681 PolarHBondContact O-N 2.89Å; Q677-S681 PolarHBondContact O-OG 2.87Å
678	W	87.5	Confident	83.8	Confident	46 Å²	46	60.5 Å²	60.5	17%	0.174	29%	0.287	C	S	.	.	H	α-helix	trans	-59	-38.8	176.5	-175.5	93.5	0	0	0	112.7	A645 L667 A671 L674 S681 N682 L685 L686	A645-W678 HydrophobicContact CB-CZ2 4.38Å; L667-W678 HydrophobicContact CD2-CZ2 4.47Å; A671-W678 HydrophobicContact CB-CZ3 4.33Å; L674-W678 HydrophobicContact CB-CB 4.04Å; L674-W678 HydrophobicContact CB-CD2 3.79Å; L674-W678 HydrophobicContact CB-CE3 3.84Å; L674-W678 HydrophobicContact CB-CG 3.87Å; L674-W678 HydrophobicContact CD1-CD2 3.68Å; L674-W678 HydrophobicContact CD1-CE3 3.78Å; L674-W678 HydrophobicContact CD1-CG 4.39Å; L674-W678 HydrophobicContact CD1-CH2 3.75Å; L674-W678 HydrophobicContact CD1-CZ2 3.65Å; L674-W678 HydrophobicContact CD1-CZ3 3.81Å; L674-W678 HydrophobicContact CG-CD2 4.31Å; L674-W678 HydrophobicContact CG-CE3 4.47Å; L674-W678 WeakPolarHBondContact O-CB 3.47Å; W678-S681 PolarHBondContact O-N 3.34Å; W678-S681 PolarHBondContact O-OG 2.85Å; W678-N682 HydrophobicContact CD2-CB 4.49Å; W678-N682 HydrophobicContact CH2-CB 4.39Å; W678-N682 HydrophobicContact CZ2-CB 4.28Å; W678-N682 PolarHBondContact NE1-ND2 3.49Å; W678-N682 WeakPolarHBondContact O-CB 3.18Å; W678-N682 PolarHBondContact O-N 3.47Å; W678-N682 PolarHBondContact O-ND2 2.98Å; W678-L685 HydrophobicContact CH2-CD2 3.73Å; W678-L685 HydrophobicContact CZ2-CD2 3.84Å; W678-L686 HydrophobicContact CH2-CD2 4.36Å; W678-L686 HydrophobicContact CZ3-CD2 3.84Å
679	R	85.2	Confident	83.1	Confident	54 Å²	54	58.3 Å²	58.3	20%	0.204	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-40.5	176.8	-74.1	-176.5	-81.6	170.5	-13.1	111.8	G675 R676 Q677 N682 M683 L686	G675-R679 PolarHBondContact O-NE 3.44Å; R676-R679 PolarHBondContact O-N 3.31Å; Q677-R679 VanDerWaalsContact C-N 3.28Å; Q677-R679 PolarHBondContact O-N 3.33Å; R679-N682 PolarHBondContact O-N 3.27Å; R679-M683 PolarHBondContact O-N 3.46Å; R679-L686 HydrophobicContact CB-CD1 3.94Å; R679-L686 HydrophobicContact CG-CD1 4.09Å
680	R	83.6	Confident	82.2	Confident	193 Å²	193	59.6 Å²	59.6	73%	0.728	28%	0.277	S	S	*	.	H	α-helix	trans	-64.6	-42.9	176.6	-70.2	177.6	178.4	172.2	-1.6	112	R676 Q677 N682 M683	R676-R680 PolarHBondContact O-N 2.97Å; R676-R680 VanDerWaalsContact O-N 3.14Å; Q677-R680 WeakPolarHBondContact O-CB 3.23Å; Q677-R680 PolarHBondContact O-N 3Å; Q677-R680 VanDerWaalsContact O-N 3.11Å; R680-N682 VanDerWaalsContact C-N 3.34Å; R680-M683 WeakPolarHBondContact O-CG 3.45Å
681	S	83.7	Confident	81.2	Confident	76 Å²	76	68.3 Å²	68.3	53%	0.531	31%	0.31	S	S	.	.	H	α-helix	trans	-73.7	-24.7	-179.8	60.5	0	0	0	0	113.4	Q677 W678	Q677-S681 PolarHBondContact O-N 2.89Å; Q677-S681 PolarHBondContact O-OG 2.87Å; W678-S681 PolarHBondContact O-N 3.34Å; W678-S681 PolarHBondContact O-OG 2.85Å
682	N	83.8	Confident	80.1	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.064	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	32	-176.2	-62.4	-82.2	0	0	0	112.8	K649 W678 R679 R680 E684 L685 L686	K649-N682 PolarHBondContact NZ-OD1 3.02Å; W678-N682 HydrophobicContact CD2-CB 4.49Å; W678-N682 HydrophobicContact CH2-CB 4.39Å; W678-N682 HydrophobicContact CZ2-CB 4.28Å; W678-N682 PolarHBondContact NE1-ND2 3.49Å; W678-N682 WeakPolarHBondContact O-CB 3.18Å; W678-N682 PolarHBondContact O-N 3.47Å; W678-N682 PolarHBondContact O-ND2 2.98Å; R679-N682 PolarHBondContact O-N 3.27Å; R680-N682 VanDerWaalsContact C-N 3.34Å; N682-E684 PolarHBondContact O-N 3.47Å; N682-L685 HydrophobicContact CB-CB 4.13Å; N682-L685 HydrophobicContact CB-CD2 4.33Å; N682-L685 VanDerWaalsContact O-CB 3.31Å; N682-L685 WeakPolarHBondContact O-CB 3.26Å; N682-L685 PolarHBondContact O-N 2.85Å; N682-L686 WeakPolarHBondContact O-CG 3.47Å; N682-L686 PolarHBondContact O-N 2.94Å
683	M	80.6	Confident	79.1	Confident	41 Å²	41	66.1 Å²	66.1	20%	0.202	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-34.1	-178.9	-78.9	-59.3	-45.7	0	0	114	R679 R680 L686 S687 L709	R679-M683 PolarHBondContact O-N 3.46Å; R680-M683 WeakPolarHBondContact O-CG 3.45Å; M683-L686 PolarHBondContact O-N 3.38Å; M683-L686 HydrophobicContact SD-CD1 4.09Å; M683-S687 WeakPolarHBondContact O-CB 3.34Å; M683-S687 PolarHBondContact O-N 3.01Å; M683-S687 PolarHBondContact O-OG 2.91Å; M683-L709 HydrophobicContact CE-CD1 4.31Å; M683-L709 HydrophobicContact CE-CD2 4.03Å; M683-L709 HydrophobicContact CG-CD2 4.35Å; M683-L709 HydrophobicContact SD-CD1 4.01Å; M683-L709 HydrophobicContact SD-CD2 4.25Å
684	E	78.7	Confident	77.3	Confident	119 Å²	119	64.2 Å²	64.2	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-64.9	-42.1	175.3	-67.8	179.8	175.1	0	0	111.7	L312 N682 S687 A688	L312-E684 HydrophobicContact CD2-CB 4.47Å; N682-E684 PolarHBondContact O-N 3.47Å; E684-S687 WeakPolarHBondContact O-CB 3.48Å; E684-S687 PolarHBondContact O-N 3.23Å; E684-A688 PolarHBondContact O-N 3.26Å
685	L	81.3	Confident	75.3	Confident	1 Å²	1	64 Å²	64	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-44.9	174.4	178.4	63.2	0	0	0	111.2	F314 L652 L664 L667 W678 N682 S687 A688 I689	F314-L685 HydrophobicContact CE1-CB 4.19Å; F314-L685 HydrophobicContact CE1-CD1 4.38Å; F314-L685 HydrophobicContact CZ-CD1 4.08Å; L652-L685 HydrophobicContact CD1-CD1 3.38Å; L664-L685 HydrophobicContact CD2-CD1 3.64Å; L667-L685 HydrophobicContact CD1-CD1 3.95Å; L667-L685 HydrophobicContact CD1-CD2 4.05Å; L667-L685 HydrophobicContact CD2-CD2 4.37Å; W678-L685 HydrophobicContact CH2-CD2 3.73Å; W678-L685 HydrophobicContact CZ2-CD2 3.84Å; N682-L685 HydrophobicContact CB-CB 4.13Å; N682-L685 HydrophobicContact CB-CD2 4.33Å; N682-L685 VanDerWaalsContact O-CB 3.31Å; N682-L685 WeakPolarHBondContact O-CB 3.26Å; N682-L685 PolarHBondContact O-N 2.85Å; L685-S687 VanDerWaalsContact C-N 3.26Å; L685-S687 PolarHBondContact O-N 3.04Å; L685-A688 WeakPolarHBondContact O-CB 3.28Å; L685-A688 PolarHBondContact O-N 3.42Å; L685-I689 HydrophobicContact CG-CD1 4.37Å; L685-I689 WeakPolarHBondContact O-CG1 3.44Å; L685-I689 PolarHBondContact O-N 3.38Å
686	L	79.7	Confident	73.2	Confident	6 Å²	6	64 Å²	64	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-39.1	176	-54.5	-177.2	0	0	0	110.9	W678 R679 N682 M683 I689 Y690 F702	W678-L686 HydrophobicContact CH2-CD2 4.36Å; W678-L686 HydrophobicContact CZ3-CD2 3.84Å; R679-L686 HydrophobicContact CB-CD1 3.94Å; R679-L686 HydrophobicContact CG-CD1 4.09Å; N682-L686 WeakPolarHBondContact O-CG 3.47Å; N682-L686 PolarHBondContact O-N 2.94Å; M683-L686 PolarHBondContact O-N 3.38Å; M683-L686 HydrophobicContact SD-CD1 4.09Å; L686-I689 HydrophobicContact CD2-CD1 4.26Å; L686-I689 WeakPolarHBondContact O-CB 3.16Å; L686-I689 PolarHBondContact O-N 3.45Å; L686-Y690 VanDerWaalsContact O-CD2 3.25Å; L686-Y690 WeakPolarHBondContact O-CD2 3.33Å; L686-Y690 PolarHBondContact O-N 3.21Å; L686-F702 HydrophobicContact CB-CZ 4.09Å; L686-F702 HydrophobicContact CD1-CE2 4.05Å; L686-F702 HydrophobicContact CD1-CZ 3.87Å; L686-F702 HydrophobicContact CD2-CE2 3.97Å; L686-F702 HydrophobicContact CD2-CZ 3.46Å; L686-F702 VanDerWaalsContact CD2-CZ 3.46Å; L686-F702 HydrophobicContact CG-CZ 3.96Å
687	S	77.6	Confident	70.9	Confident	37 Å²	37	57.2 Å²	57.2	26%	0.259	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-41.1	175.2	-56.4	0	0	0	0	111.7	M683 E684 L685 Y690 R691	M683-S687 WeakPolarHBondContact O-CB 3.34Å; M683-S687 PolarHBondContact O-N 3.01Å; M683-S687 PolarHBondContact O-OG 2.91Å; E684-S687 WeakPolarHBondContact O-CB 3.48Å; E684-S687 PolarHBondContact O-N 3.23Å; L685-S687 VanDerWaalsContact C-N 3.26Å; L685-S687 PolarHBondContact O-N 3.04Å; S687-Y690 PolarHBondContact O-N 2.87Å; S687-Y690 VanDerWaalsContact O-N 3.17Å; S687-R691 WeakPolarHBondContact O-CG 3.35Å; S687-R691 PolarHBondContact O-N 3.16Å
688	A	74.3	Confident	68.8	Low	8 Å²	8	53.5 Å²	53.5	7%	0.066	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-41	174.4	0	0	0	0	0	112.1	I309 L312 E684 L685 Y690 R691 N692	I309-A688 HydrophobicContact CD1-CB 4.16Å; L312-A688 HydrophobicContact CD2-CB 4.39Å; E684-A688 PolarHBondContact O-N 3.26Å; L685-A688 WeakPolarHBondContact O-CB 3.28Å; L685-A688 PolarHBondContact O-N 3.42Å; A688-Y690 PolarHBondContact O-N 3.39Å; A688-R691 PolarHBondContact O-N 3.3Å; A688-N692 PolarHBondContact O-N 3.46Å
689	I	73.7	Confident	66.3	Low	3 Å²	3	52.8 Å²	52.8	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-55.8	-40.2	171.9	-71.1	172	0	0	0	110.5	L664 L667 K668 L685 L686 R693	L664-I689 HydrophobicContact CB-CG1 4.35Å; L664-I689 HydrophobicContact CD2-CG1 3.68Å; L667-I689 HydrophobicContact CB-CD1 4.18Å; K668-I689 HydrophobicContact CB-CD1 4.29Å; K668-I689 HydrophobicContact CB-CG2 3.85Å; K668-I689 HydrophobicContact CD-CG2 3.91Å; K668-I689 HydrophobicContact CG-CG2 3.9Å; L685-I689 HydrophobicContact CG-CD1 4.37Å; L685-I689 WeakPolarHBondContact O-CG1 3.44Å; L685-I689 PolarHBondContact O-N 3.38Å; L686-I689 HydrophobicContact CD2-CD1 4.26Å; L686-I689 WeakPolarHBondContact O-CB 3.16Å; L686-I689 PolarHBondContact O-N 3.45Å; I689-R693 WeakPolarHBondContact O-CB 3.29Å; I689-R693 VanDerWaalsContact O-CD 3.31Å; I689-R693 WeakPolarHBondContact O-CD 3.5Å; I689-R693 WeakPolarHBondContact O-CG 3.47Å; I689-R693 PolarHBondContact O-N 2.9Å
690	Y	68.7	Low	63.7	Low	65 Å²	65	56.1 Å²	56.1	26%	0.255	27%	0.274	S	S	.	.	H	α-helix	trans	-75.3	-36.9	178.6	-87.8	-76.4	0	0	0	114	L686 S687 A688 F702 I706	L686-Y690 VanDerWaalsContact O-CD2 3.25Å; L686-Y690 WeakPolarHBondContact O-CD2 3.33Å; L686-Y690 PolarHBondContact O-N 3.21Å; S687-Y690 PolarHBondContact O-N 2.87Å; S687-Y690 VanDerWaalsContact O-N 3.17Å; A688-Y690 PolarHBondContact O-N 3.39Å; Y690-F702 HydrophobicContact CD2-CE1 4.15Å; Y690-F702 AromaticContact CE2-CD1 3.51Å; Y690-F702 HydrophobicContact CE2-CD1 3.51Å; Y690-F702 AromaticContact CE2-CE1 3.28Å; Y690-F702 HydrophobicContact CE2-CE1 3.28Å; Y690-F702 HydrophobicContact CE2-CZ 4.45Å; Y690-F702 AromaticContact CZ-CD1 3.64Å; Y690-F702 AromaticContact CZ-CE1 3.89Å; Y690-F702 WeakPolarHBondContact OH-CD1 3.41Å; Y690-I706 HydrophobicContact CD2-CD1 3.58Å; Y690-I706 HydrophobicContact CE2-CD1 3.14Å; Y690-I706 HydrophobicContact CE2-CG1 4.45Å
691	R	68.3	Low	61.5	Low	184 Å²	184	53.5 Å²	53.5	69%	0.694	28%	0.275	S	S	*	.	H	α-helix	trans	-69.5	-41.2	178.6	-72.1	178.2	-172.8	173.6	1	112	L390 S687 A688	L390-R691 WeakPolarHBondContact CD2-O 3.43Å; S687-R691 WeakPolarHBondContact O-CG 3.35Å; S687-R691 PolarHBondContact O-N 3.16Å; A688-R691 PolarHBondContact O-N 3.3Å
692	N	63.5	Low	59.1	Low	45 Å²	45	50.9 Å²	50.9	24%	0.241	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	22.2	-171.9	-63.8	-5.1	0	0	0	112.9	I309 W392 L664 A688	I309-N692 WeakPolarHBondContact CD1-ND2 3.48Å; I309-N692 WeakPolarHBondContact CG1-ND2 3.47Å; W392-N692 WeakPolarHBondContact CZ2-O 3.39Å; W392-N692 PolarHBondContact NE1-O 2.98Å; L664-N692 HydrophobicContact CD1-CB 4.26Å; A688-N692 PolarHBondContact O-N 3.46Å
693	R	61.4	Low	56.6	Low	25 Å²	25	54.4 Å²	54.4	9%	0.094	27%	0.269	C	S	.	.	S	Bend	trans	-143	158.1	173.8	-65.7	177.9	175.9	-78.1	-60.3	114.3	L661 L664 K665 I689 P695	L661-R693 PolarHBondContact O-NH2 3.24Å; L664-R693 PolarHBondContact O-NE 3.19Å; L664-R693 PolarHBondContact O-NH2 3.45Å; K665-R693 VanDerWaalsContact CG-CZ 3.43Å; K665-R693 VanDerWaalsContact N-CZ 3.34Å; I689-R693 WeakPolarHBondContact O-CB 3.29Å; I689-R693 VanDerWaalsContact O-CD 3.31Å; I689-R693 WeakPolarHBondContact O-CD 3.5Å; I689-R693 WeakPolarHBondContact O-CG 3.47Å; I689-R693 PolarHBondContact O-N 2.9Å; R693-P695 VanDerWaalsContact O-CD 3.28Å; R693-P695 WeakPolarHBondContact O-CD 3.34Å
694	V	51.4	Low	54.4	Low	26 Å²	26	55.1 Å²	55.1	16%	0.158	28%	0.281	C	S	.	.			trans	-43.3	111.9	147.6	-176.9	0	0	0	0	111.4	W392 S393 K395 K668 S696	W392-V694 HydrophobicContact CB-CB 4.18Å; W392-V694 HydrophobicContact CB-CG2 3.2Å; W392-V694 HydrophobicContact CD2-CG2 4.23Å; W392-V694 HydrophobicContact CG-CG2 3.74Å; S393-V694 WeakPolarHBondContact O-CG1 3.46Å; S393-V694 WeakPolarHBondContact O-CG2 3.33Å; K395-V694 HydrophobicContact CB-CG1 3.96Å; K395-V694 HydrophobicContact CD-CG1 4.4Å; K395-V694 HydrophobicContact CG-CG1 3.93Å; K668-V694 PolarHBondContact NZ-O 2.89Å; V694-S696 PolarHBondContact O-N 2.96Å; V694-S696 VanDerWaalsContact O-N 3.15Å
695	P	43.4	Very low	52.2	Low	35 Å²	35	51 Å²	51	23%	0.227	27%	0.27	C	S	.	.			trans	-67.2	110.8	161.9	14.8	-6.7	0	0	0	107.8	L390 R693	L390-P695 HydrophobicContact CD1-CG 4.11Å; R693-P695 VanDerWaalsContact O-CD 3.28Å; R693-P695 WeakPolarHBondContact O-CD 3.34Å
696	S	41.9	Very low	49.9	Very low	34 Å²	34	53.7 Å²	53.7	24%	0.238	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-83	120.4	162.2	57.1	0	0	0	0	106.4	K395 K668 V694 D698	K395-S696 WeakPolarHBondContact O-CA 3.49Å; K668-S696 PolarHBondContact NZ-OG 3.46Å; V694-S696 PolarHBondContact O-N 2.96Å; V694-S696 VanDerWaalsContact O-N 3.15Å; S696-D698 PolarHBondContact O-N 3.44Å; S696-D698 VanDerWaalsContact O-N 3.14Å
697	I	37.2	Very low	47.6	Very low	49 Å²	49	59.2 Å²	59.2	25%	0.251	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.6	-172.3	-74.6	171.5	0	0	0	112.2	V396 Q439 S699	V396-I697 HydrophobicContact CG2-CB 4.34Å; V396-I697 HydrophobicContact CG2-CD1 3.75Å; V396-I697 HydrophobicContact CG2-CG1 4.29Å; Q439-I697 HydrophobicContact CG-CD1 4.18Å; I697-S699 PolarHBondContact O-N 3.39Å
698	D	39.8	Very low	45.5	Very low	64 Å²	64	65.3 Å²	65.3	34%	0.342	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	2.5	-175	-53	-6.5	0	0	0	117.6	A400 S696	A400-D698 WeakPolarHBondContact CB-OD1 3.31Å; S696-D698 PolarHBondContact O-N 3.44Å; S696-D698 VanDerWaalsContact O-N 3.14Å
699	S	35.1	Very low	43.5	Very low	32 Å²	32	68 Å²	68	22%	0.224	35%	0.348	C	S	.	.			trans	-116.5	68.6	-178.7	60.5	0	0	0	0	111.6	I697 D701 F702 K703	I697-S699 PolarHBondContact O-N 3.39Å; S699-D701 PolarHBondContact O-N 3.14Å; S699-F702 PolarHBondContact O-N 3.29Å; S699-F702 WeakPolarHBondContact OG-CB 3.37Å; S699-K703 PolarHBondContact O-N 2.81Å
700	E	30.7	Very low	41.4	Very low	123 Å²	123	71 Å²	71	58%	0.575	37%	0.369	S	S	*	.	H	α-helix	trans	-56.3	-37.8	170.1	-72.6	-156.2	146.1	0	0	111.4	M407 F702 K703 A704	M407-E700 WeakPolarHBondContact CE-OE1 3.27Å; E700-F702 PolarHBondContact O-N 2.89Å; E700-F702 VanDerWaalsContact O-N 3.16Å; E700-K703 PolarHBondContact O-N 2.84Å; E700-A704 WeakPolarHBondContact O-CB 3.31Å; E700-A704 PolarHBondContact O-N 3.32Å
701	D	36.6	Very low	39.7	Very low	138 Å²	138	73 Å²	73	74%	0.738	39%	0.387	S	S	*	.	H	α-helix	trans	-60.7	-25.2	173.5	-71.8	-28.5	0	0	0	114	S699	S699-D701 PolarHBondContact O-N 3.14Å
702	F	34.3	Very low	37.9	Very low	21 Å²	21	67.3 Å²	67.3	9%	0.092	38%	0.375	C	S	.	.	H	α-helix	trans	-93.5	-37.4	-178.1	-153.3	-114.7	0	0	0	111.2	A671 L686 Y690 S699 E700 A704 G705	A671-F702 HydrophobicContact CB-CE2 3.81Å; A671-F702 HydrophobicContact CB-CZ 4.25Å; L686-F702 HydrophobicContact CB-CZ 4.09Å; L686-F702 HydrophobicContact CD1-CE2 4.05Å; L686-F702 HydrophobicContact CD1-CZ 3.87Å; L686-F702 HydrophobicContact CD2-CE2 3.97Å; L686-F702 HydrophobicContact CD2-CZ 3.46Å; L686-F702 VanDerWaalsContact CD2-CZ 3.46Å; L686-F702 HydrophobicContact CG-CZ 3.96Å; Y690-F702 HydrophobicContact CD2-CE1 4.15Å; Y690-F702 AromaticContact CE2-CD1 3.51Å; Y690-F702 HydrophobicContact CE2-CD1 3.51Å; Y690-F702 AromaticContact CE2-CE1 3.28Å; Y690-F702 HydrophobicContact CE2-CE1 3.28Å; Y690-F702 HydrophobicContact CE2-CZ 4.45Å; Y690-F702 AromaticContact CZ-CD1 3.64Å; Y690-F702 AromaticContact CZ-CE1 3.89Å; Y690-F702 WeakPolarHBondContact OH-CD1 3.41Å; S699-F702 PolarHBondContact O-N 3.29Å; S699-F702 WeakPolarHBondContact OG-CB 3.37Å; E700-F702 PolarHBondContact O-N 2.89Å; E700-F702 VanDerWaalsContact O-N 3.16Å; F702-A704 VanDerWaalsContact C-N 3.34Å; F702-G705 PolarHBondContact O-N 2.87Å
703	K	30.2	Very low	36.2	Very low	87 Å²	87	74.5 Å²	74.5	38%	0.378	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-39.7	168.7	-77	-176.7	179	176.1	0	112.2	S699 E700 G705 I706 L707	S699-K703 PolarHBondContact O-N 2.81Å; E700-K703 PolarHBondContact O-N 2.84Å; K703-G705 PolarHBondContact O-N 3.39Å; K703-I706 PolarHBondContact O-N 3.01Å; K703-L707 PolarHBondContact O-N 2.85Å
704	A	34.1	Very low	34.8	Very low	56 Å²	56	81 Å²	81	46%	0.463	43%	0.428	S	S	.	.	H	α-helix	trans	-59.8	-31.6	177.5	0	0	0	0	0	112.5	E700 F702 K708	E700-A704 WeakPolarHBondContact O-CB 3.31Å; E700-A704 PolarHBondContact O-N 3.32Å; F702-A704 VanDerWaalsContact C-N 3.34Å; A704-K708 PolarHBondContact O-N 3.32Å
705	G	33.4	Very low	34.1	Very low	31 Å²	31	83.6 Å²	83.6	32%	0.32	45%	0.447	S	S	.	.	H	α-helix	trans	-66.6	-39.1	173.4	0	0	0	0	0	113.2	F702 K703 L709	F702-G705 PolarHBondContact O-N 2.87Å; K703-G705 PolarHBondContact O-N 3.39Å; G705-L709 VanDerWaalsContact O-CD1 3.24Å; G705-L709 WeakPolarHBondContact O-CD1 3.42Å; G705-L709 PolarHBondContact O-N 2.97Å
706	I	32.6	Very low	33.6	Very low	59 Å²	59	90 Å²	90	30%	0.303	47%	0.474	S	S	.	.	H	α-helix	trans	-84.9	-38.1	-176.3	-65.3	-177.5	0	0	0	112.5	Y690 K703 K708 L709 S710	Y690-I706 HydrophobicContact CD2-CD1 3.58Å; Y690-I706 HydrophobicContact CE2-CD1 3.14Å; Y690-I706 HydrophobicContact CE2-CG1 4.45Å; K703-I706 PolarHBondContact O-N 3.01Å; I706-K708 VanDerWaalsContact C-N 3.26Å; I706-K708 PolarHBondContact O-N 2.87Å; I706-L709 CarbonylContact O-C 3.57Å; I706-L709 WeakPolarHBondContact O-CA 3.34Å; I706-L709 PolarHBondContact O-N 2.88Å; I706-S710 PolarHBondContact O-N 3.18Å
707	L	30.6	Very low	33.1	Very low	121 Å²	121	94.6 Å²	94.6	63%	0.634	49%	0.49	S	S	*	.	H	α-helix	trans	-64.4	-31.9	174.6	-91.8	155.1	0	0	0	112	K703 L709 S710 V711	K703-L707 PolarHBondContact O-N 2.85Å; L707-L709 VanDerWaalsContact C-N 3.31Å; L707-S710 PolarHBondContact O-OG 3.27Å; L707-V711 WeakPolarHBondContact O-CG2 3.33Å
708	K	33.5	Very low	33.2	Very low	165 Å²	165	95.8 Å²	95.8	72%	0.717	50%	0.503	S	S	*	.	H	α-helix	trans	-69.1	-28.8	167.8	-82.3	-176.9	173	179.2	0	112.6	A704 I706 C712	A704-K708 PolarHBondContact O-N 3.32Å; I706-K708 VanDerWaalsContact C-N 3.26Å; I706-K708 PolarHBondContact O-N 2.87Å; K708-C712 PolarHBondContact O-N 3.23Å
709	L	32.3	Very low	33.5	Very low	66 Å²	66	99.4 Å²	99.4	35%	0.346	52%	0.521	S	S	.	.	H	α-helix	trans	-86.4	-28.4	-178.8	-104.2	115.7	0	0	0	115.3	M683 G705 I706 L707 V711 C712 R713	M683-L709 HydrophobicContact CE-CD1 4.31Å; M683-L709 HydrophobicContact CE-CD2 4.03Å; M683-L709 HydrophobicContact CG-CD2 4.35Å; M683-L709 HydrophobicContact SD-CD1 4.01Å; M683-L709 HydrophobicContact SD-CD2 4.25Å; G705-L709 VanDerWaalsContact O-CD1 3.24Å; G705-L709 WeakPolarHBondContact O-CD1 3.42Å; G705-L709 PolarHBondContact O-N 2.97Å; I706-L709 CarbonylContact O-C 3.57Å; I706-L709 WeakPolarHBondContact O-CA 3.34Å; I706-L709 PolarHBondContact O-N 2.88Å; L707-L709 VanDerWaalsContact C-N 3.31Å; L709-V711 PolarHBondContact O-N 3.17Å; L709-C712 PolarHBondContact O-N 3.48Å; L709-R713 WeakPolarHBondContact O-CB 3.2Å; L709-R713 PolarHBondContact O-N 3.49Å
710	S	30.1	Very low	33.9	Very low	66 Å²	66	101.5 Å²	101.5	46%	0.462	54%	0.536	S	S	.	.	H	α-helix	trans	-64	-33.3	168.7	52.9	0	0	0	0	110.8	I706 L707	I706-S710 PolarHBondContact O-N 3.18Å; L707-S710 PolarHBondContact O-OG 3.27Å
711	V	33.2	Very low	34.5	Very low	105 Å²	105	97.4 Å²	97.4	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-70.2	-42.8	170	-178.6	0	0	0	0	110.9	L707 L709 R713 F714 S715	L707-V711 WeakPolarHBondContact O-CG2 3.33Å; L709-V711 PolarHBondContact O-N 3.17Å; V711-R713 PolarHBondContact O-N 2.9Å; V711-F714 PolarHBondContact O-N 2.95Å; V711-S715 PolarHBondContact O-N 2.93Å
712	C	29.8	Very low	34.9	Very low	66 Å²	66	94.7 Å²	94.7	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-70	-30.3	177.9	-78.2	0	0	0	0	114.9	K708 L709 F714 S715 H716	K708-C712 PolarHBondContact O-N 3.23Å; L709-C712 PolarHBondContact O-N 3.48Å; C712-F714 PolarHBondContact O-N 3.28Å; C712-S715 VanDerWaalsContact CA-OG 3.29Å; C712-S715 WeakPolarHBondContact CA-OG 3.5Å; C712-S715 PolarHBondContact O-N 3.36Å; C712-S715 PolarHBondContact O-OG 3.01Å; C712-H716 PolarHBondContact O-N 3.28Å
713	R	29.1	Very low	35.4	Very low	195 Å²	195	100.8 Å²	100.8	74%	0.736	53%	0.533	S	S	*	.	H	α-helix	trans	-71.5	-22.1	178.2	-150.5	178.9	-113.5	-171.4	-2.9	111.8	L709 V711	L709-R713 WeakPolarHBondContact O-CB 3.2Å; L709-R713 PolarHBondContact O-N 3.49Å; V711-R713 PolarHBondContact O-N 2.9Å
714	F	32.4	Very low	36.7	Very low	162 Å²	162	100.5 Å²	100.5	71%	0.711	54%	0.538	S	S	*	.	H	α-helix	trans	-75.3	-31	166.8	-107.3	-87.7	0	0	0	112.9	V711 C712 H716	V711-F714 PolarHBondContact O-N 2.95Å; C712-F714 PolarHBondContact O-N 3.28Å; F714-H716 VanDerWaalsContact C-N 3.35Å; F714-H716 PolarHBondContact O-N 3.49Å
715	S	34.9	Very low	37.4	Very low	80 Å²	80	104.5 Å²	104.5	56%	0.559	55%	0.545	S	S	*	.	H	α-helix	trans	-76.5	-14.1	179.6	65.3	0	0	0	0	115.3	V711 C712	V711-S715 PolarHBondContact O-N 2.93Å; C712-S715 VanDerWaalsContact CA-OG 3.29Å; C712-S715 WeakPolarHBondContact CA-OG 3.5Å; C712-S715 PolarHBondContact O-N 3.36Å; C712-S715 PolarHBondContact O-OG 3.01Å
716	H	33	Very low	38.2	Very low	169 Å²	169	108.5 Å²	108.5	78%	0.782	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	1.8	179.9	-101.5	-76.1	0	0	0	115	C712 F714 S718	C712-H716 PolarHBondContact O-N 3.28Å; F714-H716 VanDerWaalsContact C-N 3.35Å; F714-H716 PolarHBondContact O-N 3.49Å; H716-S718 PolarHBondContact O-N 3.45Å; H716-S718 VanDerWaalsContact O-N 3.08Å
717	F	31.6	Very low	39.3	Very low	131 Å²	131	112.4 Å²	112.4	58%	0.575	57%	0.574	S	S	*	*	S	Bend	trans	-70.1	104.8	157.9	-94.2	-89.8	0	0	0	107	L719 A721 Q722	F717-L719 PolarHBondContact O-N 2.93Å; F717-A721 HydrophobicContact CD1-CB 3.65Å; F717-A721 HydrophobicContact CE1-CB 4.26Å; F717-Q722 HydrophobicContact CB-CG 4.15Å
718	S	40.3	Very low	40.3	Very low	74 Å²	74	115.4 Å²	115.4	52%	0.517	58%	0.577	S	S	.	*			trans	-35.4	128	165.6	166.9	0	0	0	0	108.9	H716 S720 A721	H716-S718 PolarHBondContact O-N 3.45Å; H716-S718 VanDerWaalsContact O-N 3.08Å; S718-S720 PolarHBondContact O-N 3.4Å; S718-S720 PolarHBondContact OG-OG 3.44Å; S718-A721 PolarHBondContact O-N 3.06Å
719	L	46.4	Very low	41.3	Very low	141 Å²	141	110.8 Å²	110.8	74%	0.738	56%	0.559	S	S	*	*	H	α-helix	trans	-42.4	-31.4	178.9	-89.4	143.4	0	0	0	112.6	F717 A721 Q722 F723	F717-L719 PolarHBondContact O-N 2.93Å; L719-A721 PolarHBondContact O-N 2.92Å; L719-Q722 PolarHBondContact O-N 2.94Å; L719-F723 WeakPolarHBondContact O-CB 3.42Å; L719-F723 PolarHBondContact O-N 2.92Å
720	S	42.3	Very low	42	Very low	76 Å²	76	109.1 Å²	109.1	53%	0.531	56%	0.555	S	S	.	*	H	α-helix	trans	-57.9	-40.4	174.1	63.3	0	0	0	0	114.7	S718 F723 V724	S718-S720 PolarHBondContact O-N 3.4Å; S718-S720 PolarHBondContact OG-OG 3.44Å; S720-F723 WeakPolarHBondContact O-CB 3.47Å; S720-F723 PolarHBondContact O-N 2.94Å; S720-V724 WeakPolarHBondContact O-CG2 3.49Å; S720-V724 PolarHBondContact O-N 2.91Å
721	A	44	Very low	43.1	Very low	37 Å²	37	109.5 Å²	109.5	31%	0.306	56%	0.558	S	S	.	*	H	α-helix	trans	-80.3	-30.9	-176.9	0	0	0	0	0	112.8	F717 S718 L719 F723 V724 F725	F717-A721 HydrophobicContact CD1-CB 3.65Å; F717-A721 HydrophobicContact CE1-CB 4.26Å; S718-A721 PolarHBondContact O-N 3.06Å; L719-A721 PolarHBondContact O-N 2.92Å; A721-F723 VanDerWaalsContact C-N 3.3Å; A721-V724 PolarHBondContact O-N 3.4Å; A721-F725 PolarHBondContact O-N 3.44Å; A721-F725 VanDerWaalsContact O-N 3.09Å
722	Q	45.3	Very low	43.8	Very low	81 Å²	81	114 Å²	114	38%	0.379	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-39.8	168.3	-70.8	-179.7	-9.6	0	0	110.6	F717 L719 F725 L726	F717-Q722 HydrophobicContact CB-CG 4.15Å; L719-Q722 PolarHBondContact O-N 2.94Å; Q722-F725 PolarHBondContact O-N 3.34Å; Q722-L726 WeakPolarHBondContact O-CB 3.49Å; Q722-L726 PolarHBondContact O-N 2.96Å
723	F	44.2	Very low	44.5	Very low	149 Å²	149	115.8 Å²	115.8	65%	0.654	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-45.7	175.8	-145.9	-90.5	0	0	0	112	L719 S720 A721 F725 L726 F727	L719-F723 WeakPolarHBondContact O-CB 3.42Å; L719-F723 PolarHBondContact O-N 2.92Å; S720-F723 WeakPolarHBondContact O-CB 3.47Å; S720-F723 PolarHBondContact O-N 2.94Å; A721-F723 VanDerWaalsContact C-N 3.3Å; F723-F725 VanDerWaalsContact C-N 3.34Å; F723-F725 PolarHBondContact O-N 3.01Å; F723-L726 PolarHBondContact O-N 3.49Å; F723-F727 WeakPolarHBondContact O-CB 3.39Å; F723-F727 PolarHBondContact O-N 3.45Å
724	V	56.8	Low	45.4	Very low	81 Å²	81	111 Å²	111	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-64.2	-37	178	172.8	0	0	0	0	112.3	S720 A721 F727 R728	S720-V724 WeakPolarHBondContact O-CG2 3.49Å; S720-V724 PolarHBondContact O-N 2.91Å; A721-V724 PolarHBondContact O-N 3.4Å; V724-F727 PolarHBondContact O-N 2.9Å; V724-R728 WeakPolarHBondContact O-CB 3.29Å; V724-R728 PolarHBondContact O-N 2.97Å
725	F	49.2	Very low	46.3	Very low	140 Å²	140	107.9 Å²	107.9	61%	0.614	56%	0.563	S	S	*	*	H	α-helix	trans	-69.1	-45.4	177.8	-170.9	-104.2	0	0	0	111.7	A721 Q722 F723 F727 R728 I729	A721-F725 PolarHBondContact O-N 3.44Å; A721-F725 VanDerWaalsContact O-N 3.09Å; Q722-F725 PolarHBondContact O-N 3.34Å; F723-F725 VanDerWaalsContact C-N 3.34Å; F723-F725 PolarHBondContact O-N 3.01Å; F725-F727 VanDerWaalsContact C-N 3.33Å; F725-F727 PolarHBondContact O-N 2.87Å; F725-R728 PolarHBondContact O-N 3.32Å; F725-I729 HydrophobicContact CD1-CD1 3.65Å; F725-I729 HydrophobicContact CE1-CD1 3.29Å; F725-I729 HydrophobicContact CE1-CG1 4.41Å; F725-I729 HydrophobicContact CG-CD1 4.44Å; F725-I729 HydrophobicContact CZ-CD1 3.81Å; F725-I729 WeakPolarHBondContact O-CG1 3.43Å; F725-I729 PolarHBondContact O-N 3.47Å
726	L	51.6	Low	47	Very low	115 Å²	115	110.1 Å²	110.1	60%	0.602	57%	0.568	S	S	*	*	H	α-helix	trans	-63.4	-38.8	173.6	-79.7	166	0	0	0	111.7	Q722 F723 I729 A730	Q722-L726 WeakPolarHBondContact O-CB 3.49Å; Q722-L726 PolarHBondContact O-N 2.96Å; F723-L726 PolarHBondContact O-N 3.49Å; L726-I729 PolarHBondContact O-N 3Å; L726-A730 VanDerWaalsContact O-CB 3.28Å; L726-A730 WeakPolarHBondContact O-CB 3.4Å; L726-A730 PolarHBondContact O-N 3.39Å
727	F	55.6	Low	47.4	Very low	141 Å²	141	105.3 Å²	105.3	62%	0.618	56%	0.564	S	S	*	*	H	α-helix	trans	-67.2	-37.1	176.8	-157.3	-91.2	0	0	0	112.2	F723 V724 F725 A730 S731	F723-F727 WeakPolarHBondContact O-CB 3.39Å; F723-F727 PolarHBondContact O-N 3.45Å; V724-F727 PolarHBondContact O-N 2.9Å; F725-F727 VanDerWaalsContact C-N 3.33Å; F725-F727 PolarHBondContact O-N 2.87Å; F727-A730 PolarHBondContact O-N 3.43Å; F727-S731 VanDerWaalsContact O-CB 3.22Å; F727-S731 WeakPolarHBondContact O-CB 3.46Å; F727-S731 PolarHBondContact O-N 3.45Å
728	R	51.7	Low	47.9	Very low	183 Å²	183	103.1 Å²	103.1	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-37.8	172.8	-88.8	-175.8	171.3	149.3	-0.6	112.7	V724 F725 R732	V724-R728 WeakPolarHBondContact O-CB 3.29Å; V724-R728 PolarHBondContact O-N 2.97Å; F725-R728 PolarHBondContact O-N 3.32Å; R728-R732 PolarHBondContact O-N 3.29Å; R728-R732 VanDerWaalsContact O-N 3.09Å
729	I	54.2	Low	48.2	Very low	68 Å²	68	108.1 Å²	108.1	35%	0.349	58%	0.577	S	S	.	*	H	α-helix	trans	-67.5	-45.1	174.6	-71.4	170.4	0	0	0	110	F725 L726 S731 R732 L733	F725-I729 HydrophobicContact CD1-CD1 3.65Å; F725-I729 HydrophobicContact CE1-CD1 3.29Å; F725-I729 HydrophobicContact CE1-CG1 4.41Å; F725-I729 HydrophobicContact CG-CD1 4.44Å; F725-I729 HydrophobicContact CZ-CD1 3.81Å; F725-I729 WeakPolarHBondContact O-CG1 3.43Å; F725-I729 PolarHBondContact O-N 3.47Å; L726-I729 PolarHBondContact O-N 3Å; I729-S731 PolarHBondContact O-N 3.38Å; I729-R732 PolarHBondContact O-N 2.97Å; I729-L733 HydrophobicContact CG2-CD1 3.59Å; I729-L733 WeakPolarHBondContact O-CB 3.24Å; I729-L733 PolarHBondContact O-N 3.37Å
730	A	47.2	Very low	48.2	Very low	31 Å²	31	110 Å²	110	26%	0.256	58%	0.581	S	S	.	*	H	α-helix	trans	-62.8	-41.7	177	0	0	0	0	0	112.2	L726 F727 R732 L733 S734 F742	L726-A730 VanDerWaalsContact O-CB 3.28Å; L726-A730 WeakPolarHBondContact O-CB 3.4Å; L726-A730 PolarHBondContact O-N 3.39Å; F727-A730 PolarHBondContact O-N 3.43Å; A730-R732 VanDerWaalsContact C-N 3.35Å; A730-R732 PolarHBondContact O-N 3.48Å; A730-L733 PolarHBondContact O-N 3.09Å; A730-S734 WeakPolarHBondContact O-CB 3.49Å; A730-S734 PolarHBondContact O-N 3.43Å; A730-F742 HydrophobicContact CB-CE2 4.45Å
731	S	52.9	Low	48.5	Very low	75 Å²	75	113.3 Å²	113.3	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-66.3	-35.4	177	-174.6	0	0	0	0	112.2	F727 I729	F727-S731 VanDerWaalsContact O-CB 3.22Å; F727-S731 WeakPolarHBondContact O-CB 3.46Å; F727-S731 PolarHBondContact O-N 3.45Å; I729-S731 PolarHBondContact O-N 3.38Å
732	R	46.9	Very low	48.7	Very low	198 Å²	198	116.4 Å²	116.4	75%	0.747	60%	0.595	S	S	*	*	H	α-helix	trans	-72.3	-32.6	171.4	-83.7	-174.3	174.3	-172.5	-2.7	113.7	R728 I729 A730 S735	R728-R732 PolarHBondContact O-N 3.29Å; R728-R732 VanDerWaalsContact O-N 3.09Å; I729-R732 PolarHBondContact O-N 2.97Å; A730-R732 VanDerWaalsContact C-N 3.35Å; A730-R732 PolarHBondContact O-N 3.48Å; R732-S735 PolarHBondContact O-N 3.37Å; R732-S735 PolarHBondContact O-OG 2.97Å
733	L	45.6	Very low	49	Very low	105 Å²	105	116.6 Å²	116.6	55%	0.55	61%	0.606	S	S	.	*	H	α-helix	trans	-74.9	-32	176.2	-81	155	0	0	0	111.9	I729 A730 S735 L736	I729-L733 HydrophobicContact CG2-CD1 3.59Å; I729-L733 WeakPolarHBondContact O-CB 3.24Å; I729-L733 PolarHBondContact O-N 3.37Å; A730-L733 PolarHBondContact O-N 3.09Å; L733-S735 PolarHBondContact O-N 3.46Å; L733-L736 PolarHBondContact O-N 3.34Å
734	S	47.4	Very low	49.5	Very low	94 Å²	94	115.7 Å²	115.7	66%	0.657	61%	0.605	S	S	*	*	H	α-helix	trans	-61.3	-29.6	172.4	179.8	0	0	0	0	112.9	A730 L736	A730-S734 WeakPolarHBondContact O-CB 3.49Å; A730-S734 PolarHBondContact O-N 3.43Å; S734-L736 PolarHBondContact O-N 3.47Å
735	S	51.7	Low	49.3	Very low	97 Å²	97	117.6 Å²	117.6	68%	0.678	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-7.3	176.1	76	0	0	0	0	113.4	R732 L733	R732-S735 PolarHBondContact O-N 3.37Å; R732-S735 PolarHBondContact O-OG 2.97Å; L733-S735 PolarHBondContact O-N 3.46Å
736	L	49.7	Very low	49.5	Very low	126 Å²	126	115.3 Å²	115.3	66%	0.66	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	13.8	-175	-85.3	147.6	0	0	0	113.9	L733 S734 C738	L733-L736 PolarHBondContact O-N 3.34Å; S734-L736 PolarHBondContact O-N 3.47Å; L736-C738 VanDerWaalsContact C-N 3.31Å; L736-C738 PolarHBondContact O-N 3.13Å; L736-C738 VanDerWaalsContact O-N 3.13Å
737	G	41.1	Very low	49.8	Very low	68 Å²	68	112.8 Å²	112.8	70%	0.701	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.8	9.6	159	0	0	0	0	0	117.6	F739	G737-F739 PolarHBondContact O-N 3.39Å
738	C	42.6	Very low	49.9	Very low	86 Å²	86	111.7 Å²	111.7	58%	0.581	59%	0.594	S	S	*	*			trans	-94.8	76.2	178.5	-64.5	0	0	0	0	112.1	L736 E740	L736-C738 VanDerWaalsContact C-N 3.31Å; L736-C738 PolarHBondContact O-N 3.13Å; L736-C738 VanDerWaalsContact O-N 3.13Å; C738-E740 PolarHBondContact O-N 2.95Å
739	F	46	Very low	50.1	Low	178 Å²	178	106.5 Å²	106.5	78%	0.781	59%	0.585	S	S	*	*	H	α-helix	trans	-68.7	-30.5	-175.7	-138.3	-94.6	0	0	0	113.7	G737 F742	G737-F739 PolarHBondContact O-N 3.39Å; F739-F742 PolarHBondContact O-N 3.25Å
740	E	45.4	Very low	50.2	Low	180 Å²	180	110.6 Å²	110.6	84%	0.841	60%	0.6	S	S	*	*	H	α-helix	trans	-71.5	-36.7	-176.8	-72.4	-173.4	152.8	0	0	113.5	C738 F742	C738-E740 PolarHBondContact O-N 2.95Å; E740-F742 VanDerWaalsContact C-N 3.3Å; E740-F742 PolarHBondContact O-N 3.25Å
741	H	50.1	Low	50.7	Low	147 Å²	147	116.6 Å²	116.6	68%	0.681	62%	0.621	S	S	*	*	H	α-helix	trans	-72.5	-23.8	177.8	-76.1	-66	0	0	0	113.1	L745	H741-L745 PolarHBondContact O-N 3.46Å
742	F	47.2	Very low	50.9	Low	102 Å²	102	117.8 Å²	117.8	45%	0.447	62%	0.62	S	S	.	*	H	α-helix	trans	-69.7	-43.3	-179.5	-173.6	-100.3	0	0	0	112.5	A730 F739 E740 M744 L745 L746	A730-F742 HydrophobicContact CB-CE2 4.45Å; F739-F742 PolarHBondContact O-N 3.25Å; E740-F742 VanDerWaalsContact C-N 3.3Å; E740-F742 PolarHBondContact O-N 3.25Å; F742-M744 VanDerWaalsContact C-N 3.34Å; F742-M744 PolarHBondContact O-N 3.44Å; F742-L745 PolarHBondContact O-N 3.31Å; F742-L746 HydrophobicContact CZ-CD1 4.31Å; F742-L746 PolarHBondContact O-N 3.42Å; F742-L746 VanDerWaalsContact O-N 3.09Å
743	S	53	Low	51.2	Low	85 Å²	85	115.3 Å²	115.3	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-62.6	-41.8	178.9	-175.7	0	0	0	0	112	L745 L746 S747	S743-L745 PolarHBondContact O-N 2.86Å; S743-L746 PolarHBondContact O-N 3.17Å; S743-S747 PolarHBondContact O-N 2.99Å; S743-S747 VanDerWaalsContact O-N 3.11Å
744	M	54.3	Low	51.8	Low	130 Å²	130	113 Å²	113	64%	0.64	61%	0.612	S	S	*	*	H	α-helix	trans	-66.5	-40	-180	-128.8	-166.9	165.2	0	0	112.4	F742 H748	F742-M744 VanDerWaalsContact C-N 3.34Å; F742-M744 PolarHBondContact O-N 3.44Å; M744-H748 PolarHBondContact O-N 3.36Å; M744-H748 VanDerWaalsContact O-N 3.13Å
745	L	52.1	Low	52.1	Low	121 Å²	121	115.8 Å²	115.8	63%	0.634	61%	0.612	S	S	*	*	H	α-helix	trans	-67.9	-40.6	178.9	-148.9	83.7	0	0	0	111.6	H741 F742 S743 H748 C749	H741-L745 PolarHBondContact O-N 3.46Å; F742-L745 PolarHBondContact O-N 3.31Å; S743-L745 PolarHBondContact O-N 2.86Å; L745-H748 PolarHBondContact O-N 3.03Å; L745-C749 PolarHBondContact O-N 3.19Å; L745-C749 PolarHBondContact O-SG 2.96Å; L745-C749 VanDerWaalsContact O-SG 3.37Å
746	L	54.3	Low	52.3	Low	91 Å²	91	115.2 Å²	115.2	48%	0.476	60%	0.601	S	S	.	*	H	α-helix	trans	-65.3	-41	178.9	-149	83.3	0	0	0	111.6	F742 S743 C749 F750	F742-L746 HydrophobicContact CZ-CD1 4.31Å; F742-L746 PolarHBondContact O-N 3.42Å; F742-L746 VanDerWaalsContact O-N 3.09Å; S743-L746 PolarHBondContact O-N 3.17Å; L746-C749 PolarHBondContact O-N 3.3Å; L746-F750 PolarHBondContact O-N 2.79Å
747	S	58	Low	52.6	Low	62 Å²	62	115.2 Å²	115.2	43%	0.434	60%	0.595	S	S	.	*	H	α-helix	trans	-62.2	-45.4	175.8	-177.3	0	0	0	0	111.9	S743 C749 F750 F751	S743-S747 PolarHBondContact O-N 2.99Å; S743-S747 VanDerWaalsContact O-N 3.11Å; S747-C749 PolarHBondContact O-N 3.36Å; S747-F750 PolarHBondContact O-N 3.03Å; S747-F751 PolarHBondContact O-N 2.65Å
748	H	57.6	Low	53.3	Low	118 Å²	118	119.7 Å²	119.7	55%	0.546	60%	0.596	S	S	.	*	H	α-helix	trans	-63.6	-40.7	176	-94.3	-102.2	0	0	0	112.7	M744 L745 F751 I752	M744-H748 PolarHBondContact O-N 3.36Å; M744-H748 VanDerWaalsContact O-N 3.13Å; L745-H748 PolarHBondContact O-N 3.03Å; H748-F751 PolarHBondContact O-N 3.48Å; H748-I752 VanDerWaalsContact O-CG1 3.28Å; H748-I752 WeakPolarHBondContact O-CG1 3.34Å; H748-I752 PolarHBondContact O-N 3.24Å
749	C	54.6	Low	53.8	Low	75 Å²	75	122.2 Å²	122.2	51%	0.507	60%	0.597	S	S	.	*	H	α-helix	trans	-63.3	-41.4	175.6	-74.4	0	0	0	0	112	L745 L746 S747 I752 F753	L745-C749 PolarHBondContact O-N 3.19Å; L745-C749 PolarHBondContact O-SG 2.96Å; L745-C749 VanDerWaalsContact O-SG 3.37Å; L746-C749 PolarHBondContact O-N 3.3Å; S747-C749 PolarHBondContact O-N 3.36Å; C749-I752 PolarHBondContact O-N 2.92Å; C749-F753 WeakPolarHBondContact O-CB 3.35Å; C749-F753 PolarHBondContact O-N 3.02Å
750	F	57.5	Low	54.1	Low	153 Å²	153	120.8 Å²	120.8	67%	0.671	59%	0.591	S	S	*	*	H	α-helix	trans	-63.6	-42.6	175.4	-105.6	-82.4	0	0	0	112.3	L746 S747 F753 A754	L746-F750 PolarHBondContact O-N 2.79Å; S747-F750 PolarHBondContact O-N 3.03Å; F750-F753 PolarHBondContact O-N 2.64Å; F750-A754 WeakPolarHBondContact O-CB 3.49Å; F750-A754 PolarHBondContact O-N 3.01Å
751	F	57.8	Low	54.6	Low	158 Å²	158	115.9 Å²	115.9	69%	0.693	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-44	177	-103.7	-82.8	0	0	0	112.5	S747 H748 F753 A754 F755	S747-F751 PolarHBondContact O-N 2.65Å; H748-F751 PolarHBondContact O-N 3.48Å; F751-F753 VanDerWaalsContact C-N 3.32Å; F751-F753 PolarHBondContact O-N 3.29Å; F751-A754 PolarHBondContact O-N 3.25Å; F751-F755 WeakPolarHBondContact O-CB 3.45Å; F751-F755 PolarHBondContact O-N 3.34Å
752	I	57.1	Low	54.9	Low	99 Å²	99	111.8 Å²	111.8	51%	0.508	56%	0.558	S	S	.	*	H	α-helix	trans	-63.8	-41.1	177.4	-68	166.1	0	0	0	110.3	H748 C749 F755 I756	H748-I752 VanDerWaalsContact O-CG1 3.28Å; H748-I752 WeakPolarHBondContact O-CG1 3.34Å; H748-I752 PolarHBondContact O-N 3.24Å; C749-I752 PolarHBondContact O-N 2.92Å; I752-F755 PolarHBondContact O-N 3.27Å; I752-I756 HydrophobicContact CG2-CD1 3.77Å; I752-I756 HydrophobicContact CG2-CG1 4.48Å; I752-I756 VanDerWaalsContact O-CG1 3.27Å; I752-I756 WeakPolarHBondContact O-CG1 3.49Å; I752-I756 PolarHBondContact O-N 2.92Å
753	F	51.7	Low	55.4	Low	146 Å²	146	110.4 Å²	110.4	64%	0.64	56%	0.561	S	S	*	*	H	α-helix	trans	-67.5	-43.2	179	-151.7	-87.9	0	0	0	112	C749 F750 F751 F755 I756 F757	C749-F753 WeakPolarHBondContact O-CB 3.35Å; C749-F753 PolarHBondContact O-N 3.02Å; F750-F753 PolarHBondContact O-N 2.64Å; F751-F753 VanDerWaalsContact C-N 3.32Å; F751-F753 PolarHBondContact O-N 3.29Å; F753-F755 VanDerWaalsContact C-N 3.32Å; F753-F755 PolarHBondContact O-N 2.9Å; F753-I756 PolarHBondContact O-N 3.48Å; F753-F757 VanDerWaalsContact O-CB 3.31Å; F753-F757 WeakPolarHBondContact O-CB 3.28Å; F753-F757 PolarHBondContact O-N 3.03Å
754	A	58.7	Low	55.6	Low	58 Å²	58	113.8 Å²	113.8	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-60.9	-41.5	174.5	0	0	0	0	0	111.5	F750 F751 F757 F758	F750-A754 WeakPolarHBondContact O-CB 3.49Å; F750-A754 PolarHBondContact O-N 3.01Å; F751-A754 PolarHBondContact O-N 3.25Å; A754-F757 PolarHBondContact O-N 2.86Å; A754-F758 WeakPolarHBondContact O-CB 3.46Å; A754-F758 PolarHBondContact O-N 2.98Å
755	F	54.6	Low	55.8	Low	152 Å²	152	113.8 Å²	113.8	67%	0.667	56%	0.562	S	S	*	*	H	α-helix	trans	-65.9	-43.8	178.6	-157.5	-92	0	0	0	112.2	F751 I752 F753 F758 F759	F751-F755 WeakPolarHBondContact O-CB 3.45Å; F751-F755 PolarHBondContact O-N 3.34Å; I752-F755 PolarHBondContact O-N 3.27Å; F753-F755 VanDerWaalsContact C-N 3.32Å; F753-F755 PolarHBondContact O-N 2.9Å; F755-F758 PolarHBondContact O-N 3.37Å; F755-F759 WeakPolarHBondContact O-CB 3.38Å; F755-F759 PolarHBondContact O-N 3.14Å
756	I	54.2	Low	56.2	Low	85 Å²	85	114.1 Å²	114.1	44%	0.436	56%	0.564	S	S	.	*	H	α-helix	trans	-63.8	-44.2	175.7	-69.2	168.7	0	0	0	110.5	I752 F753 F758 F759 F760	I752-I756 HydrophobicContact CG2-CD1 3.77Å; I752-I756 HydrophobicContact CG2-CG1 4.48Å; I752-I756 VanDerWaalsContact O-CG1 3.27Å; I752-I756 WeakPolarHBondContact O-CG1 3.49Å; I752-I756 PolarHBondContact O-N 2.92Å; F753-I756 PolarHBondContact O-N 3.48Å; I756-F758 PolarHBondContact O-N 2.99Å; I756-F759 PolarHBondContact O-N 3.17Å; I756-F760 HydrophobicContact CG2-CD2 3.69Å; I756-F760 HydrophobicContact CG2-CE2 3.73Å; I756-F760 VanDerWaalsContact O-CD2 3.31Å; I756-F760 WeakPolarHBondContact O-CD2 3.44Å; I756-F760 PolarHBondContact O-N 3.02Å
757	F	55.7	Low	56.3	Low	125 Å²	125	113.7 Å²	113.7	55%	0.548	57%	0.568	S	S	.	*	H	α-helix	trans	-63.4	-41.8	178.9	-169.5	-104.3	0	0	0	112.1	F753 A754 F759 F760 L761	F753-F757 VanDerWaalsContact O-CB 3.31Å; F753-F757 WeakPolarHBondContact O-CB 3.28Å; F753-F757 PolarHBondContact O-N 3.03Å; A754-F757 PolarHBondContact O-N 2.86Å; F757-F759 VanDerWaalsContact C-N 3.33Å; F757-F759 PolarHBondContact O-N 2.88Å; F757-F760 PolarHBondContact O-N 3.47Å; F757-L761 HydrophobicContact CD1-CD1 3.58Å; F757-L761 HydrophobicContact CD1-CG 4.45Å; F757-L761 HydrophobicContact CE1-CD1 3.29Å; F757-L761 HydrophobicContact CE1-CG 4.19Å; F757-L761 HydrophobicContact CG-CD1 4.49Å; F757-L761 HydrophobicContact CZ-CD1 4.01Å; F757-L761 HydrophobicContact CZ-CG 4.5Å; F757-L761 WeakPolarHBondContact O-CB 3.43Å; F757-L761 PolarHBondContact O-N 3.25Å
758	F	56.3	Low	56.5	Low	163 Å²	163	116.5 Å²	116.5	72%	0.715	57%	0.573	S	S	*	*	H	α-helix	trans	-64.4	-37.8	175.7	-138.8	-85.9	0	0	0	112	A754 F755 I756 L761 S762	A754-F758 WeakPolarHBondContact O-CB 3.46Å; A754-F758 PolarHBondContact O-N 2.98Å; F755-F758 PolarHBondContact O-N 3.37Å; I756-F758 PolarHBondContact O-N 2.99Å; F758-L761 PolarHBondContact O-N 2.93Å; F758-S762 WeakPolarHBondContact O-CB 3.4Å; F758-S762 PolarHBondContact O-N 3.01Å; F758-S762 PolarHBondContact O-OG 3.47Å
759	F	53.2	Low	56.7	Low	138 Å²	138	115.6 Å²	115.6	61%	0.605	57%	0.572	S	S	*	*	H	α-helix	trans	-68.7	-37.3	177.1	-147.9	-85.7	0	0	0	112.4	F755 I756 F757 S762 S763	F755-F759 WeakPolarHBondContact O-CB 3.38Å; F755-F759 PolarHBondContact O-N 3.14Å; I756-F759 PolarHBondContact O-N 3.17Å; F757-F759 VanDerWaalsContact C-N 3.33Å; F757-F759 PolarHBondContact O-N 2.88Å; F759-S762 PolarHBondContact O-OG 3.35Å; F759-S763 WeakPolarHBondContact O-CB 3.34Å; F759-S763 PolarHBondContact O-N 3.38Å
760	F	52.5	Low	56.7	Low	149 Å²	149	115.5 Å²	115.5	65%	0.654	57%	0.571	S	S	*	*	H	α-helix	trans	-68.8	-41.5	173.5	-88.8	-73.5	0	0	0	112	I756 F757 S763 F764	I756-F760 HydrophobicContact CG2-CD2 3.69Å; I756-F760 HydrophobicContact CG2-CE2 3.73Å; I756-F760 VanDerWaalsContact O-CD2 3.31Å; I756-F760 WeakPolarHBondContact O-CD2 3.44Å; I756-F760 PolarHBondContact O-N 3.02Å; F757-F760 PolarHBondContact O-N 3.47Å; F760-S763 PolarHBondContact O-N 2.98Å; F760-F764 WeakPolarHBondContact O-CB 3.28Å; F760-F764 PolarHBondContact O-N 3.13Å
761	L	56.4	Low	56.8	Low	77 Å²	77	112 Å²	112	40%	0.403	57%	0.565	S	S	.	*	H	α-helix	trans	-62.5	-43.4	175.3	-85.3	166	0	0	0	112.1	F757 F758 F764 F765	F757-L761 HydrophobicContact CD1-CD1 3.58Å; F757-L761 HydrophobicContact CD1-CG 4.45Å; F757-L761 HydrophobicContact CE1-CD1 3.29Å; F757-L761 HydrophobicContact CE1-CG 4.19Å; F757-L761 HydrophobicContact CG-CD1 4.49Å; F757-L761 HydrophobicContact CZ-CD1 4.01Å; F757-L761 HydrophobicContact CZ-CG 4.5Å; F757-L761 WeakPolarHBondContact O-CB 3.43Å; F757-L761 PolarHBondContact O-N 3.25Å; F758-L761 PolarHBondContact O-N 2.93Å; L761-F764 PolarHBondContact O-N 3.4Å; L761-F765 WeakPolarHBondContact O-CB 3.22Å; L761-F765 PolarHBondContact O-N 3.11Å
762	S	57.1	Low	57.1	Low	61 Å²	61	108.1 Å²	108.1	43%	0.427	55%	0.551	S	S	.	*	H	α-helix	trans	-66.8	-39.8	178.6	69.8	0	0	0	0	112	F758 F759 F765 L766	F758-S762 WeakPolarHBondContact O-CB 3.4Å; F758-S762 PolarHBondContact O-N 3.01Å; F758-S762 PolarHBondContact O-OG 3.47Å; F759-S762 PolarHBondContact O-OG 3.35Å; S762-F765 PolarHBondContact O-N 3.5Å; S762-L766 WeakPolarHBondContact O-CB 3.42Å; S762-L766 PolarHBondContact O-N 3.25Å
763	S	56.4	Low	57.3	Low	72 Å²	72	110.8 Å²	110.8	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-66.9	-38.4	176.6	-162.1	0	0	0	0	112	F759 F760 S767	F759-S763 WeakPolarHBondContact O-CB 3.34Å; F759-S763 PolarHBondContact O-N 3.38Å; F760-S763 PolarHBondContact O-N 2.98Å; S763-S767 WeakPolarHBondContact O-CB 3.32Å; S763-S767 PolarHBondContact O-N 3.43Å
764	F	57.3	Low	57.9	Low	156 Å²	156	108.5 Å²	108.5	68%	0.684	55%	0.55	S	S	*	.	H	α-helix	trans	-67.3	-44.3	175.3	-159.7	-91.7	0	0	0	111.9	F760 L761 L766 S767 F768	F760-F764 WeakPolarHBondContact O-CB 3.28Å; F760-F764 PolarHBondContact O-N 3.13Å; L761-F764 PolarHBondContact O-N 3.4Å; F764-L766 PolarHBondContact O-N 3.39Å; F764-S767 PolarHBondContact O-N 3.43Å; F764-F768 WeakPolarHBondContact O-CB 3.21Å; F764-F768 PolarHBondContact O-N 2.84Å
765	F	58.9	Low	58	Low	131 Å²	131	108.1 Å²	108.1	58%	0.575	55%	0.546	S	S	*	.	H	α-helix	trans	-61.6	-42.7	175.1	-106.7	-85.1	0	0	0	112.3	L761 S762 F768 L769	L761-F765 WeakPolarHBondContact O-CB 3.22Å; L761-F765 PolarHBondContact O-N 3.11Å; S762-F765 PolarHBondContact O-N 3.5Å; F765-F768 PolarHBondContact O-N 3.27Å; F765-L769 WeakPolarHBondContact O-CB 3.43Å; F765-L769 WeakPolarHBondContact O-CG 3.5Å; F765-L769 PolarHBondContact O-N 3.09Å
766	L	59.6	Low	58.4	Low	127 Å²	127	105 Å²	105	67%	0.665	54%	0.539	S	S	*	.	H	α-helix	trans	-66.6	-39.4	179.3	-161.9	70.3	0	0	0	111.6	S762 F764 C770	S762-L766 WeakPolarHBondContact O-CB 3.42Å; S762-L766 PolarHBondContact O-N 3.25Å; F764-L766 PolarHBondContact O-N 3.39Å; L766-C770 VanDerWaalsContact O-CB 3.28Å; L766-C770 WeakPolarHBondContact O-CB 3.35Å; L766-C770 PolarHBondContact O-N 3.08Å
767	S	57.2	Low	58.5	Low	82 Å²	82	105 Å²	105	57%	0.573	54%	0.54	S	S	*	.	H	α-helix	trans	-65.9	-38.3	174.2	-168.6	0	0	0	0	112	S763 F764 C770 S771	S763-S767 WeakPolarHBondContact O-CB 3.32Å; S763-S767 PolarHBondContact O-N 3.43Å; F764-S767 PolarHBondContact O-N 3.43Å; S767-C770 PolarHBondContact O-N 3.14Å; S767-S771 WeakPolarHBondContact O-CB 3.48Å; S767-S771 PolarHBondContact O-N 2.81Å
768	F	62	Low	58.4	Low	121 Å²	121	102 Å²	102	53%	0.531	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-44.8	178	-172.5	-105.5	0	0	0	111.5	F764 F765 C770 S771 I772	F764-F768 WeakPolarHBondContact O-CB 3.21Å; F764-F768 PolarHBondContact O-N 2.84Å; F765-F768 PolarHBondContact O-N 3.27Å; F768-C770 PolarHBondContact O-N 2.96Å; F768-S771 PolarHBondContact O-N 2.83Å; F768-I772 HydrophobicContact CD1-CD1 3.65Å; F768-I772 HydrophobicContact CE1-CD1 3.29Å; F768-I772 HydrophobicContact CE1-CG1 4.35Å; F768-I772 HydrophobicContact CG-CD1 4.46Å; F768-I772 HydrophobicContact CZ-CD1 3.83Å; F768-I772 WeakPolarHBondContact O-CG1 3.4Å; F768-I772 PolarHBondContact O-N 3.1Å
769	L	61.7	Low	58.4	Low	100 Å²	100	99.8 Å²	99.8	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-39.8	175	-72.2	172.7	0	0	0	112.3	F765 S771 I772 Y773	F765-L769 WeakPolarHBondContact O-CB 3.43Å; F765-L769 WeakPolarHBondContact O-CG 3.5Å; F765-L769 PolarHBondContact O-N 3.09Å; L769-S771 VanDerWaalsContact C-N 3.34Å; L769-I772 PolarHBondContact O-N 3.27Å; L769-Y773 WeakPolarHBondContact O-CB 3.29Å; L769-Y773 PolarHBondContact O-N 2.64Å
770	C	54.9	Low	58.3	Low	72 Å²	72	96.2 Å²	96.2	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-40.6	176.3	-159.9	0	0	0	0	111.3	L766 S767 F768 Y773 I774	L766-C770 VanDerWaalsContact O-CB 3.28Å; L766-C770 WeakPolarHBondContact O-CB 3.35Å; L766-C770 PolarHBondContact O-N 3.08Å; S767-C770 PolarHBondContact O-N 3.14Å; F768-C770 PolarHBondContact O-N 2.96Å; C770-Y773 PolarHBondContact O-N 3.04Å; C770-I774 VanDerWaalsContact O-CG1 3.26Å; C770-I774 WeakPolarHBondContact O-CG1 3.37Å; C770-I774 PolarHBondContact O-N 2.98Å
771	S	60.4	Low	58.1	Low	80 Å²	80	92.6 Å²	92.6	56%	0.559	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-41.5	176.4	-144.9	0	0	0	0	112.3	S767 F768 L769 I774 A775	S767-S771 WeakPolarHBondContact O-CB 3.48Å; S767-S771 PolarHBondContact O-N 2.81Å; F768-S771 PolarHBondContact O-N 2.83Å; L769-S771 VanDerWaalsContact C-N 3.34Å; S771-I774 PolarHBondContact O-N 3.22Å; S771-A775 WeakPolarHBondContact O-CB 3.39Å; S771-A775 PolarHBondContact O-N 3.47Å
772	I	63.7	Low	57.4	Low	77 Å²	77	93.1 Å²	93.1	40%	0.395	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-44.6	173.5	-70.2	170.4	0	0	0	110.7	F768 L769 I774 A775 V776	F768-I772 HydrophobicContact CD1-CD1 3.65Å; F768-I772 HydrophobicContact CE1-CD1 3.29Å; F768-I772 HydrophobicContact CE1-CG1 4.35Å; F768-I772 HydrophobicContact CG-CD1 4.46Å; F768-I772 HydrophobicContact CZ-CD1 3.83Å; F768-I772 WeakPolarHBondContact O-CG1 3.4Å; F768-I772 PolarHBondContact O-N 3.1Å; L769-I772 PolarHBondContact O-N 3.27Å; I772-I774 VanDerWaalsContact C-N 3.34Å; I772-I774 PolarHBondContact O-N 3.32Å; I772-A775 PolarHBondContact O-N 2.92Å; I772-V776 HydrophobicContact CG2-CG2 4.23Å; I772-V776 WeakPolarHBondContact O-CG2 3.49Å; I772-V776 PolarHBondContact O-N 2.93Å
773	Y	60.5	Low	56.9	Low	155 Å²	155	94.3 Å²	94.3	61%	0.608	53%	0.528	S	S	*	.	H	α-helix	trans	-61	-43.7	179.7	-173.1	-99.9	0	0	0	111.6	L769 C770 V776 L777	L769-Y773 WeakPolarHBondContact O-CB 3.29Å; L769-Y773 PolarHBondContact O-N 2.64Å; C770-Y773 PolarHBondContact O-N 3.04Å; Y773-V776 PolarHBondContact O-N 2.99Å; Y773-L777 HydrophobicContact CD1-CD1 4.35Å; Y773-L777 HydrophobicContact CE1-CD1 3.7Å; Y773-L777 HydrophobicContact CE2-CD1 4.37Å; Y773-L777 WeakPolarHBondContact O-CB 3.36Å; Y773-L777 PolarHBondContact O-N 3.34Å
774	I	63.9	Low	56.1	Low	98 Å²	98	96.3 Å²	96.3	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-39.7	175.7	-67.3	165.3	0	0	0	111.3	C770 S771 I772 L777 S778	C770-I774 VanDerWaalsContact O-CG1 3.26Å; C770-I774 WeakPolarHBondContact O-CG1 3.37Å; C770-I774 PolarHBondContact O-N 2.98Å; S771-I774 PolarHBondContact O-N 3.22Å; I772-I774 VanDerWaalsContact C-N 3.34Å; I772-I774 PolarHBondContact O-N 3.32Å; I774-L777 PolarHBondContact O-N 2.81Å; I774-S778 WeakPolarHBondContact O-CB 3.49Å; I774-S778 PolarHBondContact O-N 3.37Å; I774-S778 PolarHBondContact O-OG 2.89Å
775	A	60.8	Low	55.1	Low	49 Å²	49	98 Å²	98	41%	0.405	54%	0.536	S	S	.	.	H	α-helix	trans	-65.3	-43.7	176.7	0	0	0	0	0	112	S771 I772 S778 I779	S771-A775 WeakPolarHBondContact O-CB 3.39Å; S771-A775 PolarHBondContact O-N 3.47Å; I772-A775 PolarHBondContact O-N 2.92Å; A775-S778 PolarHBondContact O-N 2.84Å; A775-I779 WeakPolarHBondContact O-CG1 3.25Å; A775-I779 PolarHBondContact O-N 3.19Å
776	V	64.1	Low	53.7	Low	87 Å²	87	100.2 Å²	100.2	53%	0.527	55%	0.546	S	S	.	.	H	α-helix	trans	-65	-41	176.2	173.2	0	0	0	0	111	I772 Y773 S778 I779 S780	I772-V776 HydrophobicContact CG2-CG2 4.23Å; I772-V776 WeakPolarHBondContact O-CG2 3.49Å; I772-V776 PolarHBondContact O-N 2.93Å; Y773-V776 PolarHBondContact O-N 2.99Å; V776-S778 VanDerWaalsContact C-N 3.32Å; V776-S778 PolarHBondContact O-N 3.27Å; V776-I779 PolarHBondContact O-N 3.5Å; V776-S780 WeakPolarHBondContact O-CB 3.44Å; V776-S780 PolarHBondContact O-N 3.04Å
777	L	56.9	Low	52.4	Low	84 Å²	84	102.9 Å²	102.9	44%	0.44	55%	0.553	S	S	.	*	H	α-helix	trans	-61.6	-42.9	174.7	-129.9	91.3	0	0	0	111.1	Y773 I774 I779 S780 V781	Y773-L777 HydrophobicContact CD1-CD1 4.35Å; Y773-L777 HydrophobicContact CE1-CD1 3.7Å; Y773-L777 HydrophobicContact CE2-CD1 4.37Å; Y773-L777 WeakPolarHBondContact O-CB 3.36Å; Y773-L777 PolarHBondContact O-N 3.34Å; I774-L777 PolarHBondContact O-N 2.81Å; L777-I779 VanDerWaalsContact C-N 3.34Å; L777-I779 PolarHBondContact O-N 3.23Å; L777-S780 PolarHBondContact O-N 3.5Å; L777-V781 WeakPolarHBondContact O-CB 3.39Å; L777-V781 VanDerWaalsContact O-CG2 3.23Å; L777-V781 WeakPolarHBondContact O-CG2 3.37Å; L777-V781 PolarHBondContact O-N 2.88Å
778	S	52.4	Low	51	Low	62 Å²	62	108.2 Å²	108.2	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-64.3	-39.3	-179.9	-59.6	0	0	0	0	111.9	I774 A775 V776 C782	I774-S778 WeakPolarHBondContact O-CB 3.49Å; I774-S778 PolarHBondContact O-N 3.37Å; I774-S778 PolarHBondContact O-OG 2.89Å; A775-S778 PolarHBondContact O-N 2.84Å; V776-S778 VanDerWaalsContact C-N 3.32Å; V776-S778 PolarHBondContact O-N 3.27Å; S778-C782 WeakPolarHBondContact O-CB 3.43Å; S778-C782 PolarHBondContact O-N 3.24Å; S778-C782 PolarHBondContact O-SG 3.18Å
779	I	57.6	Low	49.2	Very low	117 Å²	117	111.3 Å²	111.3	60%	0.6	58%	0.58	S	S	*	*	H	α-helix	trans	-68.3	-41.9	175.3	-65.8	164.8	0	0	0	110.8	A775 V776 L777 C782 S783	A775-I779 WeakPolarHBondContact O-CG1 3.25Å; A775-I779 PolarHBondContact O-N 3.19Å; V776-I779 PolarHBondContact O-N 3.5Å; L777-I779 VanDerWaalsContact C-N 3.34Å; L777-I779 PolarHBondContact O-N 3.23Å; I779-C782 PolarHBondContact O-N 3.07Å; I779-S783 PolarHBondContact O-N 3.27Å
780	S	50.8	Low	47.5	Very low	64 Å²	64	116.2 Å²	116.2	45%	0.448	60%	0.597	S	S	.	*	H	α-helix	trans	-64.7	-40	177.7	-174.5	0	0	0	0	112.3	V776 L777 N784	V776-S780 WeakPolarHBondContact O-CB 3.44Å; V776-S780 PolarHBondContact O-N 3.04Å; L777-S780 PolarHBondContact O-N 3.5Å; S780-N784 PolarHBondContact O-N 3.32Å; S780-N784 PolarHBondContact O-ND2 3.4Å
781	V	48.2	Very low	46.5	Very low	72 Å²	72	118.7 Å²	118.7	44%	0.436	61%	0.612	S	S	.	*	H	α-helix	trans	-66.5	-43.5	175.2	174	0	0	0	0	110.2	L777 S783 N784 Y785	L777-V781 WeakPolarHBondContact O-CB 3.39Å; L777-V781 VanDerWaalsContact O-CG2 3.23Å; L777-V781 WeakPolarHBondContact O-CG2 3.37Å; L777-V781 PolarHBondContact O-N 2.88Å; V781-S783 PolarHBondContact O-N 3.08Å; V781-N784 PolarHBondContact O-N 2.85Å; V781-Y785 HydrophobicContact CG1-CD2 4.04Å; V781-Y785 HydrophobicContact CG1-CE2 3.85Å; V781-Y785 VanDerWaalsContact O-CD2 3.29Å; V781-Y785 WeakPolarHBondContact O-CD2 3.47Å; V781-Y785 PolarHBondContact O-N 3.27Å
782	C	41	Very low	44.8	Very low	88 Å²	88	118 Å²	118	60%	0.595	62%	0.618	S	S	*	*	H	α-helix	trans	-65.7	-35.9	178.9	-68.2	0	0	0	0	113.4	S778 I779	S778-C782 WeakPolarHBondContact O-CB 3.43Å; S778-C782 PolarHBondContact O-N 3.24Å; S778-C782 PolarHBondContact O-SG 3.18Å; I779-C782 PolarHBondContact O-N 3.07Å
783	S	46.6	Very low	43	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	64%	0.641	S	S	*	*	H	α-helix	trans	-68.1	-33.3	175.5	-93.8	0	0	0	0	113.2	I779 V781 Y785	I779-S783 PolarHBondContact O-N 3.27Å; V781-S783 PolarHBondContact O-N 3.08Å; S783-Y785 VanDerWaalsContact C-N 3.33Å; S783-Y785 PolarHBondContact O-N 3.11Å
784	N	40.3	Very low	41.2	Very low	115 Å²	115	123.6 Å²	123.6	62%	0.615	65%	0.652	S	S	*	*	H	α-helix	trans	-74.5	-21	-178.7	-78.8	-46.5	0	0	0	113.7	S780 V781	S780-N784 PolarHBondContact O-N 3.32Å; S780-N784 PolarHBondContact O-ND2 3.4Å; V781-N784 PolarHBondContact O-N 2.85Å
785	Y	34.8	Very low	39.3	Very low	190 Å²	190	126.5 Å²	126.5	75%	0.745	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-83.2	-11.6	177.5	-83.2	-76.8	0	0	0	114.4	V781 S783	V781-Y785 HydrophobicContact CG1-CD2 4.04Å; V781-Y785 HydrophobicContact CG1-CE2 3.85Å; V781-Y785 VanDerWaalsContact O-CD2 3.29Å; V781-Y785 WeakPolarHBondContact O-CD2 3.47Å; V781-Y785 PolarHBondContact O-N 3.27Å; S783-Y785 VanDerWaalsContact C-N 3.33Å; S783-Y785 PolarHBondContact O-N 3.11Å
786	F	31	Very low	37.5	Very low	178 Å²	178	128.7 Å²	128.7	78%	0.781	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-85.1	-6.4	-177.5	-121.8	-86.4	0	0	0	114.9
787	F	31.3	Very low	35.6	Very low	183 Å²	183	129.7 Å²	129.7	80%	0.803	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-108.3	8.5	-172.8	-110.2	-82.5	0	0	0	116.8
788	F	28.8	Very low	34.1	Very low	194 Å²	194	132.4 Å²	132.4	85%	0.851	71%	0.71	S	S	*	*			trans	-117.8	63.5	174.5	-86.1	-86.3	0	0	0	111.9
789	F	24.5	Very low	32.7	Very low	187 Å²	187	137.6 Å²	137.6	82%	0.82	73%	0.727	S	S	*	*			trans	-102.5	89.8	158.2	-100.3	-88.3	0	0	0	108.4
790	F	26	Very low	31.2	Very low	203 Å²	203	138.3 Å²	138.3	89%	0.89	74%	0.741	S	S	*	*			trans	-128.9	122.1	157.1	-102.7	-82.3	0	0	0	108.3
791	P	33.7	Very low	29.9	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	76%	0.756	S	S	*	*			trans	-88.8	142.2	-170.2	34.4	-32	0	0	0	111.8
792	G	24.7	Very low	28.9	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	77%	0.772	S	S	*	*			trans	106.3	100.6	165.6	0	0	0	0	0	113.6
793	Y	25.7	Very low	28.1	Very low	226 Å²	226	145.8 Å²	145.8	89%	0.886	78%	0.784	S	S	*	*				172	119.8	112.9	-101.1	-84	0	0	0	109
794	C	22.4	Very low	27	Very low	124 Å²	124	149.1 Å²	149.1	84%	0.838	79%	0.793	S	S	*	*			trans	-62.7	126.4	167	-59.6	0	0	0	0	109.6
795	I	24.4	Very low	26.6	Very low	158 Å²	158	149.1 Å²	149.1	81%	0.81	80%	0.799	S	S	*	*			trans	-144.7	120	144.2	-81.8	117.9	0	0	0	107.8
796	S	22.6	Very low	26.1	Very low	96 Å²	96	151.9 Å²	151.9	67%	0.671	81%	0.808	S	S	*	*			trans	-66.2	149.7	169.3	46.4	0	0	0	0	112.7
797	S	24.5	Very low	25.9	Very low	108 Å²	108	151.4 Å²	151.4	76%	0.755	81%	0.808	S	S	*	*			trans	55.3	116.3	152	64.7	0	0	0	0	118.4
798	V	24.7	Very low	25.7	Very low	141 Å²	141	149.8 Å²	149.8	86%	0.855	81%	0.808	S	S	*	*				-167.4	139.7	126.8	162.6	0	0	0	0	109.1
799	E	23.9	Very low	25.7	Very low	171 Å²	171	148.6 Å²	148.6	80%	0.799	81%	0.809	S	S	*	*			trans	-58.9	148.9	-174.1	-60.6	156.7	135.5	0	0	115.2
800	C	24.9	Very low	25.8	Very low	131 Å²	131	145 Å²	145	89%	0.885	81%	0.805	S	S	*	*			trans	-137	82.9	155.4	-89.6	0	0	0	0	109.1
801	A	23.8	Very low	26.4	Very low	93 Å²	93	140.7 Å²	140.7	77%	0.769	80%	0.798	S	S	*	*			trans	-91.2	108.3	166	0	0	0	0	0	109.3
802	T	26.5	Very low	26.4	Very low	126 Å²	126	142.2 Å²	142.2	77%	0.773	80%	0.799	S	S	*	*			trans	-108.4	91.4	173.7	35.9	0	0	0	0	111
803	I	24.3	Very low	26.8	Very low	163 Å²	163	144.5 Å²	144.5	84%	0.836	80%	0.796	S	S	*	*			trans	25.6	106.2	134.1	-51.6	170.5	0	0	0	117
804	I	24.4	Very low	27.4	Very low	155 Å²	155	138.9 Å²	138.9	80%	0.795	79%	0.785	S	S	*	*			trans	-129.9	131.2	155.8	-62.1	178.6	0	0	0	107.5
805	P	32.5	Very low	28	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	78%	0.783	S	S	*	*			trans	-81.9	132.6	-159.9	31.6	-33.3	0	0	0	113.3
806	R	24	Very low	28.7	Very low	248 Å²	248	139 Å²	139	94%	0.936	77%	0.768	S	S	*	*			trans	-80.7	123.6	172.2	-71.5	177.7	173	176.3	-2.3	110.2
807	H	26.5	Very low	29.4	Very low	168 Å²	168	140.3 Å²	140.3	78%	0.778	76%	0.763	S	S	*	*			trans	-118.8	113.3	156.9	-104.1	-66.6	0	0	0	109.8
808	N	26.2	Very low	30.4	Very low	149 Å²	149	138 Å²	138	80%	0.797	75%	0.747	S	S	*	*			trans	47.9	88.9	151.4	-62.7	-16.1	0	0	0	118.8
809	I	29.2	Very low	31	Very low	170 Å²	170	137.1 Å²	137.1	87%	0.872	74%	0.737	S	S	*	*			trans	-114.3	131.6	156.6	-65.3	173.7	0	0	0	108.6
810	C	27.7	Very low	31.9	Very low	110 Å²	110	133.2 Å²	133.2	74%	0.743	72%	0.721	S	S	*	*			trans	-54.7	157	-170.3	-60.6	0	0	0	0	116.5	N812	C810-N812 PolarHBondContact O-N 3.27Å
811	P	38.9	Very low	32.8	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	70%	0.699	S	S	*	*	S	Bend	trans	-86.5	98.5	-177.7	34.3	-28.5	0	0	0	110.1
812	N	31.8	Very low	33.8	Very low	156 Å²	156	129.3 Å²	129.3	83%	0.834	69%	0.688	S	S	*	*			trans	-154.1	17.7	156.6	-97.4	-23.2	0	0	0	112.8	C810	C810-N812 PolarHBondContact O-N 3.27Å
813	L	34.9	Very low	34.6	Very low	114 Å²	114	127.1 Å²	127.1	60%	0.597	68%	0.675	S	S	*	*			trans	-102.4	18.3	175.3	-142.3	80	0	0	0	113
814	T	38.1	Very low	35.4	Very low	108 Å²	108	123.1 Å²	123.1	66%	0.663	66%	0.66	S	S	*	*	H	α-helix	trans	-77.5	-22.9	178.1	27.5	0	0	0	0	113.1	S818	T814-S818 PolarHBondContact O-N 3.36Å; T814-S818 PolarHBondContact O-OG 2.8Å
815	Y	34.4	Very low	36.2	Very low	201 Å²	201	122 Å²	122	79%	0.788	65%	0.651	S	S	*	*	H	α-helix	trans	-80.8	-25.1	178.8	-119.4	-85.8	0	0	0	114.1	S818	Y815-S818 PolarHBondContact O-OG 3.11Å
816	V	39.1	Very low	36.8	Very low	84 Å²	84	121 Å²	121	51%	0.509	64%	0.639	S	S	.	*	H	α-helix	trans	-86.4	-33.9	179.1	-179	0	0	0	0	110.9	I820	V816-I820 HydrophobicContact CG1-CD1 3.99Å; V816-I820 WeakPolarHBondContact O-CG1 3.27Å; V816-I820 PolarHBondContact O-N 3.43Å
817	H	38.4	Very low	37.9	Very low	122 Å²	122	113.9 Å²	113.9	57%	0.565	62%	0.623	S	S	*	*	H	α-helix	trans	-72.5	-32.2	176.9	-102.9	-80.6	0	0	0	113.6	A821	H817-A821 WeakPolarHBondContact O-CB 3.38Å; H817-A821 PolarHBondContact O-N 3.16Å
818	S	44.8	Very low	38.8	Very low	59 Å²	59	110.2 Å²	110.2	41%	0.413	62%	0.616	S	S	.	*	H	α-helix	trans	-67.5	-38.1	175.4	56.2	0	0	0	0	111.9	T814 Y815 A821 V822	T814-S818 PolarHBondContact O-N 3.36Å; T814-S818 PolarHBondContact O-OG 2.8Å; Y815-S818 PolarHBondContact O-OG 3.11Å; S818-A821 PolarHBondContact O-N 3.49Å; S818-V822 WeakPolarHBondContact O-CG2 3.16Å; S818-V822 PolarHBondContact O-N 2.84Å
819	L	37.2	Very low	39.6	Very low	123 Å²	123	109.9 Å²	109.9	64%	0.644	61%	0.614	S	S	*	*	H	α-helix	trans	-67.8	-40.7	177.3	-141.1	91.2	0	0	0	111.8	A821 V822 V823	L819-A821 VanDerWaalsContact C-N 3.35Å; L819-V822 PolarHBondContact O-N 3.27Å; L819-V823 WeakPolarHBondContact O-CG2 3.33Å; L819-V823 PolarHBondContact O-N 2.77Å
820	I	42.9	Very low	40.3	Very low	89 Å²	89	110.4 Å²	110.4	46%	0.456	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-36.3	176.9	-66.2	169.8	0	0	0	110.9	V816 V823 C824	V816-I820 HydrophobicContact CG1-CD1 3.99Å; V816-I820 WeakPolarHBondContact O-CG1 3.27Å; V816-I820 PolarHBondContact O-N 3.43Å; I820-V823 PolarHBondContact O-N 3.33Å; I820-C824 WeakPolarHBondContact O-CB 3.49Å; I820-C824 PolarHBondContact O-N 2.92Å; I820-C824 PolarHBondContact O-SG 2.76Å
821	A	44.3	Very low	40.9	Very low	53 Å²	53	110.5 Å²	110.5	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-66.8	-39.4	175.9	0	0	0	0	0	112.3	H817 S818 L819 C824 H825	H817-A821 WeakPolarHBondContact O-CB 3.38Å; H817-A821 PolarHBondContact O-N 3.16Å; S818-A821 PolarHBondContact O-N 3.49Å; L819-A821 VanDerWaalsContact C-N 3.35Å; A821-C824 PolarHBondContact O-N 3.21Å; A821-H825 PolarHBondContact O-N 2.73Å
822	V	44.6	Very low	41	Very low	89 Å²	89	110.3 Å²	110.3	54%	0.539	60%	0.604	S	S	.	*	H	α-helix	trans	-66.6	-42.2	176.1	172.8	0	0	0	0	110.9	S818 L819 H825 I826	S818-V822 WeakPolarHBondContact O-CG2 3.16Å; S818-V822 PolarHBondContact O-N 2.84Å; L819-V822 PolarHBondContact O-N 3.27Å; V822-H825 PolarHBondContact O-N 3.47Å; V822-I826 HydrophobicContact CG1-CD1 3.86Å; V822-I826 VanDerWaalsContact O-CG1 3.3Å; V822-I826 WeakPolarHBondContact O-CG1 3.4Å; V822-I826 PolarHBondContact O-N 3.03Å
823	V	43.6	Very low	41.5	Very low	81 Å²	81	107.8 Å²	107.8	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-66.5	-38.6	176.7	175.1	0	0	0	0	111.4	L819 I820 I826 V827	L819-V823 WeakPolarHBondContact O-CG2 3.33Å; L819-V823 PolarHBondContact O-N 2.77Å; I820-V823 PolarHBondContact O-N 3.33Å; V823-I826 PolarHBondContact O-N 2.76Å; V823-V827 HydrophobicContact CG1-CG2 4.5Å; V823-V827 VanDerWaalsContact O-CG2 3.31Å; V823-V827 WeakPolarHBondContact O-CG2 3.49Å; V823-V827 PolarHBondContact O-N 3.3Å
824	C	40.9	Very low	41.9	Very low	78 Å²	78	107.4 Å²	107.4	53%	0.527	59%	0.591	S	S	.	*	H	α-helix	trans	-69.1	-32.6	176.1	-67.9	0	0	0	0	112.7	I820 A821 S828	I820-C824 WeakPolarHBondContact O-CB 3.49Å; I820-C824 PolarHBondContact O-N 2.92Å; I820-C824 PolarHBondContact O-SG 2.76Å; A821-C824 PolarHBondContact O-N 3.21Å; C824-S828 WeakPolarHBondContact O-CB 3.46Å; C824-S828 PolarHBondContact O-N 2.71Å; C824-S828 VanDerWaalsContact O-N 3.08Å
825	H	40.3	Very low	42.2	Very low	131 Å²	131	107.4 Å²	107.4	61%	0.606	59%	0.587	S	S	*	*	H	α-helix	trans	-69.7	-41.4	174	-109.6	-70	0	0	0	112	A821 V822 V827 S828 D829	A821-H825 PolarHBondContact O-N 2.73Å; V822-H825 PolarHBondContact O-N 3.47Å; H825-V827 VanDerWaalsContact C-N 3.3Å; H825-V827 PolarHBondContact O-N 3.08Å; H825-S828 PolarHBondContact O-N 3.35Å; H825-S828 VanDerWaalsContact O-N 3.15Å; H825-D829 PolarHBondContact O-N 3.17Å
826	I	46.1	Very low	42.7	Very low	96 Å²	96	101.1 Å²	101.1	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-64.4	-37.1	177.3	-66.7	166.9	0	0	0	111	V822 V823 S828 I830	V822-I826 HydrophobicContact CG1-CD1 3.86Å; V822-I826 VanDerWaalsContact O-CG1 3.3Å; V822-I826 WeakPolarHBondContact O-CG1 3.4Å; V822-I826 PolarHBondContact O-N 3.03Å; V823-I826 PolarHBondContact O-N 2.76Å; I826-S828 VanDerWaalsContact C-N 3.31Å; I826-I830 HydrophobicContact CG2-CD1 3.95Å; I826-I830 WeakPolarHBondContact O-CD1 3.28Å; I826-I830 VanDerWaalsContact O-CG1 3.26Å; I826-I830 WeakPolarHBondContact O-CG1 3.12Å; I826-I830 PolarHBondContact O-N 3.4Å
827	V	47	Very low	43	Very low	98 Å²	98	102.4 Å²	102.4	59%	0.594	58%	0.578	S	S	*	*	H	α-helix	trans	-77.6	-15.9	177.4	176	0	0	0	0	112.8	V823 H825 I830	V823-V827 HydrophobicContact CG1-CG2 4.5Å; V823-V827 VanDerWaalsContact O-CG2 3.31Å; V823-V827 WeakPolarHBondContact O-CG2 3.49Å; V823-V827 PolarHBondContact O-N 3.3Å; H825-V827 VanDerWaalsContact C-N 3.3Å; H825-V827 PolarHBondContact O-N 3.08Å; V827-I830 VanDerWaalsContact O-OXT 3.12Å
828	S	44.1	Very low	43.3	Very low	91 Å²	91	100.8 Å²	100.8	64%	0.636	58%	0.579	S	S	*	*	H	α-helix	trans	-90.6	-22.4	173.7	-170.5	0	0	0	0	113.3	C824 H825 I826	C824-S828 WeakPolarHBondContact O-CB 3.46Å; C824-S828 PolarHBondContact O-N 2.71Å; C824-S828 VanDerWaalsContact O-N 3.08Å; H825-S828 PolarHBondContact O-N 3.35Å; H825-S828 VanDerWaalsContact O-N 3.15Å; I826-S828 VanDerWaalsContact C-N 3.31Å
829	D	43.5	Very low	43.2	Very low	142 Å²	142	104.3 Å²	104.3	76%	0.759	59%	0.593	S	S	*	*	H	α-helix	trans	-88	-15.9	174.5	-77.2	-17.3	0	0	0	112.7	H825	H825-D829 PolarHBondContact O-N 3.17Å
830	I	43.8	Very low	43.7	Very low	181 Å²	181	102.6 Å²	102.6	93%	0.928	59%	0.588	S	S	*	*			trans	-87.5	0	165.9	-63.5	168.3	0	0	0	108.8	I826 V827	I826-I830 HydrophobicContact CG2-CD1 3.95Å; I826-I830 WeakPolarHBondContact O-CD1 3.28Å; I826-I830 VanDerWaalsContact O-CG1 3.26Å; I826-I830 WeakPolarHBondContact O-CG1 3.12Å; I826-I830 PolarHBondContact O-N 3.4Å; V827-I830 VanDerWaalsContact O-OXT 3.12Å

Retrieved 830 of 830 residues in 2396.8 ms (Link to these results)

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