A0A077ZAM9_TRITR Loading...

Multi-sensor hybrid histidine kinase

AlphaFold DB , UniProt , Accession A0A077ZAM9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 607 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	84.4	Confident	91.6	Very high	84 Å²	84	59.1 Å²	59.1	41%	0.414	29%	0.287	S	S	.	.				0	-67	0	-161.4	52.8	81.7	0	0	114.6	R3 F4 L5 W53	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 3.44Å; M1-R3 VanDerWaalsContact O-N 3.16Å; M1-F4 WeakPolarHBondContact O-CA 3.27Å; M1-F4 WeakPolarHBondContact O-CB 3.26Å; M1-F4 PolarHBondContact O-N 3.33Å; M1-F4 HydrophobicContact SD-CD1 3.85Å; M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 HydrophobicContact CG-CG 4.44Å; M1-L5 PolarHBondContact O-N 3.42Å; M1-L5 VanDerWaalsContact O-N 3.08Å; M1-L5 HydrophobicContact SD-CG 4.4Å; M1-W53 HydrophobicContact CE-CD2 3.64Å; M1-W53 HydrophobicContact CE-CE3 3.55Å; M1-W53 HydrophobicContact CE-CH2 3.27Å; M1-W53 HydrophobicContact CE-CZ2 3.37Å; M1-W53 HydrophobicContact CE-CZ3 3.36Å
2	I	86.6	Confident	91.8	Very high	96 Å²	96	63.7 Å²	63.7	49%	0.492	31%	0.308	S	S	.	.	H	α-helix	trans	-51.4	-45.1	-174.5	-64.9	169	0	0	0	113.3	F4 L5 I6 Y83	I2-F4 VanDerWaalsContact C-N 3.32Å; I2-F4 PolarHBondContact O-N 3.39Å; I2-L5 PolarHBondContact O-N 3.49Å; I2-I6 HydrophobicContact CG2-CD1 3.87Å; I2-I6 HydrophobicContact CG2-CG1 4.43Å; I2-I6 WeakPolarHBondContact O-CG1 3.28Å; I2-I6 PolarHBondContact O-N 2.95Å; I2-Y83 HydrophobicContact CG2-CD1 3.84Å; I2-Y83 HydrophobicContact CG2-CD2 4.24Å; I2-Y83 HydrophobicContact CG2-CE1 4.13Å; I2-Y83 HydrophobicContact CG2-CE2 4.49Å; I2-Y83 HydrophobicContact CG2-CG 3.92Å
3	R	87.8	Confident	91.8	Very high	139 Å²	139	59.9 Å²	59.9	53%	0.525	29%	0.29	S	S	.	.	H	α-helix	trans	-59.1	-40.4	176.9	-65.4	176.2	-176.4	177.6	-4.6	113.2	M1 L7 Q49 Y83	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 3.44Å; M1-R3 VanDerWaalsContact O-N 3.16Å; R3-L7 WeakPolarHBondContact O-CB 3.13Å; R3-L7 WeakPolarHBondContact O-CG 3.22Å; R3-L7 PolarHBondContact O-N 2.96Å; R3-L7 VanDerWaalsContact O-N 3.08Å; R3-Q49 HydrophobicContact CB-CG 4.12Å; R3-Y83 HydrophobicContact CG-CE1 3.83Å; R3-Y83 PolarHBondContact NE-OH 2.9Å
4	F	91.8	Very high	91.7	Very high	42 Å²	42	57.8 Å²	57.8	18%	0.184	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-46.2	175.1	161.2	-104.1	0	0	0	110.7	M1 I2 I6 L7 S8 A46 Q49 L50	M1-F4 WeakPolarHBondContact O-CA 3.27Å; M1-F4 WeakPolarHBondContact O-CB 3.26Å; M1-F4 PolarHBondContact O-N 3.33Å; M1-F4 HydrophobicContact SD-CD1 3.85Å; I2-F4 VanDerWaalsContact C-N 3.32Å; I2-F4 PolarHBondContact O-N 3.39Å; F4-I6 PolarHBondContact O-N 2.85Å; F4-L7 PolarHBondContact O-N 2.96Å; F4-S8 VanDerWaalsContact O-CB 3.32Å; F4-S8 WeakPolarHBondContact O-CB 3.33Å; F4-S8 PolarHBondContact O-N 3.16Å; F4-A46 HydrophobicContact CD2-CB 3.93Å; F4-A46 VanDerWaalsContact CD2-O 3.29Å; F4-A46 WeakPolarHBondContact CD2-O 3.47Å; F4-A46 HydrophobicContact CE2-CB 4.2Å; F4-Q49 HydrophobicContact CB-CB 4.1Å; F4-L50 HydrophobicContact CD1-CD1 4.28Å; F4-L50 HydrophobicContact CD2-CB 3.82Å; F4-L50 HydrophobicContact CD2-CD1 4.39Å; F4-L50 HydrophobicContact CE1-CD1 4.22Å; F4-L50 HydrophobicContact CE2-CB 4.04Å; F4-L50 HydrophobicContact CE2-CD1 4.33Å; F4-L50 HydrophobicContact CE2-CD2 4.14Å; F4-L50 HydrophobicContact CE2-CG 4.4Å; F4-L50 HydrophobicContact CG-CB 4.33Å; F4-L50 HydrophobicContact CG-CD1 4.35Å; F4-L50 HydrophobicContact CZ-CD1 4.24Å; F4-L50 HydrophobicContact CZ-CD2 4.33Å
5	L	92.4	Very high	91.7	Very high	103 Å²	103	59.5 Å²	59.5	54%	0.539	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-41.2	179	-66	174.7	0	0	0	112.4	M1 I2 G9	M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 HydrophobicContact CG-CG 4.44Å; M1-L5 PolarHBondContact O-N 3.42Å; M1-L5 VanDerWaalsContact O-N 3.08Å; M1-L5 HydrophobicContact SD-CG 4.4Å; I2-L5 PolarHBondContact O-N 3.49Å; L5-G9 PolarHBondContact O-N 2.86Å
6	I	92.8	Very high	91.7	Very high	19 Å²	19	62.8 Å²	62.8	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-47.5	176.6	-67.5	170.6	0	0	0	110.7	I2 F4 G9 Y10 Y83 L86 L90	I2-I6 HydrophobicContact CG2-CD1 3.87Å; I2-I6 HydrophobicContact CG2-CG1 4.43Å; I2-I6 WeakPolarHBondContact O-CG1 3.28Å; I2-I6 PolarHBondContact O-N 2.95Å; F4-I6 PolarHBondContact O-N 2.85Å; I6-G9 PolarHBondContact O-N 2.89Å; I6-Y10 HydrophobicContact CG2-CD2 3.9Å; I6-Y10 HydrophobicContact CG2-CE2 3.61Å; I6-Y10 VanDerWaalsContact O-CD2 3.28Å; I6-Y10 WeakPolarHBondContact O-CD2 3.31Å; I6-Y10 PolarHBondContact O-N 2.94Å; I6-Y83 HydrophobicContact CD1-CD1 3.85Å; I6-L86 HydrophobicContact CD1-CB 4.29Å; I6-L86 HydrophobicContact CG2-CB 4.3Å; I6-L90 HydrophobicContact CG2-CD1 4.13Å; I6-L90 WeakPolarHBondContact O-CD1 3.32Å
7	L	93.6	Very high	91.5	Very high	39 Å²	39	60.1 Å²	60.1	20%	0.204	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-39.5	-179.6	-70.4	166.4	0	0	0	112.6	R3 F4 G9 Y10 F11 L45 A46 Q49	R3-L7 WeakPolarHBondContact O-CB 3.13Å; R3-L7 WeakPolarHBondContact O-CG 3.22Å; R3-L7 PolarHBondContact O-N 2.96Å; R3-L7 VanDerWaalsContact O-N 3.08Å; F4-L7 PolarHBondContact O-N 2.96Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-Y10 PolarHBondContact O-N 3.34Å; L7-F11 PolarHBondContact O-N 2.73Å; L7-L45 HydrophobicContact CD1-CB 3.8Å; L7-L45 HydrophobicContact CD2-CB 4.3Å; L7-A46 HydrophobicContact CB-CB 3.78Å; L7-Q49 HydrophobicContact CD1-CG 3.85Å
8	S	94.5	Very high	91.2	Very high	24 Å²	24	59.5 Å²	59.5	17%	0.168	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-43.3	171	-162.4	0	0	0	0	110.5	F4 Y10 F11 E12	F4-S8 VanDerWaalsContact O-CB 3.32Å; F4-S8 WeakPolarHBondContact O-CB 3.33Å; F4-S8 PolarHBondContact O-N 3.16Å; S8-Y10 VanDerWaalsContact C-N 3.32Å; S8-Y10 PolarHBondContact O-N 3.05Å; S8-F11 WeakPolarHBondContact O-CB 3.24Å; S8-F11 PolarHBondContact O-N 2.95Å; S8-F11 VanDerWaalsContact O-N 3.15Å; S8-E12 WeakPolarHBondContact O-CB 3.34Å; S8-E12 WeakPolarHBondContact O-CG 3.44Å; S8-E12 PolarHBondContact O-N 2.82Å; S8-E12 PolarHBondContact OG-OE1 3.38Å
9	G	94.3	Very high	91.1	Very high	17 Å²	17	62.7 Å²	62.7	18%	0.175	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-40	175.8	0	0	0	0	0	112.7	L5 I6 L7 E12 L13 L90	L5-G9 PolarHBondContact O-N 2.86Å; I6-G9 PolarHBondContact O-N 2.89Å; L7-G9 VanDerWaalsContact C-N 3.32Å; G9-E12 PolarHBondContact O-N 2.68Å; G9-L13 VanDerWaalsContact O-CB 3.23Å; G9-L13 WeakPolarHBondContact O-CB 3.18Å; G9-L13 PolarHBondContact O-N 3.4Å; G9-L90 WeakPolarHBondContact O-CD2 3.25Å
10	Y	94.8	Very high	90.9	Very high	47 Å²	47	62.1 Å²	62.1	18%	0.184	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-44	174	-80.4	-61.1	0	0	0	111.9	I6 L7 S8 E12 M14 L86 P89 L90	I6-Y10 HydrophobicContact CG2-CD2 3.9Å; I6-Y10 HydrophobicContact CG2-CE2 3.61Å; I6-Y10 VanDerWaalsContact O-CD2 3.28Å; I6-Y10 WeakPolarHBondContact O-CD2 3.31Å; I6-Y10 PolarHBondContact O-N 2.94Å; L7-Y10 PolarHBondContact O-N 3.34Å; S8-Y10 VanDerWaalsContact C-N 3.32Å; S8-Y10 PolarHBondContact O-N 3.05Å; Y10-E12 PolarHBondContact O-N 2.87Å; Y10-M14 HydrophobicContact CD1-CE 3.59Å; Y10-M14 HydrophobicContact CD1-SD 4.27Å; Y10-M14 HydrophobicContact CE1-CE 4.46Å; Y10-M14 HydrophobicContact CG-CE 4.18Å; Y10-M14 WeakPolarHBondContact O-CB 3.34Å; Y10-M14 PolarHBondContact O-N 3.31Å; Y10-L86 PolarHBondContact OH-O 2.84Å; Y10-P89 HydrophobicContact CE1-CB 4.17Å; Y10-L90 HydrophobicContact CD1-CD2 3.52Å; Y10-L90 HydrophobicContact CD1-CG 4.17Å; Y10-L90 HydrophobicContact CD2-CD1 4.4Å; Y10-L90 HydrophobicContact CD2-CD2 4.47Å; Y10-L90 HydrophobicContact CE1-CD2 3.93Å; Y10-L90 HydrophobicContact CE1-CG 4.14Å; Y10-L90 HydrophobicContact CE2-CD1 4.49Å; Y10-L90 HydrophobicContact CG-CD2 3.85Å; Y10-L90 HydrophobicContact CG-CG 4.44Å
11	F	94.8	Very high	90.5	Very high	40 Å²	40	61.4 Å²	61.4	18%	0.175	32%	0.317	C	S	.	.	H	α-helix	trans	-57.5	-49.2	173.9	174.1	-103.8	0	0	0	111.9	L7 S8 M15 M39 L43	L7-F11 PolarHBondContact O-N 2.73Å; S8-F11 WeakPolarHBondContact O-CB 3.24Å; S8-F11 PolarHBondContact O-N 2.95Å; S8-F11 VanDerWaalsContact O-N 3.15Å; F11-M15 HydrophobicContact CE1-CE 3.58Å; F11-M15 HydrophobicContact CE1-SD 4.37Å; F11-M15 HydrophobicContact CE2-CE 3.91Å; F11-M15 HydrophobicContact CZ-CE 3.19Å; F11-M15 VanDerWaalsContact O-CB 3.25Å; F11-M15 WeakPolarHBondContact O-CB 3.44Å; F11-M15 PolarHBondContact O-N 3.07Å; F11-M39 HydrophobicContact CD2-CB 4.04Å; F11-M39 WeakPolarHBondContact CD2-O 3.43Å; F11-M39 HydrophobicContact CE2-CB 4.31Å; F11-L43 HydrophobicContact CD1-CD1 4.3Å; F11-L43 HydrophobicContact CD2-CB 3.79Å; F11-L43 HydrophobicContact CE1-CD1 4.26Å; F11-L43 HydrophobicContact CE2-CB 3.99Å; F11-L43 HydrophobicContact CE2-CD1 4.46Å; F11-L43 HydrophobicContact CE2-CD2 3.94Å; F11-L43 HydrophobicContact CE2-CG 4.35Å; F11-L43 HydrophobicContact CG-CB 4.28Å; F11-L43 HydrophobicContact CG-CD1 4.4Å; F11-L43 HydrophobicContact CZ-CD1 4.31Å; F11-L43 HydrophobicContact CZ-CD2 4.01Å
12	E	93.3	Very high	90.4	Very high	114 Å²	114	61.9 Å²	61.9	53%	0.533	31%	0.314	S	S	.	.	H	α-helix	trans	-64.8	-42.8	-179.4	-73.2	167.8	-145.1	0	0	112.4	S8 G9 Y10 M15 Y16	S8-E12 WeakPolarHBondContact O-CB 3.34Å; S8-E12 WeakPolarHBondContact O-CG 3.44Å; S8-E12 PolarHBondContact O-N 2.82Å; S8-E12 PolarHBondContact OG-OE1 3.38Å; G9-E12 PolarHBondContact O-N 2.68Å; Y10-E12 PolarHBondContact O-N 2.87Å; E12-M15 PolarHBondContact O-N 3.39Å; E12-Y16 VanDerWaalsContact O-CB 3.3Å; E12-Y16 WeakPolarHBondContact O-CB 3.31Å; E12-Y16 PolarHBondContact O-N 3.03Å
13	L	92.1	Very high	90.2	Very high	15 Å²	15	57.7 Å²	57.7	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-49.1	177.7	177.4	63.1	0	0	0	111.1	G9 M15 Y16 L17 L90 T94	G9-L13 VanDerWaalsContact O-CB 3.23Å; G9-L13 WeakPolarHBondContact O-CB 3.18Å; G9-L13 PolarHBondContact O-N 3.4Å; L13-M15 VanDerWaalsContact C-N 3.31Å; L13-M15 PolarHBondContact O-N 2.88Å; L13-Y16 HydrophobicContact CD1-CD1 4.48Å; L13-Y16 PolarHBondContact O-N 3.39Å; L13-L17 HydrophobicContact CD1-CD1 4.33Å; L13-L17 HydrophobicContact CD1-CG 4.29Å; L13-L17 HydrophobicContact CG-CD1 4.26Å; L13-L17 WeakPolarHBondContact O-CG 3.09Å; L13-L17 PolarHBondContact O-N 2.8Å; L13-L90 HydrophobicContact CB-CD2 4.08Å; L13-L90 HydrophobicContact CD2-CD2 3.87Å; L13-T94 HydrophobicContact CD1-CG2 4.15Å
14	M	91	Very high	89.7	Confident	30 Å²	30	54.7 Å²	54.7	15%	0.148	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-39.9	178.5	-81.1	56.7	142.4	0	0	111	Y10 L17 Q18 I35 T38 M39	Y10-M14 HydrophobicContact CD1-CE 3.59Å; Y10-M14 HydrophobicContact CD1-SD 4.27Å; Y10-M14 HydrophobicContact CE1-CE 4.46Å; Y10-M14 HydrophobicContact CG-CE 4.18Å; Y10-M14 WeakPolarHBondContact O-CB 3.34Å; Y10-M14 PolarHBondContact O-N 3.31Å; M14-L17 PolarHBondContact O-N 3.5Å; M14-Q18 VanDerWaalsContact O-CB 3.31Å; M14-Q18 WeakPolarHBondContact O-CB 3.36Å; M14-Q18 PolarHBondContact O-N 2.7Å; M14-I35 HydrophobicContact CB-CG2 4.11Å; M14-I35 HydrophobicContact CG-CG2 4.07Å; M14-T38 HydrophobicContact CE-CG2 4.19Å; M14-M39 HydrophobicContact CB-CG 3.36Å; M14-M39 HydrophobicContact CB-SD 3.77Å; M14-M39 HydrophobicContact CG-CG 4.21Å
15	M	91.8	Very high	89	Confident	83 Å²	83	56.3 Å²	56.3	41%	0.409	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-44.8	174.4	-179.2	176.8	-74.6	0	0	111.5	F11 E12 L13 Q18 V19 M39	F11-M15 HydrophobicContact CE1-CE 3.58Å; F11-M15 HydrophobicContact CE1-SD 4.37Å; F11-M15 HydrophobicContact CE2-CE 3.91Å; F11-M15 HydrophobicContact CZ-CE 3.19Å; F11-M15 VanDerWaalsContact O-CB 3.25Å; F11-M15 WeakPolarHBondContact O-CB 3.44Å; F11-M15 PolarHBondContact O-N 3.07Å; E12-M15 PolarHBondContact O-N 3.39Å; L13-M15 VanDerWaalsContact C-N 3.31Å; L13-M15 PolarHBondContact O-N 2.88Å; M15-Q18 PolarHBondContact O-N 3.2Å; M15-V19 HydrophobicContact CG-CG2 4.24Å; M15-V19 WeakPolarHBondContact O-CB 3.28Å; M15-V19 VanDerWaalsContact O-CG2 3.29Å; M15-V19 WeakPolarHBondContact O-CG2 3.4Å; M15-V19 PolarHBondContact O-N 3.42Å; M15-M39 HydrophobicContact CB-SD 4.22Å
16	Y	90.8	Very high	88.4	Confident	113 Å²	113	54.8 Å²	54.8	44%	0.443	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-47.8	176	165.4	-102.6	0	0	0	111.6	E12 L13 Q18 V19 S20	E12-Y16 VanDerWaalsContact O-CB 3.3Å; E12-Y16 WeakPolarHBondContact O-CB 3.31Å; E12-Y16 PolarHBondContact O-N 3.03Å; L13-Y16 HydrophobicContact CD1-CD1 4.48Å; L13-Y16 PolarHBondContact O-N 3.39Å; Y16-Q18 VanDerWaalsContact C-N 3.31Å; Y16-Q18 PolarHBondContact O-N 3.07Å; Y16-V19 PolarHBondContact O-N 3.09Å; Y16-S20 WeakPolarHBondContact O-CB 3.38Å; Y16-S20 PolarHBondContact O-N 2.68Å; Y16-S20 PolarHBondContact O-OG 3.15Å
17	L	88.4	Confident	87.8	Confident	16 Å²	16	55.4 Å²	55.4	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-39.7	178.3	-69.8	177.1	0	0	0	111.8	L13 M14 S20 G21 R22 L23 Y26	L13-L17 HydrophobicContact CD1-CD1 4.33Å; L13-L17 HydrophobicContact CD1-CG 4.29Å; L13-L17 HydrophobicContact CG-CD1 4.26Å; L13-L17 WeakPolarHBondContact O-CG 3.09Å; L13-L17 PolarHBondContact O-N 2.8Å; M14-L17 PolarHBondContact O-N 3.5Å; L17-S20 PolarHBondContact O-OG 3.29Å; L17-G21 PolarHBondContact O-N 3.1Å; L17-R22 HydrophobicContact CD2-CB 4.06Å; L17-R22 PolarHBondContact O-N 3.39Å; L17-R22 VanDerWaalsContact O-N 3.13Å; L17-L23 HydrophobicContact CB-CB 4.28Å; L17-L23 HydrophobicContact CB-CD1 4.18Å; L17-L23 PolarHBondContact O-N 2.78Å; L17-L23 VanDerWaalsContact O-N 3.12Å; L17-Y26 HydrophobicContact CD1-CD2 4.25Å; L17-Y26 HydrophobicContact CD1-CE2 4.25Å; L17-Y26 HydrophobicContact CD2-CD2 4.15Å; L17-Y26 HydrophobicContact CD2-CE2 3.63Å
18	Q	87.1	Confident	87.2	Confident	50 Å²	50	55.4 Å²	55.4	23%	0.234	29%	0.286	C	S	.	.	H	α-helix	trans	-67.8	-45.8	177.4	-179.2	61.8	37.8	0	0	112.3	M14 M15 Y16 G21 F36	M14-Q18 VanDerWaalsContact O-CB 3.31Å; M14-Q18 WeakPolarHBondContact O-CB 3.36Å; M14-Q18 PolarHBondContact O-N 2.7Å; M15-Q18 PolarHBondContact O-N 3.2Å; Y16-Q18 VanDerWaalsContact C-N 3.31Å; Y16-Q18 PolarHBondContact O-N 3.07Å; Q18-G21 PolarHBondContact O-N 2.82Å; Q18-F36 HydrophobicContact CG-CE1 4.13Å; Q18-F36 HydrophobicContact CG-CZ 4.05Å
19	V	88	Confident	86.3	Confident	121 Å²	121	57.2 Å²	57.2	73%	0.733	30%	0.296	S	S	*	.	H	α-helix	trans	-74	-34.4	-177.7	172.8	0	0	0	0	111.7	M15 Y16 G21	M15-V19 HydrophobicContact CG-CG2 4.24Å; M15-V19 WeakPolarHBondContact O-CB 3.28Å; M15-V19 VanDerWaalsContact O-CG2 3.29Å; M15-V19 WeakPolarHBondContact O-CG2 3.4Å; M15-V19 PolarHBondContact O-N 3.42Å; Y16-V19 PolarHBondContact O-N 3.09Å; V19-G21 VanDerWaalsContact C-N 3.25Å; V19-G21 PolarHBondContact O-N 2.7Å
20	S	87.3	Confident	85.4	Confident	49 Å²	49	62.8 Å²	62.8	34%	0.343	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-10	177.3	62.8	0	0	0	0	113.9	Y16 L17 R22	Y16-S20 WeakPolarHBondContact O-CB 3.38Å; Y16-S20 PolarHBondContact O-N 2.68Å; Y16-S20 PolarHBondContact O-OG 3.15Å; L17-S20 PolarHBondContact O-OG 3.29Å; S20-R22 PolarHBondContact O-N 3.42Å; S20-R22 PolarHBondContact OG-N 3.18Å
21	G	82.9	Confident	84.7	Confident	48 Å²	48	63.9 Å²	63.9	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	7.9	-173.5	0	0	0	0	0	114.1	L17 Q18 V19 L23	L17-G21 PolarHBondContact O-N 3.1Å; Q18-G21 PolarHBondContact O-N 2.82Å; V19-G21 VanDerWaalsContact C-N 3.25Å; V19-G21 PolarHBondContact O-N 2.7Å; G21-L23 VanDerWaalsContact C-N 3.29Å; G21-L23 PolarHBondContact O-N 3.03Å
22	R	83	Confident	84.2	Confident	95 Å²	95	66.7 Å²	66.7	36%	0.358	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-80.7	-9.5	179.8	-65.7	-174.2	-176.6	-168.4	5.6	113.5	L17 S20 D24 Q25 Y26 T98	L17-R22 HydrophobicContact CD2-CB 4.06Å; L17-R22 PolarHBondContact O-N 3.39Å; L17-R22 VanDerWaalsContact O-N 3.13Å; S20-R22 PolarHBondContact O-N 3.42Å; S20-R22 PolarHBondContact OG-N 3.18Å; R22-D24 PolarHBondContact O-N 2.94Å; R22-Q25 WeakPolarHBondContact O-CB 3.5Å; R22-Q25 PolarHBondContact O-N 3.22Å; R22-Y26 WeakPolarHBondContact O-CD2 3.33Å; R22-T98 PolarHBondContact NH1-OG1 3.39Å
23	L	81.9	Confident	83.9	Confident	7 Å²	7	68 Å²	68	4%	0.037	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-56.4	-35.4	-179.6	-174	64.3	0	0	0	112.7	L17 G21 Q25 Y26 I27 R32 I35	L17-L23 HydrophobicContact CB-CB 4.28Å; L17-L23 HydrophobicContact CB-CD1 4.18Å; L17-L23 PolarHBondContact O-N 2.78Å; L17-L23 VanDerWaalsContact O-N 3.12Å; G21-L23 VanDerWaalsContact C-N 3.29Å; G21-L23 PolarHBondContact O-N 3.03Å; L23-Q25 PolarHBondContact O-N 2.84Å; L23-Q25 VanDerWaalsContact O-N 3.09Å; L23-Y26 PolarHBondContact O-N 3.47Å; L23-I27 HydrophobicContact CD1-CD1 4.01Å; L23-I27 HydrophobicContact CD1-CG1 4.05Å; L23-I27 HydrophobicContact CD2-CD1 4.16Å; L23-I27 HydrophobicContact CG-CD1 3.99Å; L23-I27 HydrophobicContact CG-CG1 3.95Å; L23-I27 PolarHBondContact O-N 2.94Å; L23-R32 HydrophobicContact CD2-CG 3.88Å; L23-I35 HydrophobicContact CD1-CG1 4.21Å; L23-I35 HydrophobicContact CD1-CG2 4.48Å; L23-I35 HydrophobicContact CD2-CB 4.31Å; L23-I35 HydrophobicContact CD2-CG1 4.13Å; L23-I35 HydrophobicContact CD2-CG2 4.19Å
24	D	77.5	Confident	83.7	Confident	77 Å²	77	70.7 Å²	70.7	41%	0.412	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-66.1	-12.9	-178.7	-56.6	-14.8	0	0	0	112.7	R22 V29	R22-D24 PolarHBondContact O-N 2.94Å; D24-V29 HydrophobicContact CB-CG2 4.03Å
25	Q	77.4	Confident	83.5	Confident	75 Å²	75	70.6 Å²	70.6	35%	0.35	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-83.1	-13.4	174	-59.5	177.4	-22.2	0	0	113.1	R22 L23 T98	R22-Q25 WeakPolarHBondContact O-CB 3.5Å; R22-Q25 PolarHBondContact O-N 3.22Å; L23-Q25 PolarHBondContact O-N 2.84Å; L23-Q25 VanDerWaalsContact O-N 3.09Å; Q25-T98 PolarHBondContact OE1-OG1 3.25Å
26	Y	80.3	Confident	83.4	Confident	71 Å²	71	71.4 Å²	71.4	28%	0.278	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-37.7	-175.2	-71	-84	0	0	0	113.2	L17 R22 L23 T98 C213 V214	L17-Y26 HydrophobicContact CD1-CD2 4.25Å; L17-Y26 HydrophobicContact CD1-CE2 4.25Å; L17-Y26 HydrophobicContact CD2-CD2 4.15Å; L17-Y26 HydrophobicContact CD2-CE2 3.63Å; R22-Y26 WeakPolarHBondContact O-CD2 3.33Å; L23-Y26 PolarHBondContact O-N 3.47Å; Y26-T98 HydrophobicContact CE2-CG2 3.59Å; Y26-T98 WeakPolarHBondContact OH-CG2 3.39Å; Y26-C213 CarbonylContact O-C 3.38Å; Y26-C213 WeakPolarHBondContact O-CA 3.46Å; Y26-V214 PolarHBondContact O-N 3.43Å
27	I	79.7	Confident	83.5	Confident	33 Å²	33	71 Å²	71	17%	0.169	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-135.7	159.3	-173.1	65.4	165	0	0	0	111.1	L23 V29 I35	L23-I27 HydrophobicContact CD1-CD1 4.01Å; L23-I27 HydrophobicContact CD1-CG1 4.05Å; L23-I27 HydrophobicContact CD2-CD1 4.16Å; L23-I27 HydrophobicContact CG-CD1 3.99Å; L23-I27 HydrophobicContact CG-CG1 3.95Å; L23-I27 PolarHBondContact O-N 2.94Å; I27-V29 PolarHBondContact O-N 2.75Å; I27-I35 HydrophobicContact CD1-CD1 3.92Å; I27-I35 HydrophobicContact CD1-CG1 3.37Å
28	N	79.7	Confident	83.6	Confident	38 Å²	38	72.8 Å²	72.8	20%	0.203	36%	0.364	C	S	.	.			trans	-66	128.7	170.1	-178.4	-21.2	0	0	0	110.8	H30 Y31 I210 I211 H212	N28-H30 PolarHBondContact O-N 3.41Å; N28-H30 VanDerWaalsContact O-N 3.15Å; N28-H30 WeakPolarHBondContact OD1-CB 3.28Å; N28-H30 PolarHBondContact OD1-N 2.77Å; N28-Y31 HydrophobicContact CB-CD2 3.86Å; N28-Y31 HydrophobicContact CB-CE2 4.25Å; N28-Y31 PolarHBondContact O-N 2.98Å; N28-I210 HydrophobicContact CB-CG2 4.35Å; N28-I210 WeakPolarHBondContact CB-O 3.34Å; N28-I210 PolarHBondContact ND2-O 3.47Å; N28-I211 WeakPolarHBondContact CB-O 3.31Å; N28-I211 PolarHBondContact ND2-O 2.84Å; N28-H212 PolarHBondContact N-O 3.5Å
29	V	75.5	Confident	83.8	Confident	62 Å²	62	71.1 Å²	71.1	38%	0.376	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-57.5	-30	-176.9	-168.8	0	0	0	0	112.4	D24 I27 Y31 R32	D24-V29 HydrophobicContact CB-CG2 4.03Å; I27-V29 PolarHBondContact O-N 2.75Å; V29-Y31 PolarHBondContact O-N 3.38Å; V29-R32 WeakPolarHBondContact O-CB 3.05Å; V29-R32 PolarHBondContact O-N 2.62Å; V29-R32 VanDerWaalsContact O-N 3.11Å
30	H	76.5	Confident	84.1	Confident	134 Å²	134	67.8 Å²	67.8	62%	0.62	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-57.3	-32.9	174.7	-177.7	-102.6	0	0	0	112.3	N28	N28-H30 PolarHBondContact O-N 3.41Å; N28-H30 VanDerWaalsContact O-N 3.15Å; N28-H30 WeakPolarHBondContact OD1-CB 3.28Å; N28-H30 PolarHBondContact OD1-N 2.77Å
31	Y	80.4	Confident	84.5	Confident	70 Å²	70	70.1 Å²	70.1	28%	0.275	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-92.2	8.6	-179	-62.2	-54.3	0	0	0	114.1	N28 V29 Y33 L34	N28-Y31 HydrophobicContact CB-CD2 3.86Å; N28-Y31 HydrophobicContact CB-CE2 4.25Å; N28-Y31 PolarHBondContact O-N 2.98Å; V29-Y31 PolarHBondContact O-N 3.38Å; Y31-Y33 HydrophobicContact CD1-CE1 4.38Å; Y31-Y33 PolarHBondContact O-N 3.47Å; Y31-L34 HydrophobicContact CD1-CD1 4.08Å; Y31-L34 HydrophobicContact CG-CD1 4.36Å; Y31-L34 WeakPolarHBondContact O-CB 3.31Å; Y31-L34 PolarHBondContact O-N 3.42Å
32	R	84.1	Confident	85	Confident	99 Å²	99	68.1 Å²	68.1	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-56.1	-28.7	-178.9	-174	170	65.2	-153.3	-3.6	113.7	L23 V29 L34 I35 F36	L23-R32 HydrophobicContact CD2-CG 3.88Å; V29-R32 WeakPolarHBondContact O-CB 3.05Å; V29-R32 PolarHBondContact O-N 2.62Å; V29-R32 VanDerWaalsContact O-N 3.11Å; R32-L34 VanDerWaalsContact C-N 3.27Å; R32-L34 PolarHBondContact O-N 3.17Å; R32-I35 WeakPolarHBondContact O-CB 3.41Å; R32-I35 PolarHBondContact O-N 2.71Å; R32-I35 VanDerWaalsContact O-N 3.13Å; R32-F36 HydrophobicContact CG-CE2 3.99Å; R32-F36 WeakPolarHBondContact O-CD2 3.22Å; R32-F36 PolarHBondContact O-N 2.97Å
33	Y	86.1	Confident	85.6	Confident	142 Å²	142	66.8 Å²	66.8	56%	0.557	33%	0.328	S	S	*	.	H	α-helix	trans	-61.6	-31.9	175.8	77.8	-89	0	0	0	113.4	Y31 I35 F36 L37	Y31-Y33 HydrophobicContact CD1-CE1 4.38Å; Y31-Y33 PolarHBondContact O-N 3.47Å; Y33-I35 PolarHBondContact O-N 3.39Å; Y33-F36 PolarHBondContact O-N 3.47Å; Y33-L37 PolarHBondContact O-N 2.7Å
34	L	87.9	Confident	86.3	Confident	72 Å²	72	71.5 Å²	71.5	38%	0.377	35%	0.352	S	S	.	.	H	α-helix	trans	-66	-29.3	176.7	-71.7	161.7	0	0	0	111.6	Y31 R32 L37 T38	Y31-L34 HydrophobicContact CD1-CD1 4.08Å; Y31-L34 HydrophobicContact CG-CD1 4.36Å; Y31-L34 WeakPolarHBondContact O-CB 3.31Å; Y31-L34 PolarHBondContact O-N 3.42Å; R32-L34 VanDerWaalsContact C-N 3.27Å; R32-L34 PolarHBondContact O-N 3.17Å; L34-L37 PolarHBondContact O-N 2.78Å; L34-T38 WeakPolarHBondContact O-CB 3.43Å; L34-T38 PolarHBondContact O-N 2.9Å; L34-T38 PolarHBondContact O-OG1 2.87Å
35	I	87.4	Confident	87.2	Confident	27 Å²	27	71.4 Å²	71.4	14%	0.138	35%	0.351	C	S	.	.	H	α-helix	trans	-71	-40.4	175.6	-60.4	-60.3	0	0	0	111	M14 L23 I27 R32 Y33 L37 T38 M39	M14-I35 HydrophobicContact CB-CG2 4.11Å; M14-I35 HydrophobicContact CG-CG2 4.07Å; L23-I35 HydrophobicContact CD1-CG1 4.21Å; L23-I35 HydrophobicContact CD1-CG2 4.48Å; L23-I35 HydrophobicContact CD2-CB 4.31Å; L23-I35 HydrophobicContact CD2-CG1 4.13Å; L23-I35 HydrophobicContact CD2-CG2 4.19Å; I27-I35 HydrophobicContact CD1-CD1 3.92Å; I27-I35 HydrophobicContact CD1-CG1 3.37Å; R32-I35 WeakPolarHBondContact O-CB 3.41Å; R32-I35 PolarHBondContact O-N 2.71Å; R32-I35 VanDerWaalsContact O-N 3.13Å; Y33-I35 PolarHBondContact O-N 3.39Å; I35-L37 VanDerWaalsContact C-N 3.3Å; I35-L37 PolarHBondContact O-N 2.84Å; I35-T38 PolarHBondContact O-N 3.36Å; I35-M39 HydrophobicContact CG2-CE 4.24Å; I35-M39 HydrophobicContact CG2-CG 4.4Å; I35-M39 WeakPolarHBondContact O-CB 3.43Å; I35-M39 WeakPolarHBondContact O-CG 3.33Å; I35-M39 PolarHBondContact O-N 3.02Å
36	F	89.7	Confident	88	Confident	101 Å²	101	67.9 Å²	67.9	44%	0.443	34%	0.335	S	S	.	.	H	α-helix	trans	-60.2	-42.1	173.3	-70.7	-70.8	0	0	0	112.1	Q18 R32 Y33 M39 A40	Q18-F36 HydrophobicContact CG-CE1 4.13Å; Q18-F36 HydrophobicContact CG-CZ 4.05Å; R32-F36 HydrophobicContact CG-CE2 3.99Å; R32-F36 WeakPolarHBondContact O-CD2 3.22Å; R32-F36 PolarHBondContact O-N 2.97Å; Y33-F36 PolarHBondContact O-N 3.47Å; F36-M39 HydrophobicContact CB-CE 4.33Å; F36-M39 HydrophobicContact CD1-CE 3.27Å; F36-M39 HydrophobicContact CE1-CE 3.74Å; F36-M39 HydrophobicContact CG-CE 3.97Å; F36-M39 PolarHBondContact O-N 2.64Å; F36-A40 PolarHBondContact O-N 2.68Å
37	L	92.3	Very high	88.7	Confident	103 Å²	103	69.2 Å²	69.2	54%	0.539	35%	0.346	S	S	.	.	H	α-helix	trans	-62.8	-45.2	174.5	-173.9	152.5	0	0	0	111.3	Y33 L34 I35 M39 A40 L41	Y33-L37 PolarHBondContact O-N 2.7Å; L34-L37 PolarHBondContact O-N 2.78Å; I35-L37 VanDerWaalsContact C-N 3.3Å; I35-L37 PolarHBondContact O-N 2.84Å; L37-M39 VanDerWaalsContact C-N 3.35Å; L37-M39 PolarHBondContact O-N 2.85Å; L37-A40 PolarHBondContact O-N 3.11Å; L37-L41 WeakPolarHBondContact O-CB 3.47Å; L37-L41 PolarHBondContact O-N 2.69Å
38	T	90.1	Very high	89.3	Confident	55 Å²	55	70.9 Å²	70.9	34%	0.337	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-39.5	178.7	-55.5	0	0	0	0	111.8	M14 L34 I35 L41 S42	M14-T38 HydrophobicContact CE-CG2 4.19Å; L34-T38 WeakPolarHBondContact O-CB 3.43Å; L34-T38 PolarHBondContact O-N 2.9Å; L34-T38 PolarHBondContact O-OG1 2.87Å; I35-T38 PolarHBondContact O-N 3.36Å; T38-L41 PolarHBondContact O-N 2.95Å; T38-S42 WeakPolarHBondContact O-CB 3.35Å; T38-S42 PolarHBondContact O-N 2.86Å; T38-S42 PolarHBondContact O-OG 2.85Å; T38-S42 VanDerWaalsContact O-OG 3.11Å
39	M	92.7	Very high	89.8	Confident	15 Å²	15	71.2 Å²	71.2	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-47.7	173.7	-75.9	-171.8	-63.9	0	0	111.8	F11 M14 M15 I35 F36 L37 L41 S42 L43	F11-M39 HydrophobicContact CD2-CB 4.04Å; F11-M39 WeakPolarHBondContact CD2-O 3.43Å; F11-M39 HydrophobicContact CE2-CB 4.31Å; M14-M39 HydrophobicContact CB-CG 3.36Å; M14-M39 HydrophobicContact CB-SD 3.77Å; M14-M39 HydrophobicContact CG-CG 4.21Å; M15-M39 HydrophobicContact CB-SD 4.22Å; I35-M39 HydrophobicContact CG2-CE 4.24Å; I35-M39 HydrophobicContact CG2-CG 4.4Å; I35-M39 WeakPolarHBondContact O-CB 3.43Å; I35-M39 WeakPolarHBondContact O-CG 3.33Å; I35-M39 PolarHBondContact O-N 3.02Å; F36-M39 HydrophobicContact CB-CE 4.33Å; F36-M39 HydrophobicContact CD1-CE 3.27Å; F36-M39 HydrophobicContact CE1-CE 3.74Å; F36-M39 HydrophobicContact CG-CE 3.97Å; F36-M39 PolarHBondContact O-N 2.64Å; L37-M39 VanDerWaalsContact C-N 3.35Å; L37-M39 PolarHBondContact O-N 2.85Å; M39-L41 VanDerWaalsContact C-N 3.33Å; M39-L41 PolarHBondContact O-N 3.16Å; M39-S42 PolarHBondContact O-N 3.41Å; M39-S42 PolarHBondContact O-OG 3.15Å; M39-L43 WeakPolarHBondContact O-CB 3.21Å; M39-L43 PolarHBondContact O-N 3.08Å
40	A	94.1	Very high	90.5	Very high	50 Å²	50	71.1 Å²	71.1	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-61.8	-44	178.3	0	0	0	0	0	111.2	F36 L37 L43 I44	F36-A40 PolarHBondContact O-N 2.68Å; L37-A40 PolarHBondContact O-N 3.11Å; A40-L43 PolarHBondContact O-N 2.93Å; A40-I44 VanDerWaalsContact O-CG1 3.26Å; A40-I44 WeakPolarHBondContact O-CG1 3.2Å; A40-I44 PolarHBondContact O-N 3.42Å
41	L	95.3	Very high	91.2	Very high	98 Å²	98	72.3 Å²	72.3	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-46.7	178.4	-164.8	97.8	0	0	0	111.6	L37 T38 M39 L43 I44 L45	L37-L41 WeakPolarHBondContact O-CB 3.47Å; L37-L41 PolarHBondContact O-N 2.69Å; T38-L41 PolarHBondContact O-N 2.95Å; M39-L41 VanDerWaalsContact C-N 3.33Å; M39-L41 PolarHBondContact O-N 3.16Å; L41-L43 VanDerWaalsContact C-N 3.32Å; L41-L43 PolarHBondContact O-N 3.46Å; L41-I44 PolarHBondContact O-N 3.39Å; L41-L45 HydrophobicContact CD2-CD1 3.94Å; L41-L45 HydrophobicContact CG-CD1 4.08Å; L41-L45 WeakPolarHBondContact O-CB 3.42Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.36Å; L41-L45 PolarHBondContact O-N 2.94Å
42	S	93.9	Very high	91.5	Very high	7 Å²	7	73.7 Å²	73.7	5%	0.049	37%	0.369	C	S	.	.	H	α-helix	trans	-63.6	-38.5	179.5	64.9	0	0	0	0	111.6	T38 M39 L45 A46	T38-S42 WeakPolarHBondContact O-CB 3.35Å; T38-S42 PolarHBondContact O-N 2.86Å; T38-S42 PolarHBondContact O-OG 2.85Å; T38-S42 VanDerWaalsContact O-OG 3.11Å; M39-S42 PolarHBondContact O-N 3.41Å; M39-S42 PolarHBondContact O-OG 3.15Å; S42-L45 PolarHBondContact O-N 2.86Å; S42-A46 VanDerWaalsContact O-CB 3.25Å; S42-A46 WeakPolarHBondContact O-CB 3.27Å; S42-A46 PolarHBondContact O-N 3.24Å
43	L	96	Very high	91.4	Very high	66 Å²	66	74.6 Å²	74.6	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-48	174.2	-177.9	63.7	0	0	0	112.1	F11 M39 A40 L41 L45 A46 L47	F11-L43 HydrophobicContact CD1-CD1 4.3Å; F11-L43 HydrophobicContact CD2-CB 3.79Å; F11-L43 HydrophobicContact CE1-CD1 4.26Å; F11-L43 HydrophobicContact CE2-CB 3.99Å; F11-L43 HydrophobicContact CE2-CD1 4.46Å; F11-L43 HydrophobicContact CE2-CD2 3.94Å; F11-L43 HydrophobicContact CE2-CG 4.35Å; F11-L43 HydrophobicContact CG-CB 4.28Å; F11-L43 HydrophobicContact CG-CD1 4.4Å; F11-L43 HydrophobicContact CZ-CD1 4.31Å; F11-L43 HydrophobicContact CZ-CD2 4.01Å; M39-L43 WeakPolarHBondContact O-CB 3.21Å; M39-L43 PolarHBondContact O-N 3.08Å; A40-L43 PolarHBondContact O-N 2.93Å; L41-L43 VanDerWaalsContact C-N 3.32Å; L41-L43 PolarHBondContact O-N 3.46Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.47Å; L43-A46 WeakPolarHBondContact O-CB 3.23Å; L43-A46 PolarHBondContact O-N 3.33Å; L43-L47 HydrophobicContact CG-CD1 4.39Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 3.35Å
44	I	96.5	Very high	91.4	Very high	106 Å²	106	70.5 Å²	70.5	54%	0.544	37%	0.369	S	S	.	.	H	α-helix	trans	-59.4	-47.6	177.8	-70.1	165.8	0	0	0	110	A40 L41 A46 L47 V48	A40-I44 VanDerWaalsContact O-CG1 3.26Å; A40-I44 WeakPolarHBondContact O-CG1 3.2Å; A40-I44 PolarHBondContact O-N 3.42Å; L41-I44 PolarHBondContact O-N 3.39Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 2.88Å; I44-L47 PolarHBondContact O-N 3.38Å; I44-V48 WeakPolarHBondContact O-CG2 3.11Å; I44-V48 PolarHBondContact O-N 3.07Å
45	L	94.7	Very high	91	Very high	76 Å²	76	69.1 Å²	69.1	40%	0.398	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-38.1	178.4	-69.3	173.6	0	0	0	111.7	L7 L41 S42 L43 V48 Q49	L7-L45 HydrophobicContact CD1-CB 3.8Å; L7-L45 HydrophobicContact CD2-CB 4.3Å; L41-L45 HydrophobicContact CD2-CD1 3.94Å; L41-L45 HydrophobicContact CG-CD1 4.08Å; L41-L45 WeakPolarHBondContact O-CB 3.42Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.36Å; L41-L45 PolarHBondContact O-N 2.94Å; S42-L45 PolarHBondContact O-N 2.86Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.47Å; L45-V48 PolarHBondContact O-N 3.4Å; L45-Q49 WeakPolarHBondContact O-CG 3.38Å; L45-Q49 PolarHBondContact O-N 2.85Å
46	A	94.4	Very high	89.9	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.008	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-49.8	174.2	0	0	0	0	0	110.6	F4 L7 S42 L43 I44 V48 Q49 L50	F4-A46 HydrophobicContact CD2-CB 3.93Å; F4-A46 VanDerWaalsContact CD2-O 3.29Å; F4-A46 WeakPolarHBondContact CD2-O 3.47Å; F4-A46 HydrophobicContact CE2-CB 4.2Å; L7-A46 HydrophobicContact CB-CB 3.78Å; S42-A46 VanDerWaalsContact O-CB 3.25Å; S42-A46 WeakPolarHBondContact O-CB 3.27Å; S42-A46 PolarHBondContact O-N 3.24Å; L43-A46 WeakPolarHBondContact O-CB 3.23Å; L43-A46 PolarHBondContact O-N 3.33Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 2.88Å; A46-V48 VanDerWaalsContact C-N 3.31Å; A46-V48 PolarHBondContact O-N 3.25Å; A46-Q49 CarbonylContact O-C 3.5Å; A46-Q49 PolarHBondContact O-N 3.03Å; A46-Q49 VanDerWaalsContact O-N 3.1Å; A46-L50 PolarHBondContact O-N 2.87Å
47	L	94.6	Very high	88.1	Confident	99 Å²	99	73.5 Å²	73.5	52%	0.518	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-39	178.2	-68.3	174.5	0	0	0	112.4	L43 I44 L50 K51	L43-L47 HydrophobicContact CG-CD1 4.39Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 3.35Å; I44-L47 PolarHBondContact O-N 3.38Å; L47-L50 PolarHBondContact O-N 2.94Å; L47-K51 WeakPolarHBondContact O-CB 3.39Å; L47-K51 PolarHBondContact O-N 3.32Å
48	V	92.4	Very high	85.8	Confident	68 Å²	68	75.5 Å²	75.5	41%	0.412	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-46	173.2	170.7	0	0	0	0	110.9	I44 L45 A46 L50 K51 I52	I44-V48 WeakPolarHBondContact O-CG2 3.11Å; I44-V48 PolarHBondContact O-N 3.07Å; L45-V48 PolarHBondContact O-N 3.4Å; A46-V48 VanDerWaalsContact C-N 3.31Å; A46-V48 PolarHBondContact O-N 3.25Å; V48-L50 VanDerWaalsContact C-N 3.29Å; V48-L50 PolarHBondContact O-N 3.07Å; V48-K51 PolarHBondContact O-N 2.93Å; V48-I52 HydrophobicContact CG1-CD1 3.77Å; V48-I52 HydrophobicContact CG1-CG1 4.42Å; V48-I52 VanDerWaalsContact O-CG1 3.3Å; V48-I52 WeakPolarHBondContact O-CG1 3.4Å; V48-I52 PolarHBondContact O-N 2.69Å
49	Q	90.1	Very high	83.5	Confident	44 Å²	44	80.3 Å²	80.3	21%	0.206	43%	0.434	C	S	.	.	H	α-helix	trans	-65.2	-32.7	176.9	-68.6	-58.6	-57.1	0	0	112.7	R3 F4 L7 L45 A46 W53	R3-Q49 HydrophobicContact CB-CG 4.12Å; F4-Q49 HydrophobicContact CB-CB 4.1Å; L7-Q49 HydrophobicContact CD1-CG 3.85Å; L45-Q49 WeakPolarHBondContact O-CG 3.38Å; L45-Q49 PolarHBondContact O-N 2.85Å; A46-Q49 CarbonylContact O-C 3.5Å; A46-Q49 PolarHBondContact O-N 3.03Å; A46-Q49 VanDerWaalsContact O-N 3.1Å; Q49-W53 VanDerWaalsContact O-CB 3.24Å; Q49-W53 WeakPolarHBondContact O-CB 3.12Å; Q49-W53 PolarHBondContact O-N 3.42Å
50	L	91.8	Very high	80.8	Confident	60 Å²	60	88.7 Å²	88.7	31%	0.314	47%	0.47	S	S	.	.	H	α-helix	trans	-67.3	-45	173.4	-174.7	65.5	0	0	0	110.9	F4 A46 L47 V48 W53 A54	F4-L50 HydrophobicContact CD1-CD1 4.28Å; F4-L50 HydrophobicContact CD2-CB 3.82Å; F4-L50 HydrophobicContact CD2-CD1 4.39Å; F4-L50 HydrophobicContact CE1-CD1 4.22Å; F4-L50 HydrophobicContact CE2-CB 4.04Å; F4-L50 HydrophobicContact CE2-CD1 4.33Å; F4-L50 HydrophobicContact CE2-CD2 4.14Å; F4-L50 HydrophobicContact CE2-CG 4.4Å; F4-L50 HydrophobicContact CG-CB 4.33Å; F4-L50 HydrophobicContact CG-CD1 4.35Å; F4-L50 HydrophobicContact CZ-CD1 4.24Å; F4-L50 HydrophobicContact CZ-CD2 4.33Å; A46-L50 PolarHBondContact O-N 2.87Å; L47-L50 PolarHBondContact O-N 2.94Å; V48-L50 VanDerWaalsContact C-N 3.29Å; V48-L50 PolarHBondContact O-N 3.07Å; L50-W53 HydrophobicContact CD1-CE3 4.15Å; L50-W53 PolarHBondContact O-N 2.79Å; L50-A54 WeakPolarHBondContact O-CB 3.33Å; L50-A54 PolarHBondContact O-N 3.27Å
51	K	90.2	Very high	77.9	Confident	160 Å²	160	92.9 Å²	92.9	70%	0.696	49%	0.486	S	S	*	.	H	α-helix	trans	-63.3	-45.2	177	-172.8	-178.4	178.2	-175.6	0	111.9	L47 V48 W53 A54 A55	L47-K51 WeakPolarHBondContact O-CB 3.39Å; L47-K51 PolarHBondContact O-N 3.32Å; V48-K51 PolarHBondContact O-N 2.93Å; K51-W53 VanDerWaalsContact C-N 3.3Å; K51-W53 PolarHBondContact O-N 3.19Å; K51-A54 PolarHBondContact O-N 3.08Å; K51-A55 VanDerWaalsContact O-CB 3.27Å; K51-A55 WeakPolarHBondContact O-CB 3.02Å; K51-A55 PolarHBondContact O-N 3.06Å
52	I	86.2	Confident	75.1	Confident	98 Å²	98	94.8 Å²	94.8	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-42.8	175.9	-68.5	166.8	0	0	0	110.3	V48 A55 G56	V48-I52 HydrophobicContact CG1-CD1 3.77Å; V48-I52 HydrophobicContact CG1-CG1 4.42Å; V48-I52 VanDerWaalsContact O-CG1 3.3Å; V48-I52 WeakPolarHBondContact O-CG1 3.4Å; V48-I52 PolarHBondContact O-N 2.69Å; I52-A55 PolarHBondContact O-N 3.09Å; I52-G56 PolarHBondContact O-N 3.35Å
53	W	83	Confident	72.2	Confident	118 Å²	118	102.7 Å²	102.7	45%	0.447	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-41.4	177.9	178.1	69.2	0	0	0	112.3	M1 Q49 L50 K51 G56	M1-W53 HydrophobicContact CE-CD2 3.64Å; M1-W53 HydrophobicContact CE-CE3 3.55Å; M1-W53 HydrophobicContact CE-CH2 3.27Å; M1-W53 HydrophobicContact CE-CZ2 3.37Å; M1-W53 HydrophobicContact CE-CZ3 3.36Å; Q49-W53 VanDerWaalsContact O-CB 3.24Å; Q49-W53 WeakPolarHBondContact O-CB 3.12Å; Q49-W53 PolarHBondContact O-N 3.42Å; L50-W53 HydrophobicContact CD1-CE3 4.15Å; L50-W53 PolarHBondContact O-N 2.79Å; K51-W53 VanDerWaalsContact C-N 3.3Å; K51-W53 PolarHBondContact O-N 3.19Å; W53-G56 PolarHBondContact O-N 2.83Å
54	A	85.2	Confident	69.4	Low	57 Å²	57	106.7 Å²	106.7	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-69.2	-36.5	176.7	0	0	0	0	0	112.9	L50 K51 G56	L50-A54 WeakPolarHBondContact O-CB 3.33Å; L50-A54 PolarHBondContact O-N 3.27Å; K51-A54 PolarHBondContact O-N 3.08Å; A54-G56 VanDerWaalsContact C-N 3.33Å
55	A	81.1	Confident	66.5	Low	42 Å²	42	108.9 Å²	108.9	35%	0.347	56%	0.557	S	S	.	*	H	α-helix	trans	-70.9	-30.4	174.1	0	0	0	0	0	112.1	K51 I52 E57 N58 E59	K51-A55 VanDerWaalsContact O-CB 3.27Å; K51-A55 WeakPolarHBondContact O-CB 3.02Å; K51-A55 PolarHBondContact O-N 3.06Å; I52-A55 PolarHBondContact O-N 3.09Å; A55-E57 PolarHBondContact O-N 2.89Å; A55-E57 VanDerWaalsContact O-N 3.09Å; A55-N58 PolarHBondContact O-N 3.41Å; A55-E59 PolarHBondContact O-N 3.02Å
56	G	64.3	Low	63.8	Low	58 Å²	58	113.1 Å²	113.1	60%	0.598	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-8.8	179	0	0	0	0	0	115.4	I52 W53 A54	I52-G56 PolarHBondContact O-N 3.35Å; W53-G56 PolarHBondContact O-N 2.83Å; A54-G56 VanDerWaalsContact C-N 3.33Å
57	E	51.8	Low	61.1	Low	162 Å²	162	121.9 Å²	121.9	76%	0.757	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-16.8	165.9	-80.2	-172.9	166.4	0	0	113.4	A55	A55-E57 PolarHBondContact O-N 2.89Å; A55-E57 VanDerWaalsContact O-N 3.09Å
58	N	43.2	Very low	58.3	Low	146 Å²	146	120.1 Å²	120.1	78%	0.781	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-12.3	-175	-80.9	-19.9	0	0	0	116.1	A55	A55-N58 PolarHBondContact O-N 3.41Å
59	E	41.8	Very low	56	Low	156 Å²	156	124.6 Å²	124.6	73%	0.729	64%	0.636	S	S	*	*			trans	-105.8	78.9	178.3	-77.9	176.5	-179.2	0	0	111.5	A55	A55-E59 PolarHBondContact O-N 3.02Å
60	K	35.5	Very low	53.7	Low	190 Å²	190	128.6 Å²	128.6	83%	0.826	66%	0.659	S	S	*	*			trans	-83.8	126	141.8	-76.4	-175.1	179.2	178	0	106.8
61	N	34.2	Very low	51.8	Low	139 Å²	139	134.3 Å²	134.3	74%	0.743	68%	0.684	S	S	*	*			trans	86.6	94.8	172.6	-45.6	-27	0	0	0	114.3
62	D	36	Very low	50.1	Low	137 Å²	137	128 Å²	128	73%	0.733	67%	0.665	S	S	*	*				-155.1	107	128.4	-90.1	-29.6	0	0	0	108.6	H64	D62-H64 VanDerWaalsContact C-N 3.3Å; D62-H64 PolarHBondContact O-N 3.24Å
63	E	32.7	Very low	49.1	Very low	174 Å²	174	127 Å²	127	81%	0.813	66%	0.66	S	S	*	*			trans	-73.3	77.9	178.7	-67.5	-178.1	162	0	0	110.2
64	H	38.3	Very low	48.3	Very low	149 Å²	149	126.9 Å²	126.9	69%	0.69	67%	0.668	S	S	*	*			trans	-93.9	100.7	167.8	-79.3	-65.3	0	0	0	110.9	D62 H66	D62-H64 VanDerWaalsContact C-N 3.3Å; D62-H64 PolarHBondContact O-N 3.24Å; H64-H66 VanDerWaalsContact C-N 3.29Å; H64-H66 PolarHBondContact O-N 2.82Å
65	H	34.2	Very low	48.1	Very low	152 Å²	152	129.9 Å²	129.9	70%	0.704	67%	0.67	S	S	*	*			trans	-62.3	78.9	172.6	-65.4	-79.8	0	0	0	112.2
66	H	38.8	Very low	48	Very low	165 Å²	165	132.8 Å²	132.8	76%	0.764	69%	0.688	S	S	*	*			trans	-102.3	110.4	161.9	-74.2	-67.6	0	0	0	109.1	H64 G68	H64-H66 VanDerWaalsContact C-N 3.29Å; H64-H66 PolarHBondContact O-N 2.82Å; H66-G68 PolarHBondContact O-N 3.22Å
67	H	36.7	Very low	48.9	Very low	186 Å²	186	135.9 Å²	135.9	86%	0.861	68%	0.683	S	S	*	*			trans	-66.4	66.8	170.2	-67.9	-76	0	0	0	110.4
68	G	37.9	Very low	50.5	Low	61 Å²	61	131.3 Å²	131.3	63%	0.629	66%	0.661	S	S	*	*			trans	-91.3	119.5	168.7	0	0	0	0	0	108.4	H66 D70	H66-G68 PolarHBondContact O-N 3.22Å; G68-D70 PolarHBondContact O-N 2.91Å; G68-D70 VanDerWaalsContact O-N 3.1Å
69	H	42.8	Very low	52.3	Low	163 Å²	163	130.2 Å²	130.2	76%	0.755	65%	0.646	S	S	*	*			trans	-49.5	116.3	174.9	-63.9	-82.1	0	0	0	110.2	H71	H69-H71 VanDerWaalsContact C-N 3.29Å; H69-H71 PolarHBondContact O-CD2 3.42Å; H69-H71 PolarHBondContact O-N 3.03Å
70	D	42.7	Very low	54.4	Low	127 Å²	127	124.7 Å²	124.7	68%	0.679	63%	0.631	S	S	*	*			trans	-72.4	88.4	179.8	-158.9	-1.2	0	0	0	108.2	G68 G72	G68-D70 PolarHBondContact O-N 2.91Å; G68-D70 VanDerWaalsContact O-N 3.1Å; D70-G72 PolarHBondContact O-N 3.41Å; D70-G72 VanDerWaalsContact O-N 3.07Å; D70-G72 WeakPolarHBondContact OD1-CA 3.01Å; D70-G72 PolarHBondContact OD1-N 3.29Å; D70-G72 VanDerWaalsContact OD1-N 3.17Å
71	H	50.6	Low	56.9	Low	180 Å²	180	120 Å²	120	83%	0.833	61%	0.614	S	S	*	*			trans	-72.6	21.9	165.3	-64.4	-71.4	0	0	0	111.3	H69	H69-H71 VanDerWaalsContact C-N 3.29Å; H69-H71 PolarHBondContact O-CD2 3.42Å; H69-H71 PolarHBondContact O-N 3.03Å
72	G	56.1	Low	59.3	Low	29 Å²	29	114.7 Å²	114.7	30%	0.299	59%	0.589	S	S	.	*	S	Bend	trans	-66.5	135.6	173.1	0	0	0	0	0	111.2	D70 N74	D70-G72 PolarHBondContact O-N 3.41Å; D70-G72 VanDerWaalsContact O-N 3.07Å; D70-G72 WeakPolarHBondContact OD1-CA 3.01Å; D70-G72 PolarHBondContact OD1-N 3.29Å; D70-G72 VanDerWaalsContact OD1-N 3.17Å; G72-N74 VanDerWaalsContact C-N 3.31Å; G72-N74 PolarHBondContact O-N 2.83Å
73	L	64.1	Low	61.8	Low	76 Å²	76	111 Å²	111	40%	0.398	57%	0.566	S	S	.	*			trans	-58.8	96.8	161.5	-64.4	161.8	0	0	0	107.4	K75 Q78 R79 A82	L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 2.95Å; L73-Q78 HydrophobicContact CB-CB 3.87Å; L73-Q78 HydrophobicContact CD2-CB 3.86Å; L73-Q78 HydrophobicContact CG-CB 4.35Å; L73-R79 HydrophobicContact CB-CG 3.77Å; L73-R79 WeakPolarHBondContact O-CG 3.33Å; L73-R79 PolarHBondContact O-NE 3.3Å; L73-R79 PolarHBondContact O-NH2 3.48Å; L73-A82 HydrophobicContact CD1-CB 3.47Å; L73-A82 VanDerWaalsContact CD1-CB 3.47Å
74	N	66.8	Low	64.6	Low	116 Å²	116	108.3 Å²	108.3	62%	0.62	56%	0.556	S	S	*	*			trans	-67.3	-34	-170.8	-88	-19.7	0	0	0	112.6	G72	G72-N74 VanDerWaalsContact C-N 3.31Å; G72-N74 PolarHBondContact O-N 2.83Å
75	K	80.4	Confident	67.1	Low	119 Å²	119	106.2 Å²	106.2	52%	0.517	55%	0.55	S	S	.	.	S	Bend	trans	-88.9	138.5	-177.3	-56.8	-173.1	-173.5	175.3	0	110.8	L73 Y77 Q78 R79	L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 2.95Å; K75-Y77 VanDerWaalsContact C-N 3.26Å; K75-Y77 HydrophobicContact CB-CD1 3.71Å; K75-Y77 HydrophobicContact CB-CE1 3.57Å; K75-Y77 HydrophobicContact CD-CD1 4.17Å; K75-Y77 HydrophobicContact CD-CE1 3.26Å; K75-Y77 HydrophobicContact CG-CE1 4.05Å; K75-Y77 PolarHBondContact O-N 3.45Å; K75-Q78 HydrophobicContact CB-CG 4.1Å; K75-Q78 WeakPolarHBondContact O-CB 3.2Å; K75-Q78 PolarHBondContact O-N 3.43Å; K75-R79 PolarHBondContact O-N 2.87Å
76	S	80.1	Confident	69.8	Low	103 Å²	103	103.1 Å²	103.1	72%	0.72	54%	0.538	S	S	*	.	H	α-helix	trans	-56.1	-39	179.9	54.8	0	0	0	0	112.8	Q78 R79 G80	S76-Q78 VanDerWaalsContact C-N 3.35Å; S76-Q78 PolarHBondContact O-N 3.4Å; S76-R79 PolarHBondContact O-N 3.48Å; S76-G80 PolarHBondContact O-N 3.13Å
77	Y	83.3	Confident	72.3	Confident	124 Å²	124	96.6 Å²	96.6	49%	0.486	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-34.9	177.1	78.7	-99.9	0	0	0	112.7	K75 R79 G80 I81	K75-Y77 VanDerWaalsContact C-N 3.26Å; K75-Y77 HydrophobicContact CB-CD1 3.71Å; K75-Y77 HydrophobicContact CB-CE1 3.57Å; K75-Y77 HydrophobicContact CD-CD1 4.17Å; K75-Y77 HydrophobicContact CD-CE1 3.26Å; K75-Y77 HydrophobicContact CG-CE1 4.05Å; K75-Y77 PolarHBondContact O-N 3.45Å; Y77-R79 VanDerWaalsContact C-N 3.34Å; Y77-G80 PolarHBondContact O-N 3.3Å; Y77-I81 HydrophobicContact CD2-CD1 3.86Å; Y77-I81 HydrophobicContact CE2-CD1 4.39Å; Y77-I81 WeakPolarHBondContact O-CG1 3.35Å; Y77-I81 PolarHBondContact O-N 2.87Å
78	Q	84.3	Confident	75	Confident	65 Å²	65	91.9 Å²	91.9	30%	0.304	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-41.5	178	-69.8	176.7	-43.9	0	0	110.5	L73 K75 S76 G80 I81 A82	L73-Q78 HydrophobicContact CB-CB 3.87Å; L73-Q78 HydrophobicContact CD2-CB 3.86Å; L73-Q78 HydrophobicContact CG-CB 4.35Å; K75-Q78 HydrophobicContact CB-CG 4.1Å; K75-Q78 WeakPolarHBondContact O-CB 3.2Å; K75-Q78 PolarHBondContact O-N 3.43Å; S76-Q78 VanDerWaalsContact C-N 3.35Å; S76-Q78 PolarHBondContact O-N 3.4Å; Q78-G80 VanDerWaalsContact C-N 3.33Å; Q78-I81 PolarHBondContact O-N 3.21Å; Q78-A82 WeakPolarHBondContact O-CB 3.34Å; Q78-A82 PolarHBondContact O-N 3.49Å
79	R	80.6	Confident	77.4	Confident	124 Å²	124	92 Å²	92	47%	0.468	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-42.5	172.4	-63	178.4	-173.4	176.8	1.4	111.2	L73 K75 S76 Y77 A82 Y83	L73-R79 HydrophobicContact CB-CG 3.77Å; L73-R79 WeakPolarHBondContact O-CG 3.33Å; L73-R79 PolarHBondContact O-NE 3.3Å; L73-R79 PolarHBondContact O-NH2 3.48Å; K75-R79 PolarHBondContact O-N 2.87Å; S76-R79 PolarHBondContact O-N 3.48Å; Y77-R79 VanDerWaalsContact C-N 3.34Å; R79-A82 PolarHBondContact O-N 2.91Å; R79-Y83 HydrophobicContact CB-CE2 4.32Å; R79-Y83 WeakPolarHBondContact O-CD2 3.45Å; R79-Y83 PolarHBondContact O-N 2.88Å
80	G	85.5	Confident	79.8	Confident	40 Å²	40	85.2 Å²	85.2	41%	0.412	45%	0.452	S	S	.	.	H	α-helix	trans	-58.1	-49.7	175.5	0	0	0	0	0	112.6	S76 Y77 Q78 Y83 L84	S76-G80 PolarHBondContact O-N 3.13Å; Y77-G80 PolarHBondContact O-N 3.3Å; Q78-G80 VanDerWaalsContact C-N 3.33Å; G80-Y83 PolarHBondContact O-N 2.8Å; G80-L84 WeakPolarHBondContact O-CB 3.22Å; G80-L84 PolarHBondContact O-N 3.11Å
81	I	88.2	Confident	82	Confident	91 Å²	91	82.2 Å²	82.2	47%	0.467	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-44.6	177.2	-67.3	169	0	0	0	111	Y77 Q78 Y83 L84 L85	Y77-I81 HydrophobicContact CD2-CD1 3.86Å; Y77-I81 HydrophobicContact CE2-CD1 4.39Å; Y77-I81 WeakPolarHBondContact O-CG1 3.35Å; Y77-I81 PolarHBondContact O-N 2.87Å; Q78-I81 PolarHBondContact O-N 3.21Å; I81-Y83 PolarHBondContact O-N 3.22Å; I81-L84 PolarHBondContact O-N 3.43Å; I81-L85 HydrophobicContact CG2-CD1 3.84Å; I81-L85 HydrophobicContact CG2-CG 4.27Å; I81-L85 WeakPolarHBondContact O-CB 3.48Å; I81-L85 WeakPolarHBondContact O-CG 3.36Å; I81-L85 PolarHBondContact O-N 2.87Å
82	A	86	Confident	83.8	Confident	27 Å²	27	76.9 Å²	76.9	22%	0.223	42%	0.418	C	S	.	.	H	α-helix	trans	-60.7	-43.6	178.7	0	0	0	0	0	112	L73 Q78 R79 L85 L86	L73-A82 HydrophobicContact CD1-CB 3.47Å; L73-A82 VanDerWaalsContact CD1-CB 3.47Å; Q78-A82 WeakPolarHBondContact O-CB 3.34Å; Q78-A82 PolarHBondContact O-N 3.49Å; R79-A82 PolarHBondContact O-N 2.91Å; A82-L85 PolarHBondContact O-N 3.29Å; A82-L86 WeakPolarHBondContact O-CB 3.19Å; A82-L86 VanDerWaalsContact O-CG 3.24Å; A82-L86 WeakPolarHBondContact O-CG 3.48Å; A82-L86 PolarHBondContact O-N 2.99Å
83	Y	88.3	Confident	85.1	Confident	61 Å²	61	76 Å²	76	24%	0.239	41%	0.409	C	S	.	.	H	α-helix	trans	-66.7	-36.7	175.3	-67.7	-46.3	0	0	0	112.7	I2 R3 I6 R79 G80 I81 L86 A87	I2-Y83 HydrophobicContact CG2-CD1 3.84Å; I2-Y83 HydrophobicContact CG2-CD2 4.24Å; I2-Y83 HydrophobicContact CG2-CE1 4.13Å; I2-Y83 HydrophobicContact CG2-CE2 4.49Å; I2-Y83 HydrophobicContact CG2-CG 3.92Å; R3-Y83 HydrophobicContact CG-CE1 3.83Å; R3-Y83 PolarHBondContact NE-OH 2.9Å; I6-Y83 HydrophobicContact CD1-CD1 3.85Å; R79-Y83 HydrophobicContact CB-CE2 4.32Å; R79-Y83 WeakPolarHBondContact O-CD2 3.45Å; R79-Y83 PolarHBondContact O-N 2.88Å; G80-Y83 PolarHBondContact O-N 2.8Å; I81-Y83 PolarHBondContact O-N 3.22Å; Y83-L86 PolarHBondContact O-N 3.15Å; Y83-A87 WeakPolarHBondContact O-CB 3.3Å; Y83-A87 PolarHBondContact O-N 2.95Å
84	L	90.7	Very high	86.1	Confident	117 Å²	117	76.9 Å²	76.9	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-63.1	-47.2	175.4	-172.3	154.5	0	0	0	111	G80 I81 L86 A87 L88	G80-L84 WeakPolarHBondContact O-CB 3.22Å; G80-L84 PolarHBondContact O-N 3.11Å; I81-L84 PolarHBondContact O-N 3.43Å; L84-L86 PolarHBondContact O-N 2.95Å; L84-A87 PolarHBondContact O-N 3.01Å; L84-L88 PolarHBondContact O-N 3.22Å
85	L	90.8	Very high	87	Confident	105 Å²	105	77.5 Å²	77.5	55%	0.55	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-41.5	177.2	-73.1	172	0	0	0	112.1	I81 A82 A87 L88 P89	I81-L85 HydrophobicContact CG2-CD1 3.84Å; I81-L85 HydrophobicContact CG2-CG 4.27Å; I81-L85 WeakPolarHBondContact O-CB 3.48Å; I81-L85 WeakPolarHBondContact O-CG 3.36Å; I81-L85 PolarHBondContact O-N 2.87Å; A82-L85 PolarHBondContact O-N 3.29Å; L85-A87 VanDerWaalsContact C-N 3.35Å; L85-L88 PolarHBondContact O-N 2.95Å; L85-P89 WeakPolarHBondContact O-CD 3.32Å
86	L	90.5	Very high	87.1	Confident	87 Å²	87	78.2 Å²	78.2	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-70.6	-29.2	176.8	-71.8	168.7	0	0	0	112.9	I6 Y10 A82 Y83 L84	I6-L86 HydrophobicContact CD1-CB 4.29Å; I6-L86 HydrophobicContact CG2-CB 4.3Å; Y10-L86 PolarHBondContact OH-O 2.84Å; A82-L86 WeakPolarHBondContact O-CB 3.19Å; A82-L86 VanDerWaalsContact O-CG 3.24Å; A82-L86 WeakPolarHBondContact O-CG 3.48Å; A82-L86 PolarHBondContact O-N 2.99Å; Y83-L86 PolarHBondContact O-N 3.15Å; L84-L86 PolarHBondContact O-N 2.95Å
87	A	91.7	Very high	86.9	Confident	28 Å²	28	78.4 Å²	78.4	23%	0.231	42%	0.422	C	S	.	.	H	α-helix	trans	-81.9	-21.1	176.2	0	0	0	0	0	112.6	Y83 L84 L85 L90 V91	Y83-A87 WeakPolarHBondContact O-CB 3.3Å; Y83-A87 PolarHBondContact O-N 2.95Å; L84-A87 PolarHBondContact O-N 3.01Å; L85-A87 VanDerWaalsContact C-N 3.35Å; A87-L90 WeakPolarHBondContact O-CB 3.42Å; A87-L90 PolarHBondContact O-N 3.38Å; A87-V91 WeakPolarHBondContact O-CG2 3.28Å; A87-V91 PolarHBondContact O-N 3.47Å
88	L	93.3	Very high	86.4	Confident	87 Å²	87	74.2 Å²	74.2	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-55.3	-47.6	-174.2	177.7	68.8	0	0	0	113.6	L84 L85 L90 V91 V92	L84-L88 PolarHBondContact O-N 3.22Å; L85-L88 PolarHBondContact O-N 2.95Å; L88-L90 PolarHBondContact O-N 2.75Å; L88-V91 PolarHBondContact O-N 3.19Å; L88-V92 HydrophobicContact CD1-CG2 3.94Å; L88-V92 HydrophobicContact CG-CG2 4.28Å; L88-V92 VanDerWaalsContact O-CG2 3.28Å; L88-V92 WeakPolarHBondContact O-CG2 3.43Å; L88-V92 PolarHBondContact O-N 2.91Å
89	P	89.5	Confident	85.8	Confident	62 Å²	62	77.7 Å²	77.7	40%	0.403	43%	0.429	S	S	.	.	H	α-helix	trans	-61.4	-32.8	177.1	-24.8	35.9	0	0	0	113.2	Y10 L85 G93	Y10-P89 HydrophobicContact CE1-CB 4.17Å; L85-P89 WeakPolarHBondContact O-CD 3.32Å; P89-G93 PolarHBondContact O-N 2.84Å
90	L	91.4	Very high	85.3	Confident	21 Å²	21	75.4 Å²	75.4	11%	0.11	43%	0.432	C	S	.	.	H	α-helix	trans	-68.7	-45.7	175.9	-60.5	174.8	0	0	0	111.2	I6 G9 Y10 L13 A87 L88 G93 T94	I6-L90 HydrophobicContact CG2-CD1 4.13Å; I6-L90 WeakPolarHBondContact O-CD1 3.32Å; G9-L90 WeakPolarHBondContact O-CD2 3.25Å; Y10-L90 HydrophobicContact CD1-CD2 3.52Å; Y10-L90 HydrophobicContact CD1-CG 4.17Å; Y10-L90 HydrophobicContact CD2-CD1 4.4Å; Y10-L90 HydrophobicContact CD2-CD2 4.47Å; Y10-L90 HydrophobicContact CE1-CD2 3.93Å; Y10-L90 HydrophobicContact CE1-CG 4.14Å; Y10-L90 HydrophobicContact CE2-CD1 4.49Å; Y10-L90 HydrophobicContact CG-CD2 3.85Å; Y10-L90 HydrophobicContact CG-CG 4.44Å; L13-L90 HydrophobicContact CB-CD2 4.08Å; L13-L90 HydrophobicContact CD2-CD2 3.87Å; A87-L90 WeakPolarHBondContact O-CB 3.42Å; A87-L90 PolarHBondContact O-N 3.38Å; L88-L90 PolarHBondContact O-N 2.75Å; L90-G93 PolarHBondContact O-N 2.89Å; L90-T94 WeakPolarHBondContact O-CB 3.37Å; L90-T94 VanDerWaalsContact O-CG2 3.25Å; L90-T94 WeakPolarHBondContact O-CG2 3.31Å; L90-T94 PolarHBondContact O-N 3.23Å; L90-T94 PolarHBondContact O-OG1 3.11Å
91	V	90.6	Very high	84.7	Confident	65 Å²	65	76 Å²	76	39%	0.394	43%	0.425	S	S	.	.	H	α-helix	trans	-60.7	-47.1	177.2	175.2	0	0	0	0	110.2	A87 L88 T94 L95	A87-V91 WeakPolarHBondContact O-CG2 3.28Å; A87-V91 PolarHBondContact O-N 3.47Å; L88-V91 PolarHBondContact O-N 3.19Å; V91-T94 PolarHBondContact O-N 2.87Å; V91-T94 PolarHBondContact O-OG1 3.08Å; V91-L95 HydrophobicContact CG1-CD1 3.7Å; V91-L95 HydrophobicContact CG1-CG 4.44Å; V91-L95 VanDerWaalsContact O-CB 3.28Å; V91-L95 WeakPolarHBondContact O-CB 3.47Å; V91-L95 WeakPolarHBondContact O-CG 3.46Å; V91-L95 PolarHBondContact O-N 2.78Å
92	V	87.3	Confident	84.2	Confident	67 Å²	67	73.8 Å²	73.8	41%	0.406	42%	0.415	S	S	.	.	H	α-helix	trans	-64.9	-50	179.6	175.2	0	0	0	0	110.6	L88 T94 F96	L88-V92 HydrophobicContact CD1-CG2 3.94Å; L88-V92 HydrophobicContact CG-CG2 4.28Å; L88-V92 VanDerWaalsContact O-CG2 3.28Å; L88-V92 WeakPolarHBondContact O-CG2 3.43Å; L88-V92 PolarHBondContact O-N 2.91Å; V92-T94 PolarHBondContact O-N 3.34Å; V92-F96 WeakPolarHBondContact O-CB 3.47Å; V92-F96 PolarHBondContact O-N 3.4Å; V92-F96 VanDerWaalsContact O-N 3.13Å
93	G	83.6	Confident	83.7	Confident	12 Å²	12	72.8 Å²	72.8	12%	0.124	41%	0.406	C	S	.	.	H	α-helix	trans	-66.4	-19.9	-177.9	0	0	0	0	0	115	P89 L90	P89-G93 PolarHBondContact O-N 2.84Å; L90-G93 PolarHBondContact O-N 2.89Å
94	T	84.9	Confident	83.1	Confident	94 Å²	94	73.6 Å²	73.6	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-100.6	-38.6	179.3	55.2	0	0	0	0	113.7	L13 L90 V91 V92	L13-T94 HydrophobicContact CD1-CG2 4.15Å; L90-T94 WeakPolarHBondContact O-CB 3.37Å; L90-T94 VanDerWaalsContact O-CG2 3.25Å; L90-T94 WeakPolarHBondContact O-CG2 3.31Å; L90-T94 PolarHBondContact O-N 3.23Å; L90-T94 PolarHBondContact O-OG1 3.11Å; V91-T94 PolarHBondContact O-N 2.87Å; V91-T94 PolarHBondContact O-OG1 3.08Å; V92-T94 PolarHBondContact O-N 3.34Å
95	L	86.3	Confident	82.2	Confident	128 Å²	128	69.9 Å²	69.9	67%	0.67	40%	0.398	S	S	*	.	H	α-helix	trans	-92.4	-25.5	-173.7	-63.2	-178.4	0	0	0	113.9	V91	V91-L95 HydrophobicContact CG1-CD1 3.7Å; V91-L95 HydrophobicContact CG1-CG 4.44Å; V91-L95 VanDerWaalsContact O-CB 3.28Å; V91-L95 WeakPolarHBondContact O-CB 3.47Å; V91-L95 WeakPolarHBondContact O-CG 3.46Å; V91-L95 PolarHBondContact O-N 2.78Å
96	F	82.1	Confident	81.2	Confident	135 Å²	135	65.3 Å²	65.3	59%	0.592	37%	0.374	S	S	*	.	S	Bend	trans	-97.1	130.1	-176.9	-70.8	-104.1	0	0	0	110.3	V92	V92-F96 WeakPolarHBondContact O-CB 3.47Å; V92-F96 PolarHBondContact O-N 3.4Å; V92-F96 VanDerWaalsContact O-N 3.13Å
97	P	76.8	Confident	80	Confident	106 Å²	106	66.2 Å²	66.2	69%	0.688	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-66.1	139.6	176	28.3	-33.4	0	0	0	110.1	I99	P97-I99 PolarHBondContact O-N 2.74Å
98	T	72.7	Confident	78.6	Confident	36 Å²	36	69.2 Å²	69.2	22%	0.221	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-65.1	122.3	167.5	44.6	0	0	0	0	109.7	R22 Q25 Y26	R22-T98 PolarHBondContact NH1-OG1 3.39Å; Q25-T98 PolarHBondContact OE1-OG1 3.25Å; Y26-T98 HydrophobicContact CE2-CG2 3.59Å; Y26-T98 WeakPolarHBondContact OH-CG2 3.39Å
99	I	70.3	Confident	76.9	Confident	139 Å²	139	69.2 Å²	69.2	71%	0.713	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-93.9	127.7	170.9	-62.5	174	0	0	0	107.5	P97	P97-I99 PolarHBondContact O-N 2.74Å
100	S	71.8	Confident	75	Confident	76 Å²	76	67 Å²	67	53%	0.531	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-70.9	136.6	170.7	51.6	0	0	0	0	109.7	D102	S100-D102 PolarHBondContact O-N 2.98Å
101	L	72.3	Confident	73	Confident	51 Å²	51	67.4 Å²	67.4	27%	0.267	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-65.9	128.1	173.1	-56.2	169	0	0	0	109.5	I105 F208	L101-I105 HydrophobicContact CB-CD1 4.06Å; L101-I105 HydrophobicContact CD2-CD1 3.32Å; L101-I105 HydrophobicContact CG-CD1 4.28Å; L101-F208 HydrophobicContact CB-CB 4.2Å; L101-F208 HydrophobicContact CB-CD1 3.48Å; L101-F208 VanDerWaalsContact CB-CD1 3.48Å; L101-F208 HydrophobicContact CB-CD2 3.47Å; L101-F208 VanDerWaalsContact CB-CD2 3.47Å; L101-F208 HydrophobicContact CB-CE1 3.58Å; L101-F208 HydrophobicContact CB-CE2 3.6Å; L101-F208 HydrophobicContact CB-CG 3.42Å; L101-F208 VanDerWaalsContact CB-CG 3.42Å; L101-F208 HydrophobicContact CB-CZ 3.66Å; L101-F208 HydrophobicContact CD1-CB 3.82Å; L101-F208 HydrophobicContact CD1-CD1 3.53Å; L101-F208 HydrophobicContact CD1-CE1 4.25Å; L101-F208 HydrophobicContact CD1-CG 3.75Å; L101-F208 HydrophobicContact CG-CD1 4.04Å; L101-F208 HydrophobicContact CG-CE1 4.33Å; L101-F208 HydrophobicContact CG-CG 4.21Å; L101-F208 WeakPolarHBondContact O-CD2 3.15Å; L101-F208 VanDerWaalsContact O-CE2 3.3Å; L101-F208 WeakPolarHBondContact O-CE2 3.34Å
102	D	77.6	Confident	70.8	Confident	46 Å²	46	68.5 Å²	68.5	25%	0.246	40%	0.396	C	S	.	.			trans	-138.5	-177.9	-174.2	74.7	3.7	0	0	0	112.4	S100 T104 I105 F208 N235	S100-D102 PolarHBondContact O-N 2.98Å; D102-T104 PolarHBondContact O-N 3.05Å; D102-T104 VanDerWaalsContact O-N 3.13Å; D102-T104 WeakPolarHBondContact OD1-CA 3.41Å; D102-T104 VanDerWaalsContact OD1-CB 3.27Å; D102-T104 WeakPolarHBondContact OD1-CB 3.28Å; D102-T104 PolarHBondContact OD1-N 3.23Å; D102-T104 PolarHBondContact OD1-OG1 3.01Å; D102-I105 PolarHBondContact O-N 3.01Å; D102-I105 VanDerWaalsContact O-N 3.08Å; D102-F208 VanDerWaalsContact O-CZ 3.29Å; D102-F208 WeakPolarHBondContact O-CZ 3.42Å; D102-N235 WeakPolarHBondContact CB-OD1 3.33Å
103	T	75.5	Confident	68.5	Low	5 Å²	5	69.7 Å²	69.7	3%	0.031	40%	0.396	C	S	.	.	H	α-helix	trans	-60.1	-22.6	-180	57.5	0	0	0	0	114	I105 V106 E107 F191 Y193 N234 N235	T103-I105 PolarHBondContact O-N 2.72Å; T103-V106 WeakPolarHBondContact O-CB 3.18Å; T103-V106 PolarHBondContact O-N 2.98Å; T103-V106 VanDerWaalsContact O-N 3.12Å; T103-E107 WeakPolarHBondContact O-CG 3.34Å; T103-E107 PolarHBondContact O-N 2.86Å; T103-F191 HydrophobicContact CG2-CD2 3.9Å; T103-F191 HydrophobicContact CG2-CE2 3.89Å; T103-Y193 HydrophobicContact CG2-CD2 3.88Å; T103-N234 HydrophobicContact CG2-CB 4.04Å; T103-N235 VanDerWaalsContact CG2-OD1 3.27Å; T103-N235 WeakPolarHBondContact CG2-OD1 3.23Å; T103-N235 PolarHBondContact N-OD1 3.47Å; T103-N235 PolarHBondContact OG1-ND2 3.19Å; T103-N235 PolarHBondContact OG1-OD1 3.14Å
104	T	74.5	Confident	66.2	Low	79 Å²	79	72.3 Å²	72.3	49%	0.485	41%	0.411	S	S	.	.	H	α-helix	trans	-65.3	-31.2	177.2	73.1	0	0	0	0	111.6	D102 A108	D102-T104 PolarHBondContact O-N 3.05Å; D102-T104 VanDerWaalsContact O-N 3.13Å; D102-T104 WeakPolarHBondContact OD1-CA 3.41Å; D102-T104 VanDerWaalsContact OD1-CB 3.27Å; D102-T104 WeakPolarHBondContact OD1-CB 3.28Å; D102-T104 PolarHBondContact OD1-N 3.23Å; D102-T104 PolarHBondContact OD1-OG1 3.01Å; T104-A108 VanDerWaalsContact O-CB 3.23Å; T104-A108 WeakPolarHBondContact O-CB 3.32Å; T104-A108 PolarHBondContact O-N 2.86Å
105	I	72.7	Confident	63.7	Low	39 Å²	39	74.9 Å²	74.9	20%	0.2	43%	0.426	C	S	.	.	H	α-helix	trans	-72.7	-35.5	174.9	-58.5	-178.5	0	0	0	110.8	L101 D102 T103 A108 K109 F208	L101-I105 HydrophobicContact CB-CD1 4.06Å; L101-I105 HydrophobicContact CD2-CD1 3.32Å; L101-I105 HydrophobicContact CG-CD1 4.28Å; D102-I105 PolarHBondContact O-N 3.01Å; D102-I105 VanDerWaalsContact O-N 3.08Å; T103-I105 PolarHBondContact O-N 2.72Å; I105-A108 PolarHBondContact O-N 2.81Å; I105-K109 HydrophobicContact CG2-CD 4.04Å; I105-K109 HydrophobicContact CG2-CG 4.22Å; I105-K109 VanDerWaalsContact O-CB 3.31Å; I105-K109 WeakPolarHBondContact O-CB 3.2Å; I105-K109 WeakPolarHBondContact O-CG 3.37Å; I105-K109 PolarHBondContact O-N 2.89Å; I105-F208 HydrophobicContact CB-CE1 4.45Å; I105-F208 HydrophobicContact CB-CZ 4.24Å; I105-F208 HydrophobicContact CG2-CE1 4.28Å
106	V	69.3	Low	61.2	Low	8 Å²	8	70.5 Å²	70.5	5%	0.048	41%	0.406	C	S	.	.	H	α-helix	trans	-62.9	-46	174.6	-176.8	0	0	0	0	110.3	T103 G110 F191 Y193 F206 F208 V219	T103-V106 WeakPolarHBondContact O-CB 3.18Å; T103-V106 PolarHBondContact O-N 2.98Å; T103-V106 VanDerWaalsContact O-N 3.12Å; V106-G110 PolarHBondContact O-N 2.92Å; V106-F191 HydrophobicContact CG2-CE2 4.38Å; V106-F191 HydrophobicContact CG2-CZ 4.42Å; V106-Y193 HydrophobicContact CB-CD2 4.33Å; V106-Y193 HydrophobicContact CB-CE2 4.2Å; V106-Y193 HydrophobicContact CG1-CD1 4.24Å; V106-Y193 HydrophobicContact CG1-CD2 4.07Å; V106-Y193 HydrophobicContact CG1-CE1 4.01Å; V106-Y193 HydrophobicContact CG1-CE2 3.86Å; V106-Y193 HydrophobicContact CG1-CG 4.24Å; V106-F206 HydrophobicContact CG1-CE2 4.38Å; V106-F208 HydrophobicContact CG2-CZ 4.01Å; V106-V219 HydrophobicContact CG2-CB 4.34Å; V106-V219 HydrophobicContact CG2-CG1 4.08Å; V106-V219 HydrophobicContact CG2-CG2 3.75Å
107	E	66.9	Low	59	Low	107 Å²	107	73.2 Å²	73.2	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-63.8	-46.1	176.7	-69.6	171.8	-167.2	0	0	111.4	T103 G110 Y193	T103-E107 WeakPolarHBondContact O-CG 3.34Å; T103-E107 PolarHBondContact O-N 2.86Å; E107-G110 PolarHBondContact O-N 3.37Å; E107-Y193 HydrophobicContact CG-CE2 3.86Å
108	A	62.3	Low	57.2	Low	90 Å²	90	76.4 Å²	76.4	74%	0.744	42%	0.424	S	S	*	.	H	α-helix	trans	-68.5	-36.7	-178	0	0	0	0	0	113.5	T104 I105 G110	T104-A108 VanDerWaalsContact O-CB 3.23Å; T104-A108 WeakPolarHBondContact O-CB 3.32Å; T104-A108 PolarHBondContact O-N 2.86Å; I105-A108 PolarHBondContact O-N 2.81Å; A108-G110 PolarHBondContact O-N 3.01Å
109	K	56.6	Low	55.5	Low	88 Å²	88	79.5 Å²	79.5	38%	0.383	45%	0.447	S	S	.	.	H	α-helix	trans	-71.1	-22.3	174.8	-75.1	-173	173.9	-173.8	0	111.8	I105 Y129 S217	I105-K109 HydrophobicContact CG2-CD 4.04Å; I105-K109 HydrophobicContact CG2-CG 4.22Å; I105-K109 VanDerWaalsContact O-CB 3.31Å; I105-K109 WeakPolarHBondContact O-CB 3.2Å; I105-K109 WeakPolarHBondContact O-CG 3.37Å; I105-K109 PolarHBondContact O-N 2.89Å; K109-Y129 HydrophobicContact CB-CE1 4.08Å; K109-Y129 PolarHBondContact O-OH 3.44Å; K109-S217 PolarHBondContact NZ-O 3.08Å
110	G	49.8	Very low	53.8	Low	14 Å²	14	74.1 Å²	74.1	14%	0.144	42%	0.42	C	S	.	.			trans	84.9	106.5	-177.5	0	0	0	0	0	110.3	V106 E107 A108 S112 Y129	V106-G110 PolarHBondContact O-N 2.92Å; E107-G110 PolarHBondContact O-N 3.37Å; A108-G110 PolarHBondContact O-N 3.01Å; G110-S112 PolarHBondContact O-N 2.84Å; G110-Y129 WeakPolarHBondContact O-CE1 3.44Å
111	F	49.1	Very low	52.2	Low	31 Å²	31	74.7 Å²	74.7	14%	0.136	44%	0.438	C	S	.	.	S	Bend	trans	-70	-19.7	165.4	-171	-106.1	0	0	0	111.9	F113 L130 Y193 F204 F206 F249	F111-F113 PolarHBondContact O-N 3.45Å; F111-L130 HydrophobicContact CE2-CD1 3.85Å; F111-L130 HydrophobicContact CE2-CD2 3.55Å; F111-L130 HydrophobicContact CE2-CG 3.78Å; F111-L130 HydrophobicContact CZ-CD1 3.84Å; F111-L130 HydrophobicContact CZ-CD2 4.04Å; F111-L130 HydrophobicContact CZ-CG 4.27Å; F111-Y193 HydrophobicContact CB-CE1 4.2Å; F111-Y193 HydrophobicContact CD1-CE1 4.46Å; F111-Y193 HydrophobicContact CD2-CE1 4.42Å; F111-Y193 HydrophobicContact CG-CE1 4.11Å; F111-F204 HydrophobicContact CE1-CD2 4.49Å; F111-F204 HydrophobicContact CE1-CE1 4.42Å; F111-F204 AromaticContact CE1-CE2 3.79Å; F111-F204 HydrophobicContact CE1-CE2 3.79Å; F111-F204 AromaticContact CE1-CZ 3.77Å; F111-F204 HydrophobicContact CE1-CZ 3.77Å; F111-F204 HydrophobicContact CZ-CD1 4.2Å; F111-F204 HydrophobicContact CZ-CD2 4.29Å; F111-F204 AromaticContact CZ-CE1 3.7Å; F111-F204 HydrophobicContact CZ-CE1 3.7Å; F111-F204 AromaticContact CZ-CE2 3.8Å; F111-F204 HydrophobicContact CZ-CE2 3.8Å; F111-F204 HydrophobicContact CZ-CG 4.48Å; F111-F204 AromaticContact CZ-CZ 3.51Å; F111-F204 HydrophobicContact CZ-CZ 3.51Å; F111-F206 HydrophobicContact CD2-CE2 4.43Å; F111-F206 HydrophobicContact CD2-CZ 4.26Å; F111-F206 HydrophobicContact CE2-CE2 4.18Å; F111-F206 AromaticContact CE2-CZ 3.58Å; F111-F206 HydrophobicContact CE2-CZ 3.58Å; F111-F206 HydrophobicContact CZ-CZ 4.21Å; F111-F249 AromaticContact CE1-CE1 3.83Å; F111-F249 HydrophobicContact CE1-CE1 3.83Å; F111-F249 HydrophobicContact CE1-CZ 4.22Å; F111-F249 HydrophobicContact CZ-CE1 4.25Å
112	S	43.8	Very low	50.7	Low	88 Å²	88	76.1 Å²	76.1	62%	0.615	45%	0.446	S	S	*	.	S	Bend	trans	-66	112.1	163.3	50.2	0	0	0	0	108	G110	G110-S112 PolarHBondContact O-N 2.84Å
113	F	40.4	Very low	48.9	Very low	92 Å²	92	79.4 Å²	79.4	40%	0.404	47%	0.47	S	S	.	.			trans	-37.1	130.7	167	-76.8	-93.2	0	0	0	109.4	F111 V115 F252	F111-F113 PolarHBondContact O-N 3.45Å; F113-V115 PolarHBondContact O-N 2.72Å; F113-F252 AromaticContact CD2-CE1 3.67Å; F113-F252 HydrophobicContact CD2-CE1 3.67Å; F113-F252 HydrophobicContact CD2-CZ 4.1Å; F113-F252 HydrophobicContact CE1-CE1 4.21Å; F113-F252 HydrophobicContact CE2-CD1 4.32Å; F113-F252 AromaticContact CE2-CE1 3.16Å; F113-F252 HydrophobicContact CE2-CE1 3.16Å; F113-F252 HydrophobicContact CE2-CE2 4.32Å; F113-F252 AromaticContact CE2-CZ 3.17Å; F113-F252 HydrophobicContact CE2-CZ 3.17Å; F113-F252 HydrophobicContact CG-CE1 4.41Å; F113-F252 AromaticContact CZ-CE1 3.47Å; F113-F252 HydrophobicContact CZ-CE1 3.47Å; F113-F252 VanDerWaalsContact CZ-CE1 3.47Å; F113-F252 AromaticContact CZ-CZ 3.43Å; F113-F252 HydrophobicContact CZ-CZ 3.43Å; F113-F252 VanDerWaalsContact CZ-CZ 3.43Å
114	P	33.8	Very low	47.2	Very low	66 Å²	66	87.3 Å²	87.3	43%	0.429	51%	0.506	S	S	.	.			trans	-58.3	103.3	-170.3	21.1	-30.9	0	0	0	109.2	S116	P114-S116 PolarHBondContact O-N 2.7Å
115	V	33.4	Very low	45.4	Very low	148 Å²	148	88.8 Å²	88.8	90%	0.897	51%	0.509	S	S	*	.	S	Bend	trans	-70.5	-9.3	166.5	-174.1	0	0	0	0	109.4	F113	F113-V115 PolarHBondContact O-N 2.72Å
116	S	33.7	Very low	43.9	Very low	37 Å²	37	93.5 Å²	93.5	26%	0.259	54%	0.535	S	S	.	.			trans	-127.3	117.9	178.1	55.2	0	0	0	0	111.1	P114 E118 S119	P114-S116 PolarHBondContact O-N 2.7Å; S116-E118 PolarHBondContact O-N 2.6Å; S116-S119 PolarHBondContact O-N 3.32Å; S116-S119 PolarHBondContact OG-OG 2.8Å
117	K	36.1	Very low	42.6	Very low	191 Å²	191	95.2 Å²	95.2	83%	0.83	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-5.5	158.9	-79.4	179	170.8	178.8	0	113.5
118	E	38.7	Very low	41.7	Very low	174 Å²	174	92 Å²	92	81%	0.813	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-21.5	-172.9	-65.7	155.6	163.8	0	0	113.4	S116	S116-E118 PolarHBondContact O-N 2.6Å
119	S	37	Very low	41.3	Very low	101 Å²	101	89.8 Å²	89.8	71%	0.706	50%	0.503	S	S	*	.	S	Bend	trans	-83.6	-19.6	-178.2	-62.1	0	0	0	0	113.3	S116	S116-S119 PolarHBondContact O-N 3.32Å; S116-S119 PolarHBondContact OG-OG 2.8Å
120	V	35.5	Very low	41.6	Very low	25 Å²	25	86.3 Å²	86.3	15%	0.152	49%	0.489	C	S	.	.	S	Bend	trans	-102.8	101.6	171.6	-148.6	0	0	0	0	106	D122 M125 T127	V120-D122 PolarHBondContact O-N 3.2Å; V120-M125 HydrophobicContact CG1-CB 3.88Å; V120-M125 HydrophobicContact CG1-CE 3.46Å; V120-M125 VanDerWaalsContact CG1-CE 3.46Å; V120-M125 HydrophobicContact CG1-CG 4.31Å; V120-T127 HydrophobicContact CG1-CG2 4.46Å
121	G	37	Very low	42.5	Very low	88 Å²	88	88.3 Å²	88.3	91%	0.907	49%	0.493	S	S	*	.	S	Bend	trans	-60.2	-5.4	-176.2	0	0	0	0	0	114.9
122	D	40.9	Very low	43.8	Very low	82 Å²	82	86.9 Å²	86.9	44%	0.439	49%	0.487	S	S	.	.	S	Bend	trans	-121.9	112	172.3	-166.3	-18.6	0	0	0	109.5	V120 E124 M125	V120-D122 PolarHBondContact O-N 3.2Å; D122-E124 PolarHBondContact O-N 3.48Å; D122-E124 VanDerWaalsContact O-N 3.14Å; D122-E124 PolarHBondContact OD1-N 3.21Å; D122-M125 HydrophobicContact CB-CB 4.14Å; D122-M125 PolarHBondContact O-N 3.33Å
123	P	39	Very low	45.3	Very low	115 Å²	115	84.5 Å²	84.5	75%	0.747	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.7	178.6	25.5	-32.3	0	0	0	113.4
124	E	40.6	Very low	47.2	Very low	171 Å²	171	81.3 Å²	81.3	80%	0.799	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.6	174.6	-60.3	-167.4	159.9	0	0	113.1	D122 N126	D122-E124 PolarHBondContact O-N 3.48Å; D122-E124 VanDerWaalsContact O-N 3.14Å; D122-E124 PolarHBondContact OD1-N 3.21Å; E124-N126 PolarHBondContact O-N 2.97Å; E124-N126 VanDerWaalsContact O-N 3.16Å
125	M	37.2	Very low	49.2	Very low	110 Å²	110	80.3 Å²	80.3	54%	0.542	45%	0.45	S	S	.	.			trans	-83.7	96.3	-176.8	-167.4	168.8	83.4	0	0	111.6	V120 D122 T127	V120-M125 HydrophobicContact CG1-CB 3.88Å; V120-M125 HydrophobicContact CG1-CE 3.46Å; V120-M125 VanDerWaalsContact CG1-CE 3.46Å; V120-M125 HydrophobicContact CG1-CG 4.31Å; D122-M125 HydrophobicContact CB-CB 4.14Å; D122-M125 PolarHBondContact O-N 3.33Å; M125-T127 HydrophobicContact CE-CG2 4.23Å; M125-T127 PolarHBondContact O-N 3.42Å; M125-T127 VanDerWaalsContact O-N 3.08Å
126	N	40.6	Very low	51.1	Low	137 Å²	137	78.4 Å²	78.4	73%	0.733	43%	0.434	S	S	*	.			trans	-71.7	97	169.6	-76.8	-27	0	0	0	110.4	E124 Q128	E124-N126 PolarHBondContact O-N 2.97Å; E124-N126 VanDerWaalsContact O-N 3.16Å; N126-Q128 PolarHBondContact O-N 3.25Å
127	T	41.7	Very low	53	Low	44 Å²	44	81.8 Å²	81.8	27%	0.27	44%	0.442	S	S	.	.			trans	-67.3	114.5	166.3	42.6	0	0	0	0	109.5	V120 M125 Y129	V120-T127 HydrophobicContact CG1-CG2 4.46Å; M125-T127 HydrophobicContact CE-CG2 4.23Å; M125-T127 PolarHBondContact O-N 3.42Å; M125-T127 VanDerWaalsContact O-N 3.08Å; T127-Y129 WeakPolarHBondContact O-CD2 3.16Å; T127-Y129 PolarHBondContact O-N 2.91Å; T127-Y129 WeakPolarHBondContact OG1-CE2 3.18Å
128	Q	48	Very low	54.6	Low	41 Å²	41	76.9 Å²	76.9	19%	0.192	42%	0.418	C	S	.	.			trans	-77	108.2	177.3	-62.3	176.1	11.9	0	0	109.5	N126 D133 F220	N126-Q128 PolarHBondContact O-N 3.25Å; Q128-D133 HydrophobicContact CG-CB 4.28Å; Q128-D133 PolarHBondContact NE2-O 3.44Å; Q128-F220 HydrophobicContact CB-CE1 4.17Å
129	Y	55	Low	56.3	Low	42 Å²	42	73.6 Å²	73.6	17%	0.165	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.5	171.1	-67.5	-75.5	0	0	0	109.3	K109 G110 T127 K131	K109-Y129 HydrophobicContact CB-CE1 4.08Å; K109-Y129 PolarHBondContact O-OH 3.44Å; G110-Y129 WeakPolarHBondContact O-CE1 3.44Å; T127-Y129 WeakPolarHBondContact O-CD2 3.16Å; T127-Y129 PolarHBondContact O-N 2.91Å; T127-Y129 WeakPolarHBondContact OG1-CE2 3.18Å; Y129-K131 PolarHBondContact O-N 3.29Å
130	L	62.1	Low	57.8	Low	16 Å²	16	76.6 Å²	76.6	8%	0.084	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.2	-45	172.2	-66.3	172.3	0	0	0	116	F111 Y175 F204 F206 V219 F220	F111-L130 HydrophobicContact CE2-CD1 3.85Å; F111-L130 HydrophobicContact CE2-CD2 3.55Å; F111-L130 HydrophobicContact CE2-CG 3.78Å; F111-L130 HydrophobicContact CZ-CD1 3.84Å; F111-L130 HydrophobicContact CZ-CD2 4.04Å; F111-L130 HydrophobicContact CZ-CG 4.27Å; L130-Y175 HydrophobicContact CB-CE1 4.33Å; L130-Y175 WeakPolarHBondContact O-CE2 3.29Å; L130-F204 HydrophobicContact CD2-CD1 4.47Å; L130-F206 HydrophobicContact CD2-CD1 4.36Å; L130-F206 HydrophobicContact CD2-CE1 3.23Å; L130-F206 HydrophobicContact CD2-CZ 3.46Å; L130-F206 VanDerWaalsContact CD2-CZ 3.46Å; L130-V219 WeakPolarHBondContact CA-O 3.42Å; L130-V219 PolarHBondContact N-O 3.13Å; L130-V219 VanDerWaalsContact N-O 3.12Å; L130-F220 WeakPolarHBondContact O-CA 3.35Å
131	K	68.8	Low	59.7	Low	55 Å²	55	78.5 Å²	78.5	24%	0.239	42%	0.421	C	S	.	.	S	Bend	trans	-99.8	121.6	-178.5	173.9	-172.4	174.3	-158.9	0	109.8	Y129 D133 Y175 N176	Y129-K131 PolarHBondContact O-N 3.29Å; K131-D133 IonicContact NZ-OD2 2.97Å; K131-D133 PolarHBondContact NZ-OD2 3.12Å; K131-Y175 HydrophobicContact CB-CD1 4.01Å; K131-Y175 HydrophobicContact CB-CD2 4Å; K131-Y175 HydrophobicContact CB-CG 3.73Å; K131-Y175 HydrophobicContact CG-CD2 4.32Å; K131-Y175 HydrophobicContact CG-CG 3.92Å; K131-N176 WeakPolarHBondContact CE-OD1 3.41Å; K131-N176 PolarHBondContact NZ-OD1 3.23Å
132	P	76.6	Confident	61.6	Low	1 Å²	1	78 Å²	78	1%	0.006	40%	0.398	C	S	.	.			trans	-65	133.6	162.2	-7.7	21.2	0	0	0	109.8	L168 M171 E172 F220	P132-L168 HydrophobicContact CB-CD2 3.98Å; P132-L168 HydrophobicContact CG-CD2 3.89Å; P132-M171 HydrophobicContact CG-CB 3.73Å; P132-E172 HydrophobicContact CB-CB 4.17Å; P132-E172 HydrophobicContact CG-CB 4.35Å; P132-E172 WeakPolarHBondContact O-CB 3.41Å; P132-E172 WeakPolarHBondContact O-CG 3.29Å; P132-F220 VanDerWaalsContact CA-CE1 3.46Å; P132-F220 HydrophobicContact CB-CD1 4.06Å; P132-F220 HydrophobicContact CB-CE1 4Å; P132-F220 HydrophobicContact CB-CG 4.37Å; P132-F220 HydrophobicContact CB-CZ 4.26Å; P132-F220 HydrophobicContact CG-CB 4.01Å; P132-F220 HydrophobicContact CG-CD1 3.66Å; P132-F220 HydrophobicContact CG-CD2 4.28Å; P132-F220 HydrophobicContact CG-CE1 4.14Å; P132-F220 HydrophobicContact CG-CG 3.72Å; P132-F220 VanDerWaalsContact N-CD1 3.29Å
133	D	76	Confident	63.4	Low	38 Å²	38	75.3 Å²	75.3	20%	0.203	38%	0.382	C	S	.	.			trans	-130.6	103.8	177.2	-164	-36.8	0	0	0	110.3	Q128 K131 S135	Q128-D133 HydrophobicContact CG-CB 4.28Å; Q128-D133 PolarHBondContact NE2-O 3.44Å; K131-D133 IonicContact NZ-OD2 2.97Å; K131-D133 PolarHBondContact NZ-OD2 3.12Å; D133-S135 WeakPolarHBondContact OD1-CB 3.31Å; D133-S135 PolarHBondContact OD1-N 3.37Å; D133-S135 PolarHBondContact OD1-OG 2.67Å
134	T	79.4	Confident	65.3	Low	25 Å²	25	73.5 Å²	73.5	15%	0.153	37%	0.366	C	S	.	.			trans	-91.5	-1.9	-178.8	56.1	0	0	0	0	112.8	I136 Y137 Y138 E172 I211	T134-I136 PolarHBondContact O-N 2.9Å; T134-I136 VanDerWaalsContact O-N 3.13Å; T134-Y137 WeakPolarHBondContact O-CD2 3.3Å; T134-Y137 PolarHBondContact O-N 3.42Å; T134-Y138 WeakPolarHBondContact O-CD2 3.46Å; T134-E172 WeakPolarHBondContact CG2-OE2 3.25Å; T134-E172 PolarHBondContact N-OE1 3.35Å; T134-E172 PolarHBondContact OG1-OE1 3.41Å; T134-E172 PolarHBondContact OG1-OE2 3.44Å; T134-I211 HydrophobicContact CG2-CG2 4.27Å
135	S	76.1	Confident	67.4	Low	45 Å²	45	70.9 Å²	70.9	32%	0.315	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-61	-28.2	-174.1	69.4	0	0	0	0	113.7	D133 Y137 Y138	D133-S135 WeakPolarHBondContact OD1-CB 3.31Å; D133-S135 PolarHBondContact OD1-N 3.37Å; D133-S135 PolarHBondContact OD1-OG 2.67Å; S135-Y137 PolarHBondContact O-N 2.99Å; S135-Y138 PolarHBondContact O-N 2.8Å; S135-Y138 VanDerWaalsContact O-O 3.05Å
136	I	73.1	Confident	69.7	Low	108 Å²	108	68.6 Å²	68.6	55%	0.554	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-64.8	-18.4	177.1	62.1	173.6	0	0	0	113.7	T134	T134-I136 PolarHBondContact O-N 2.9Å; T134-I136 VanDerWaalsContact O-N 3.13Å
137	Y	73.5	Confident	71.8	Confident	109 Å²	109	62.1 Å²	62.1	43%	0.427	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-98.2	-4.9	-178.4	-55.9	-71.7	0	0	0	113.5	T134 S135 I211	T134-Y137 WeakPolarHBondContact O-CD2 3.3Å; T134-Y137 PolarHBondContact O-N 3.42Å; S135-Y137 PolarHBondContact O-N 2.99Å; Y137-I211 HydrophobicContact CD2-CG2 3.98Å; Y137-I211 HydrophobicContact CE2-CB 4.19Å; Y137-I211 HydrophobicContact CE2-CD1 3.93Å; Y137-I211 HydrophobicContact CE2-CG2 3.47Å; Y137-I211 VanDerWaalsContact CE2-CG2 3.47Å
138	Y	69.9	Low	74	Confident	87 Å²	87	63.4 Å²	63.4	34%	0.341	32%	0.315	S	S	.	.	S	Bend	trans	-127.7	153.2	-173.5	-62.8	-70.3	0	0	0	111.3	T134 S135 Y143 Q146	T134-Y138 WeakPolarHBondContact O-CD2 3.46Å; S135-Y138 PolarHBondContact O-N 2.8Å; S135-Y138 VanDerWaalsContact O-O 3.05Å; Y138-Y143 HydrophobicContact CD2-CD2 4.08Å; Y138-Q146 PolarHBondContact OH-OE1 3.2Å
139	N	74.3	Confident	76	Confident	105 Å²	105	66.9 Å²	66.9	56%	0.561	33%	0.331	S	S	*	.			trans	-67	150.3	161.8	-173.1	11.1	0	0	0	109.3	S141 D142 Y143	N139-S141 VanDerWaalsContact C-N 3.26Å; N139-S141 PolarHBondContact ND2-OG 2.97Å; N139-S141 PolarHBondContact O-N 3.42Å; N139-D142 PolarHBondContact O-N 3.09Å; N139-Y143 PolarHBondContact O-N 3.41Å
140	K	69.5	Low	77.7	Confident	165 Å²	165	66.3 Å²	66.3	72%	0.717	33%	0.331	S	S	*	.	H	α-helix	trans	-56.3	-37.7	-175.4	-168.8	175.2	-175	174.4	0	113.1	N144	K140-N144 WeakPolarHBondContact O-CB 3.27Å; K140-N144 PolarHBondContact O-N 3.34Å; K140-N144 VanDerWaalsContact O-N 3.17Å; K140-N144 PolarHBondContact O-ND2 2.55Å
141	S	75.4	Confident	79	Confident	64 Å²	64	66.4 Å²	66.4	45%	0.448	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-48	175.3	50.8	0	0	0	0	111.7	N139 N144 E145	N139-S141 VanDerWaalsContact C-N 3.26Å; N139-S141 PolarHBondContact ND2-OG 2.97Å; N139-S141 PolarHBondContact O-N 3.42Å; S141-N144 PolarHBondContact O-N 3.28Å; S141-E145 PolarHBondContact O-N 2.9Å
142	D	77	Confident	79.9	Confident	79 Å²	79	71 Å²	71	42%	0.422	35%	0.351	S	S	.	.	H	α-helix	trans	-71.7	-39.6	-172.7	-54.3	-4.8	0	0	0	109.9	N139 E145 Q146	N139-D142 PolarHBondContact O-N 3.09Å; D142-E145 PolarHBondContact O-N 3.06Å; D142-Q146 WeakPolarHBondContact O-CG 3.32Å; D142-Q146 PolarHBondContact O-N 3.12Å
143	Y	76.9	Confident	80.5	Confident	24 Å²	24	76.9 Å²	76.9	9%	0.094	38%	0.376	C	S	.	.	H	α-helix	trans	-57.9	-50.5	171.9	-179.4	-106.4	0	0	0	111.8	Y138 N139 E145 Q146 M147 E172 N176	Y138-Y143 HydrophobicContact CD2-CD2 4.08Å; N139-Y143 PolarHBondContact O-N 3.41Å; Y143-E145 VanDerWaalsContact C-N 3.3Å; Y143-E145 PolarHBondContact O-N 3.08Å; Y143-Q146 PolarHBondContact O-N 3.17Å; Y143-M147 HydrophobicContact CD1-CG 4.22Å; Y143-M147 HydrophobicContact CD2-CE 4.34Å; Y143-M147 HydrophobicContact CD2-CG 4.4Å; Y143-M147 HydrophobicContact CE1-CG 3.8Å; Y143-M147 HydrophobicContact CE2-CE 3.81Å; Y143-M147 HydrophobicContact CE2-CG 4.01Å; Y143-M147 HydrophobicContact CE2-SD 4.2Å; Y143-M147 WeakPolarHBondContact O-CG 3.38Å; Y143-M147 PolarHBondContact O-N 3.46Å; Y143-E172 WeakPolarHBondContact CE2-OE1 3.3Å; Y143-E172 PolarHBondContact OH-OE1 2.8Å; Y143-N176 PolarHBondContact OH-ND2 2.69Å; Y143-N176 VanDerWaalsContact OH-ND2 3.08Å
144	N	79.4	Confident	81.2	Confident	78 Å²	78	75.5 Å²	75.5	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-38.4	179.8	-73	-19.4	0	0	0	111.9	K140 S141 T148	K140-N144 WeakPolarHBondContact O-CB 3.27Å; K140-N144 PolarHBondContact O-N 3.34Å; K140-N144 VanDerWaalsContact O-N 3.17Å; K140-N144 PolarHBondContact O-ND2 2.55Å; S141-N144 PolarHBondContact O-N 3.28Å; N144-T148 WeakPolarHBondContact O-CB 3.33Å; N144-T148 PolarHBondContact O-N 3.37Å; N144-T148 PolarHBondContact O-OG1 3.13Å
145	E	84.3	Confident	81.2	Confident	116 Å²	116	79 Å²	79	54%	0.542	38%	0.383	S	S	.	.	H	α-helix	trans	-63.6	-46.4	175.2	-170.6	176.3	174.6	0	0	111.2	S141 D142 Y143 T148 Q149	S141-E145 PolarHBondContact O-N 2.9Å; D142-E145 PolarHBondContact O-N 3.06Å; Y143-E145 VanDerWaalsContact C-N 3.3Å; Y143-E145 PolarHBondContact O-N 3.08Å; E145-T148 WeakPolarHBondContact O-CB 3.49Å; E145-T148 PolarHBondContact O-N 3.13Å; E145-Q149 WeakPolarHBondContact O-CG 3.44Å; E145-Q149 PolarHBondContact O-N 3.34Å; E145-Q149 PolarHBondContact OE1-NE2 2.98Å
146	Q	86.4	Confident	81.3	Confident	62 Å²	62	82.4 Å²	82.4	29%	0.29	40%	0.402	S	S	.	.	H	α-helix	trans	-59.8	-48.2	175.4	-76.4	-172	-6.3	0	0	112.4	Y138 D142 Y143 T148 Q149 L150	Y138-Q146 PolarHBondContact OH-OE1 3.2Å; D142-Q146 WeakPolarHBondContact O-CG 3.32Å; D142-Q146 PolarHBondContact O-N 3.12Å; Y143-Q146 PolarHBondContact O-N 3.17Å; Q146-T148 VanDerWaalsContact C-N 3.26Å; Q146-T148 PolarHBondContact O-N 3.46Å; Q146-Q149 PolarHBondContact O-N 3.26Å; Q146-Q149 VanDerWaalsContact O-N 3.11Å; Q146-L150 WeakPolarHBondContact O-CG 3.42Å; Q146-L150 PolarHBondContact O-N 2.96Å
147	M	85.3	Confident	81.8	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.005	40%	0.395	C	S	.	.	H	α-helix	trans	-59.2	-40	177.1	-70.2	-57.9	109.4	0	0	111.4	Y143 L150 M151 E172 L173 Y177	Y143-M147 HydrophobicContact CD1-CG 4.22Å; Y143-M147 HydrophobicContact CD2-CE 4.34Å; Y143-M147 HydrophobicContact CD2-CG 4.4Å; Y143-M147 HydrophobicContact CE1-CG 3.8Å; Y143-M147 HydrophobicContact CE2-CE 3.81Å; Y143-M147 HydrophobicContact CE2-CG 4.01Å; Y143-M147 HydrophobicContact CE2-SD 4.2Å; Y143-M147 WeakPolarHBondContact O-CG 3.38Å; Y143-M147 PolarHBondContact O-N 3.46Å; M147-L150 HydrophobicContact CE-CD1 3.78Å; M147-L150 PolarHBondContact O-N 3.06Å; M147-M151 WeakPolarHBondContact O-CB 3.42Å; M147-M151 VanDerWaalsContact O-CG 3.31Å; M147-M151 WeakPolarHBondContact O-CG 3.16Å; M147-M151 PolarHBondContact O-N 3.45Å; M147-E172 HydrophobicContact SD-CG 4.29Å; M147-L173 HydrophobicContact SD-CD2 3.89Å; M147-Y177 HydrophobicContact CB-CE2 4.33Å
148	T	87.2	Confident	82.3	Confident	71 Å²	71	83.4 Å²	83.4	44%	0.436	41%	0.411	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.8	-57.1	0	0	0	0	111.9	N144 E145 Q146 K152	N144-T148 WeakPolarHBondContact O-CB 3.33Å; N144-T148 PolarHBondContact O-N 3.37Å; N144-T148 PolarHBondContact O-OG1 3.13Å; E145-T148 WeakPolarHBondContact O-CB 3.49Å; E145-T148 PolarHBondContact O-N 3.13Å; Q146-T148 VanDerWaalsContact C-N 3.26Å; Q146-T148 PolarHBondContact O-N 3.46Å; T148-K152 WeakPolarHBondContact O-CG 3.24Å; T148-K152 PolarHBondContact O-N 2.93Å
149	Q	90.4	Very high	83.4	Confident	113 Å²	113	86.1 Å²	86.1	53%	0.528	42%	0.424	S	S	.	.	H	α-helix	trans	-66.8	-43.1	177	-71.4	178.1	11.9	0	0	111.7	E145 Q146 K152 K153	E145-Q149 WeakPolarHBondContact O-CG 3.44Å; E145-Q149 PolarHBondContact O-N 3.34Å; E145-Q149 PolarHBondContact OE1-NE2 2.98Å; Q146-Q149 PolarHBondContact O-N 3.26Å; Q146-Q149 VanDerWaalsContact O-N 3.11Å; Q149-K152 PolarHBondContact O-N 2.98Å; Q149-K153 PolarHBondContact O-N 3.23Å
150	L	90.4	Very high	84.2	Confident	31 Å²	31	81.5 Å²	81.5	16%	0.162	40%	0.4	C	S	.	.	H	α-helix	trans	-65.9	-40.3	176.3	-71.4	177.1	0	0	0	111.9	Q146 M147 K152 K153 Y154 E169 L173	Q146-L150 WeakPolarHBondContact O-CG 3.42Å; Q146-L150 PolarHBondContact O-N 2.96Å; M147-L150 HydrophobicContact CE-CD1 3.78Å; M147-L150 PolarHBondContact O-N 3.06Å; L150-K152 VanDerWaalsContact C-N 3.34Å; L150-K152 PolarHBondContact O-N 2.84Å; L150-K153 VanDerWaalsContact O-CB 3.31Å; L150-K153 WeakPolarHBondContact O-CB 3.46Å; L150-K153 PolarHBondContact O-N 2.98Å; L150-Y154 HydrophobicContact CD2-CE2 4.3Å; L150-Y154 VanDerWaalsContact O-CD2 3.28Å; L150-Y154 WeakPolarHBondContact O-CD2 3.21Å; L150-Y154 PolarHBondContact O-N 3.23Å; L150-E169 HydrophobicContact CD1-CB 4.24Å; L150-E169 HydrophobicContact CD1-CG 4.27Å; L150-E169 HydrophobicContact CD2-CB 4.35Å; L150-E169 HydrophobicContact CD2-CG 4.19Å; L150-L173 HydrophobicContact CB-CD1 3.87Å; L150-L173 HydrophobicContact CB-CD2 4.15Å; L150-L173 HydrophobicContact CB-CG 4.41Å
151	M	88.5	Confident	85.4	Confident	18 Å²	18	79.8 Å²	79.8	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-57.7	-46.2	174.4	-81.6	-58.7	-67.8	0	0	111.6	M147 K153 Y154 E155 L173 Y177 F181	M147-M151 WeakPolarHBondContact O-CB 3.42Å; M147-M151 VanDerWaalsContact O-CG 3.31Å; M147-M151 WeakPolarHBondContact O-CG 3.16Å; M147-M151 PolarHBondContact O-N 3.45Å; M151-K153 PolarHBondContact O-N 3.12Å; M151-K153 VanDerWaalsContact O-N 3.1Å; M151-Y154 PolarHBondContact O-N 2.78Å; M151-Y154 VanDerWaalsContact O-N 3.15Å; M151-E155 HydrophobicContact CE-CB 4.25Å; M151-E155 HydrophobicContact CE-CG 4.37Å; M151-E155 WeakPolarHBondContact O-CB 3.15Å; M151-E155 PolarHBondContact O-N 3.22Å; M151-L173 HydrophobicContact CG-CD2 3.86Å; M151-L173 HydrophobicContact SD-CB 4.27Å; M151-L173 HydrophobicContact SD-CD1 4.23Å; M151-L173 HydrophobicContact SD-CD2 3.81Å; M151-L173 HydrophobicContact SD-CG 4.32Å; M151-Y177 HydrophobicContact CE-CD2 4.42Å; M151-Y177 HydrophobicContact CE-CG 4.32Å; M151-Y177 HydrophobicContact CG-CD2 3.88Å; M151-Y177 HydrophobicContact CG-CE2 3.94Å; M151-Y177 HydrophobicContact SD-CD2 3.54Å; M151-Y177 VanDerWaalsContact SD-CD2 3.54Å; M151-Y177 HydrophobicContact SD-CE2 4.21Å; M151-Y177 HydrophobicContact SD-CG 4.01Å; M151-F181 HydrophobicContact CE-CE2 4.36Å; M151-F181 HydrophobicContact SD-CE2 3.92Å; M151-F181 HydrophobicContact SD-CZ 4.29Å
152	K	88.2	Confident	86.3	Confident	152 Å²	152	76.8 Å²	76.8	66%	0.661	37%	0.373	S	S	*	.	H	α-helix	trans	-57	-29.4	175.9	-73.7	172.8	-179.4	174.9	0	113.4	T148 Q149 L150	T148-K152 WeakPolarHBondContact O-CG 3.24Å; T148-K152 PolarHBondContact O-N 2.93Å; Q149-K152 PolarHBondContact O-N 2.98Å; L150-K152 VanDerWaalsContact C-N 3.34Å; L150-K152 PolarHBondContact O-N 2.84Å
153	K	89.4	Confident	87	Confident	124 Å²	124	75.5 Å²	75.5	54%	0.539	37%	0.368	S	S	.	.	H	α-helix	trans	-75	-36.5	-179.9	-172	-179.9	174	-166.1	0	112.8	Q149 L150 M151 E169	Q149-K153 PolarHBondContact O-N 3.23Å; L150-K153 VanDerWaalsContact O-CB 3.31Å; L150-K153 WeakPolarHBondContact O-CB 3.46Å; L150-K153 PolarHBondContact O-N 2.98Å; M151-K153 PolarHBondContact O-N 3.12Å; M151-K153 VanDerWaalsContact O-N 3.1Å; K153-E169 IonicContact NZ-OE2 3.65Å
154	Y	90.9	Very high	87.4	Confident	8 Å²	8	79.7 Å²	79.7	3%	0.031	39%	0.392	C	S	.	.	H	α-helix	trans	-115.5	-11.1	-170.3	-55.1	-64.5	0	0	0	114.7	L150 M151 T156 L160 N166 E169 V170 L173 K184	L150-Y154 HydrophobicContact CD2-CE2 4.3Å; L150-Y154 VanDerWaalsContact O-CD2 3.28Å; L150-Y154 WeakPolarHBondContact O-CD2 3.21Å; L150-Y154 PolarHBondContact O-N 3.23Å; M151-Y154 PolarHBondContact O-N 2.78Å; M151-Y154 VanDerWaalsContact O-N 3.15Å; Y154-T156 VanDerWaalsContact C-N 3.34Å; Y154-T156 PolarHBondContact O-N 3.21Å; Y154-L160 HydrophobicContact CD1-CD1 3.57Å; Y154-L160 HydrophobicContact CE1-CD1 4.27Å; Y154-L160 HydrophobicContact CG-CD1 4.34Å; Y154-N166 HydrophobicContact CE1-CB 4.4Å; Y154-N166 VanDerWaalsContact OH-CB 3.22Å; Y154-N166 WeakPolarHBondContact OH-CB 3.4Å; Y154-E169 HydrophobicContact CE2-CB 4.39Å; Y154-E169 PolarHBondContact OH-OE2 3.31Å; Y154-V170 HydrophobicContact CD1-CG2 4.15Å; Y154-V170 HydrophobicContact CD2-CG2 4.05Å; Y154-V170 HydrophobicContact CE1-CG2 3.99Å; Y154-V170 HydrophobicContact CE2-CG2 3.87Å; Y154-V170 HydrophobicContact CG-CG2 4.16Å; Y154-L173 HydrophobicContact CD2-CD1 3.57Å; Y154-L173 HydrophobicContact CE2-CD1 4.25Å; Y154-K184 PolarHBondContact O-NZ 3.32Å
155	E	79.3	Confident	87.7	Confident	98 Å²	98	84.8 Å²	84.8	46%	0.458	41%	0.414	S	S	.	.	S	Bend	trans	-69.4	-26.5	-175.9	-179.2	174.5	-142.8	0	0	113.5	M151 K184	M151-E155 HydrophobicContact CE-CB 4.25Å; M151-E155 HydrophobicContact CE-CG 4.37Å; M151-E155 WeakPolarHBondContact O-CB 3.15Å; M151-E155 PolarHBondContact O-N 3.22Å; E155-K184 WeakPolarHBondContact O-CE 3.49Å; E155-K184 PolarHBondContact O-NZ 3.44Å
156	T	79.3	Confident	88	Confident	118 Å²	118	80.1 Å²	80.1	72%	0.724	39%	0.392	S	S	*	.	S	Bend	trans	-85.9	-27.7	-174.8	-50.5	0	0	0	0	113.2	Y154 Q158	Y154-T156 VanDerWaalsContact C-N 3.34Å; Y154-T156 PolarHBondContact O-N 3.21Å; T156-Q158 PolarHBondContact O-N 3.36Å
157	D	81.8	Confident	88.2	Confident	76 Å²	76	77.5 Å²	77.5	41%	0.406	38%	0.38	S	S	.	.			trans	-77.2	117.2	-170.6	-63.7	-31.4	0	0	0	112	K159 K184	D157-K159 PolarHBondContact O-N 2.98Å; D157-K184 WeakPolarHBondContact O-CD 3.5Å; D157-K184 WeakPolarHBondContact O-CE 3.26Å; D157-K184 PolarHBondContact O-NZ 2.99Å
158	Q	85.1	Confident	88.4	Confident	161 Å²	161	79.4 Å²	79.4	75%	0.752	39%	0.39	S	S	*	.	S	Bend	trans	-69.9	-24.1	175.7	-70.2	-167.8	-11.2	0	0	112.9	T156 T185	T156-Q158 PolarHBondContact O-N 3.36Å; Q158-T185 PolarHBondContact O-N 3.27Å
159	K	91.8	Very high	88.5	Confident	145 Å²	145	79.2 Å²	79.2	63%	0.63	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	118	173.5	-67.6	-162.2	162.3	-153.5	0	108.7	D157 T185 E241	D157-K159 PolarHBondContact O-N 2.98Å; K159-T185 CarbonylContact C-O 3.58Å; K159-T185 VanDerWaalsContact CA-O 3.27Å; K159-T185 WeakPolarHBondContact CA-O 3.3Å; K159-E241 IonicContact NZ-OE1 3.05Å; K159-E241 PolarHBondContact NZ-OE1 3.1Å
160	L	92.5	Very high	88.6	Confident	8 Å²	8	73.9 Å²	73.9	4%	0.042	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	115.7	-176.1	176.6	65.8	0	0	0	110.4	Y154 I162 V170 F181 T185 I186 S187	Y154-L160 HydrophobicContact CD1-CD1 3.57Å; Y154-L160 HydrophobicContact CE1-CD1 4.27Å; Y154-L160 HydrophobicContact CG-CD1 4.34Å; L160-I162 HydrophobicContact CG-CG1 4.44Å; L160-V170 HydrophobicContact CD2-CG1 3.57Å; L160-V170 HydrophobicContact CD2-CG2 4.26Å; L160-F181 HydrophobicContact CD2-CD1 4.33Å; L160-F181 HydrophobicContact CD2-CE1 3.88Å; L160-T185 PolarHBondContact N-O 2.64Å; L160-I186 HydrophobicContact CB-CG2 4.2Å; L160-I186 VanDerWaalsContact O-CA 3.22Å; L160-I186 WeakPolarHBondContact O-CA 3.33Å; L160-S187 PolarHBondContact O-N 3Å
161	E	94.3	Very high	88.6	Confident	128 Å²	128	72.4 Å²	72.4	60%	0.598	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.1	172.6	-173.6	176.2	-171.2	0	0	109.8	T163 N166	E161-T163 HydrophobicContact CG-CG2 4.07Å; E161-N166 PolarHBondContact O-ND2 3.38Å; E161-N166 VanDerWaalsContact O-ND2 3.09Å
162	I	94.4	Very high	88.6	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	99.6	177.9	-41.8	-178	0	0	0	108.1	L160 Y167 V170 M171 I174 I186 S187 F188	L160-I162 HydrophobicContact CG-CG1 4.44Å; I162-Y167 HydrophobicContact CG2-CD2 3.63Å; I162-Y167 HydrophobicContact CG2-CE2 4.39Å; I162-Y167 HydrophobicContact CG2-CG 4.29Å; I162-V170 HydrophobicContact CD1-CB 4.49Å; I162-V170 HydrophobicContact CD1-CG1 3.63Å; I162-V170 HydrophobicContact CG1-CG1 3.94Å; I162-V170 HydrophobicContact CG2-CB 4.24Å; I162-V170 HydrophobicContact CG2-CG1 4.44Å; I162-M171 HydrophobicContact CD1-CE 3.56Å; I162-I174 HydrophobicContact CD1-CD1 4.19Å; I162-I186 HydrophobicContact CD1-CB 4.12Å; I162-I186 HydrophobicContact CD1-CD1 3.93Å; I162-I186 HydrophobicContact CD1-CG2 4.35Å; I162-I186 HydrophobicContact CG1-CB 4.45Å; I162-S187 PolarHBondContact N-O 2.9Å; I162-F188 HydrophobicContact CB-CB 3.71Å; I162-F188 HydrophobicContact CD1-CB 4.28Å; I162-F188 HydrophobicContact CG1-CB 4.28Å; I162-F188 HydrophobicContact CG2-CB 4.44Å
163	T	91.7	Very high	88.5	Confident	51 Å²	51	64.5 Å²	64.5	31%	0.313	32%	0.317	S	S	.	.			trans	-87.5	179.2	177.6	70.1	0	0	0	0	111.5	E161 E165 N166 Y167	E161-T163 HydrophobicContact CG-CG2 4.07Å; T163-E165 VanDerWaalsContact C-N 3.27Å; T163-E165 PolarHBondContact O-N 3.35Å; T163-E165 PolarHBondContact OG1-N 3.02Å; T163-N166 WeakPolarHBondContact CA-OD1 3.39Å; T163-N166 PolarHBondContact N-OD1 2.57Å; T163-N166 PolarHBondContact O-OD1 3.28Å; T163-N166 VanDerWaalsContact O-OD1 3.11Å; T163-N166 PolarHBondContact OG1-OD1 3.26Å; T163-Y167 WeakPolarHBondContact O-CB 3.38Å; T163-Y167 PolarHBondContact O-N 2.81Å; T163-Y167 VanDerWaalsContact O-N 3.15Å
164	D	84.9	Confident	88.4	Confident	112 Å²	112	59 Å²	59	60%	0.599	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-31.7	175.5	-62.6	-6.6	0	0	0	112.7	R207	D164-R207 VanDerWaalsContact CG-NH2 3.26Å; D164-R207 IonicContact OD1-CZ 2.68Å; D164-R207 IonicContact OD1-NH1 2.94Å; D164-R207 PolarHBondContact OD1-NH1 2.88Å; D164-R207 IonicContact OD1-NH2 2.71Å; D164-R207 PolarHBondContact OD1-NH2 2.86Å; D164-R207 IonicContact OD2-NH2 2.85Å
165	E	85.4	Confident	88	Confident	186 Å²	186	62.2 Å²	62.2	87%	0.869	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-33.7	-174.5	-63.3	-176.5	171.6	0	0	112.9	T163	T163-E165 VanDerWaalsContact C-N 3.27Å; T163-E165 PolarHBondContact O-N 3.35Å; T163-E165 PolarHBondContact OG1-N 3.02Å
166	N	90.7	Very high	88	Confident	17 Å²	17	59.8 Å²	59.8	9%	0.091	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	3.8	-178.1	66.9	-13.4	0	0	0	113.8	Y154 E161 T163 L168 E169 V170	Y154-N166 HydrophobicContact CE1-CB 4.4Å; Y154-N166 VanDerWaalsContact OH-CB 3.22Å; Y154-N166 WeakPolarHBondContact OH-CB 3.4Å; E161-N166 PolarHBondContact O-ND2 3.38Å; E161-N166 VanDerWaalsContact O-ND2 3.09Å; T163-N166 WeakPolarHBondContact CA-OD1 3.39Å; T163-N166 PolarHBondContact N-OD1 2.57Å; T163-N166 PolarHBondContact O-OD1 3.28Å; T163-N166 VanDerWaalsContact O-OD1 3.11Å; T163-N166 PolarHBondContact OG1-OD1 3.26Å; N166-L168 PolarHBondContact O-N 2.61Å; N166-E169 PolarHBondContact O-N 3.39Å; N166-V170 HydrophobicContact CB-CG2 4.11Å; N166-V170 WeakPolarHBondContact O-CB 3.41Å; N166-V170 WeakPolarHBondContact O-CG2 3.47Å; N166-V170 PolarHBondContact O-N 2.89Å
167	Y	91.1	Very high	88.1	Confident	7 Å²	7	58.1 Å²	58.1	3%	0.027	28%	0.277	C	S	.	.	H	α-helix	trans	-55.7	-54.1	-172.7	-170.6	-95	0	0	0	113.3	I162 T163 M171 F188 R207 F220 G221	I162-Y167 HydrophobicContact CG2-CD2 3.63Å; I162-Y167 HydrophobicContact CG2-CE2 4.39Å; I162-Y167 HydrophobicContact CG2-CG 4.29Å; T163-Y167 WeakPolarHBondContact O-CB 3.38Å; T163-Y167 PolarHBondContact O-N 2.81Å; T163-Y167 VanDerWaalsContact O-N 3.15Å; Y167-M171 HydrophobicContact CD1-CG 4.03Å; Y167-M171 HydrophobicContact CE1-CG 3.71Å; Y167-M171 HydrophobicContact CE2-CE 3.95Å; Y167-M171 HydrophobicContact CE2-CG 4.22Å; Y167-M171 HydrophobicContact CG-CG 4.44Å; Y167-M171 VanDerWaalsContact O-CB 3.3Å; Y167-M171 WeakPolarHBondContact O-CB 3.28Å; Y167-M171 WeakPolarHBondContact O-CG 3.44Å; Y167-M171 PolarHBondContact O-N 2.74Å; Y167-F188 AromaticContact CE2-CD2 3.85Å; Y167-F188 HydrophobicContact CE2-CD2 3.85Å; Y167-F188 HydrophobicContact CE2-CE2 4.45Å; Y167-R207 HydrophobicContact CD1-CB 4.27Å; Y167-R207 HydrophobicContact CD2-CG 4.38Å; Y167-R207 HydrophobicContact CE1-CB 3.64Å; Y167-R207 HydrophobicContact CE1-CG 3.94Å; Y167-R207 HydrophobicContact CE2-CB 4.39Å; Y167-R207 HydrophobicContact CE2-CG 3.77Å; Y167-R207 VanDerWaalsContact CZ-CD 3.43Å; Y167-F220 HydrophobicContact CE1-CB 4.13Å; Y167-F220 PolarHBondContact OH-O 2.89Å; Y167-G221 WeakPolarHBondContact OH-CA 3.44Å
168	L	88.2	Confident	88	Confident	42 Å²	42	55.7 Å²	55.7	22%	0.22	27%	0.265	C	S	.	.	H	α-helix	trans	-65.6	-43	-177	-73.2	174	0	0	0	111.9	P132 N166 M171 E172 F220	P132-L168 HydrophobicContact CB-CD2 3.98Å; P132-L168 HydrophobicContact CG-CD2 3.89Å; N166-L168 PolarHBondContact O-N 2.61Å; L168-M171 PolarHBondContact O-N 2.87Å; L168-E172 WeakPolarHBondContact O-CB 3.36Å; L168-E172 PolarHBondContact O-N 2.97Å; L168-F220 HydrophobicContact CD2-CD2 3.4Å; L168-F220 HydrophobicContact CD2-CE2 3.58Å; L168-F220 HydrophobicContact CD2-CG 4.18Å; L168-F220 HydrophobicContact CD2-CZ 4.48Å
169	E	90.3	Very high	87.6	Confident	67 Å²	67	52.2 Å²	52.2	31%	0.313	25%	0.251	S	S	.	.	H	α-helix	trans	-57.7	-54	177.4	-61.4	179.3	168.1	0	0	110.6	L150 K153 Y154 N166 M171 E172 L173	L150-E169 HydrophobicContact CD1-CB 4.24Å; L150-E169 HydrophobicContact CD1-CG 4.27Å; L150-E169 HydrophobicContact CD2-CB 4.35Å; L150-E169 HydrophobicContact CD2-CG 4.19Å; K153-E169 IonicContact NZ-OE2 3.65Å; Y154-E169 HydrophobicContact CE2-CB 4.39Å; Y154-E169 PolarHBondContact OH-OE2 3.31Å; N166-E169 PolarHBondContact O-N 3.39Å; E169-M171 PolarHBondContact O-N 2.77Å; E169-E172 PolarHBondContact O-N 3.02Å; E169-L173 VanDerWaalsContact O-CG 3.28Å; E169-L173 WeakPolarHBondContact O-CG 3.48Å; E169-L173 PolarHBondContact O-N 3.35Å
170	V	92	Very high	87.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-40.2	-176.2	174.9	0	0	0	0	110.8	Y154 L160 I162 N166 L173 I174	Y154-V170 HydrophobicContact CD1-CG2 4.15Å; Y154-V170 HydrophobicContact CD2-CG2 4.05Å; Y154-V170 HydrophobicContact CE1-CG2 3.99Å; Y154-V170 HydrophobicContact CE2-CG2 3.87Å; Y154-V170 HydrophobicContact CG-CG2 4.16Å; L160-V170 HydrophobicContact CD2-CG1 3.57Å; L160-V170 HydrophobicContact CD2-CG2 4.26Å; I162-V170 HydrophobicContact CD1-CB 4.49Å; I162-V170 HydrophobicContact CD1-CG1 3.63Å; I162-V170 HydrophobicContact CG1-CG1 3.94Å; I162-V170 HydrophobicContact CG2-CB 4.24Å; I162-V170 HydrophobicContact CG2-CG1 4.44Å; N166-V170 HydrophobicContact CB-CG2 4.11Å; N166-V170 WeakPolarHBondContact O-CB 3.41Å; N166-V170 WeakPolarHBondContact O-CG2 3.47Å; N166-V170 PolarHBondContact O-N 2.89Å; V170-L173 PolarHBondContact O-N 3.19Å; V170-I174 HydrophobicContact CG1-CD1 3.68Å; V170-I174 HydrophobicContact CG1-CG1 4.19Å; V170-I174 VanDerWaalsContact O-CG1 3.25Å; V170-I174 WeakPolarHBondContact O-CG1 3.44Å; V170-I174 PolarHBondContact O-N 3.17Å
171	M	91	Very high	86.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-47.4	176	-74.2	-64.6	138.4	0	0	111.5	P132 I162 Y167 L168 E169 L173 I174 Y175 L222	P132-M171 HydrophobicContact CG-CB 3.73Å; I162-M171 HydrophobicContact CD1-CE 3.56Å; Y167-M171 HydrophobicContact CD1-CG 4.03Å; Y167-M171 HydrophobicContact CE1-CG 3.71Å; Y167-M171 HydrophobicContact CE2-CE 3.95Å; Y167-M171 HydrophobicContact CE2-CG 4.22Å; Y167-M171 HydrophobicContact CG-CG 4.44Å; Y167-M171 VanDerWaalsContact O-CB 3.3Å; Y167-M171 WeakPolarHBondContact O-CB 3.28Å; Y167-M171 WeakPolarHBondContact O-CG 3.44Å; Y167-M171 PolarHBondContact O-N 2.74Å; L168-M171 PolarHBondContact O-N 2.87Å; E169-M171 PolarHBondContact O-N 2.77Å; M171-L173 VanDerWaalsContact C-N 3.31Å; M171-L173 PolarHBondContact O-N 3.44Å; M171-I174 HydrophobicContact CE-CD1 4.27Å; M171-I174 PolarHBondContact O-N 2.83Å; M171-Y175 VanDerWaalsContact O-CD2 3.26Å; M171-Y175 WeakPolarHBondContact O-CD2 3.47Å; M171-Y175 PolarHBondContact O-N 3.29Å; M171-L222 HydrophobicContact CE-CD1 4.08Å; M171-L222 HydrophobicContact CE-CG 4.21Å; M171-L222 HydrophobicContact SD-CD1 4.4Å; M171-L222 HydrophobicContact SD-CD2 4.24Å; M171-L222 HydrophobicContact SD-CG 3.99Å
172	E	88	Confident	86.4	Confident	5 Å²	5	43.8 Å²	43.8	2%	0.023	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-42.8	176.8	-178	163	-163	0	0	111.6	P132 T134 Y143 M147 L168 E169 Y175 N176	P132-E172 HydrophobicContact CB-CB 4.17Å; P132-E172 HydrophobicContact CG-CB 4.35Å; P132-E172 WeakPolarHBondContact O-CB 3.41Å; P132-E172 WeakPolarHBondContact O-CG 3.29Å; T134-E172 WeakPolarHBondContact CG2-OE2 3.25Å; T134-E172 PolarHBondContact N-OE1 3.35Å; T134-E172 PolarHBondContact OG1-OE1 3.41Å; T134-E172 PolarHBondContact OG1-OE2 3.44Å; Y143-E172 WeakPolarHBondContact CE2-OE1 3.3Å; Y143-E172 PolarHBondContact OH-OE1 2.8Å; M147-E172 HydrophobicContact SD-CG 4.29Å; L168-E172 WeakPolarHBondContact O-CB 3.36Å; L168-E172 PolarHBondContact O-N 2.97Å; E169-E172 PolarHBondContact O-N 3.02Å; E172-Y175 PolarHBondContact O-N 2.85Å; E172-N176 WeakPolarHBondContact CG-ND2 3.41Å; E172-N176 VanDerWaalsContact O-CB 3.3Å; E172-N176 WeakPolarHBondContact O-CB 3.45Å; E172-N176 PolarHBondContact O-N 2.84Å; E172-N176 PolarHBondContact O-ND2 3.03Å
173	L	87.4	Confident	86.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-42.5	176.3	-65.9	177.1	0	0	0	113.3	M147 L150 M151 Y154 E169 V170 M171 Y175 N176 Y177 F181	M147-L173 HydrophobicContact SD-CD2 3.89Å; L150-L173 HydrophobicContact CB-CD1 3.87Å; L150-L173 HydrophobicContact CB-CD2 4.15Å; L150-L173 HydrophobicContact CB-CG 4.41Å; M151-L173 HydrophobicContact CG-CD2 3.86Å; M151-L173 HydrophobicContact SD-CB 4.27Å; M151-L173 HydrophobicContact SD-CD1 4.23Å; M151-L173 HydrophobicContact SD-CD2 3.81Å; M151-L173 HydrophobicContact SD-CG 4.32Å; Y154-L173 HydrophobicContact CD2-CD1 3.57Å; Y154-L173 HydrophobicContact CE2-CD1 4.25Å; E169-L173 VanDerWaalsContact O-CG 3.28Å; E169-L173 WeakPolarHBondContact O-CG 3.48Å; E169-L173 PolarHBondContact O-N 3.35Å; V170-L173 PolarHBondContact O-N 3.19Å; M171-L173 VanDerWaalsContact C-N 3.31Å; M171-L173 PolarHBondContact O-N 3.44Å; L173-Y175 VanDerWaalsContact C-N 3.26Å; L173-Y175 PolarHBondContact O-N 2.78Å; L173-N176 PolarHBondContact O-N 2.87Å; L173-Y177 HydrophobicContact CD2-CD2 3.99Å; L173-Y177 HydrophobicContact CD2-CE2 3.95Å; L173-Y177 WeakPolarHBondContact O-CA 3.48Å; L173-Y177 PolarHBondContact O-N 3.02Å; L173-F181 HydrophobicContact CB-CE2 3.74Å; L173-F181 HydrophobicContact CB-CZ 3.68Å; L173-F181 HydrophobicContact CD1-CZ 4.2Å
174	I	87	Confident	86.1	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-42	177.4	-72	166.7	0	0	0	109.8	I162 V170 M171 P178 F181 L222 I244	I162-I174 HydrophobicContact CD1-CD1 4.19Å; V170-I174 HydrophobicContact CG1-CD1 3.68Å; V170-I174 HydrophobicContact CG1-CG1 4.19Å; V170-I174 VanDerWaalsContact O-CG1 3.25Å; V170-I174 WeakPolarHBondContact O-CG1 3.44Å; V170-I174 PolarHBondContact O-N 3.17Å; M171-I174 HydrophobicContact CE-CD1 4.27Å; M171-I174 PolarHBondContact O-N 2.83Å; I174-P178 WeakPolarHBondContact O-CA 3.35Å; I174-P178 WeakPolarHBondContact O-CB 3.1Å; I174-P178 WeakPolarHBondContact O-CD 3.34Å; I174-F181 HydrophobicContact CD1-CD1 4.49Å; I174-F181 HydrophobicContact CG1-CB 4.17Å; I174-F181 HydrophobicContact CG1-CD1 3.7Å; I174-F181 HydrophobicContact CG1-CD2 4.1Å; I174-F181 HydrophobicContact CG1-CE1 4.07Å; I174-F181 HydrophobicContact CG1-CE2 4.45Å; I174-F181 HydrophobicContact CG1-CG 3.73Å; I174-F181 HydrophobicContact CG1-CZ 4.44Å; I174-L222 HydrophobicContact CD1-CD1 4.45Å; I174-L222 HydrophobicContact CG2-CD2 4.13Å; I174-I244 HydrophobicContact CD1-CD1 3.87Å; I174-I244 HydrophobicContact CG1-CD1 4.16Å; I174-I244 HydrophobicContact CG2-CD1 4.48Å
175	Y	82.5	Confident	86.7	Confident	75 Å²	75	40.8 Å²	40.8	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-71.6	-39.8	177.8	-85.2	-76	0	0	0	113.4	L130 K131 M171 E172 L173 G221 L222	L130-Y175 HydrophobicContact CB-CE1 4.33Å; L130-Y175 WeakPolarHBondContact O-CE2 3.29Å; K131-Y175 HydrophobicContact CB-CD1 4.01Å; K131-Y175 HydrophobicContact CB-CD2 4Å; K131-Y175 HydrophobicContact CB-CG 3.73Å; K131-Y175 HydrophobicContact CG-CD2 4.32Å; K131-Y175 HydrophobicContact CG-CG 3.92Å; M171-Y175 VanDerWaalsContact O-CD2 3.26Å; M171-Y175 WeakPolarHBondContact O-CD2 3.47Å; M171-Y175 PolarHBondContact O-N 3.29Å; E172-Y175 PolarHBondContact O-N 2.85Å; L173-Y175 VanDerWaalsContact C-N 3.26Å; L173-Y175 PolarHBondContact O-N 2.78Å; Y175-G221 PolarHBondContact OH-O 2.81Å; Y175-L222 HydrophobicContact CE2-CD2 4.15Å
176	N	79	Confident	87.1	Confident	46 Å²	46	32.3 Å²	32.3	25%	0.246	18%	0.178	C	C	.	.	H	α-helix	trans	-75.2	-34.1	-179.3	-77.9	-20.1	0	0	0	113	K131 Y143 E172 L173 P178	K131-N176 WeakPolarHBondContact CE-OD1 3.41Å; K131-N176 PolarHBondContact NZ-OD1 3.23Å; Y143-N176 PolarHBondContact OH-ND2 2.69Å; Y143-N176 VanDerWaalsContact OH-ND2 3.08Å; E172-N176 WeakPolarHBondContact CG-ND2 3.41Å; E172-N176 VanDerWaalsContact O-CB 3.3Å; E172-N176 WeakPolarHBondContact O-CB 3.45Å; E172-N176 PolarHBondContact O-N 2.84Å; E172-N176 PolarHBondContact O-ND2 3.03Å; L173-N176 PolarHBondContact O-N 2.87Å; N176-P178 VanDerWaalsContact C-CD 3.5Å
177	Y	81.9	Confident	87.4	Confident	83 Å²	83	32.4 Å²	32.4	33%	0.325	18%	0.18	S	C	.	.			trans	-133.6	51.9	-172.1	-50.5	-72.9	0	0	0	112.2	M147 M151 L173 N179 S180 F181	M147-Y177 HydrophobicContact CB-CE2 4.33Å; M151-Y177 HydrophobicContact CE-CD2 4.42Å; M151-Y177 HydrophobicContact CE-CG 4.32Å; M151-Y177 HydrophobicContact CG-CD2 3.88Å; M151-Y177 HydrophobicContact CG-CE2 3.94Å; M151-Y177 HydrophobicContact SD-CD2 3.54Å; M151-Y177 VanDerWaalsContact SD-CD2 3.54Å; M151-Y177 HydrophobicContact SD-CE2 4.21Å; M151-Y177 HydrophobicContact SD-CG 4.01Å; L173-Y177 HydrophobicContact CD2-CD2 3.99Å; L173-Y177 HydrophobicContact CD2-CE2 3.95Å; L173-Y177 WeakPolarHBondContact O-CA 3.48Å; L173-Y177 PolarHBondContact O-N 3.02Å; Y177-N179 PolarHBondContact O-N 2.89Å; Y177-S180 WeakPolarHBondContact O-CB 3.34Å; Y177-S180 PolarHBondContact O-N 2.8Å; Y177-F181 WeakPolarHBondContact O-CD2 3.27Å
178	P	78.8	Confident	87.6	Confident	25 Å²	25	32.3 Å²	32.3	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-35	-170.7	22.8	-34.3	0	0	0	113	I174 N176 S180 F181 V182 L246	I174-P178 WeakPolarHBondContact O-CA 3.35Å; I174-P178 WeakPolarHBondContact O-CB 3.1Å; I174-P178 WeakPolarHBondContact O-CD 3.34Å; N176-P178 VanDerWaalsContact C-CD 3.5Å; P178-S180 PolarHBondContact O-N 3.4Å; P178-F181 PolarHBondContact O-N 3.44Å; P178-V182 WeakPolarHBondContact O-CG2 3.48Å; P178-V182 PolarHBondContact O-N 3.04Å; P178-L246 HydrophobicContact CB-CD1 4.43Å; P178-L246 HydrophobicContact CB-CD2 3.95Å; P178-L246 HydrophobicContact CB-CG 4.42Å; P178-L246 HydrophobicContact CG-CD2 4.42Å
179	N	76.8	Confident	87.9	Confident	88 Å²	88	33.1 Å²	33.1	47%	0.471	18%	0.184	S	C	.	.	H	α-helix	trans	-59.2	-31.1	178.5	-65.7	-16.1	0	0	0	113.1	Y177 F181	Y177-N179 PolarHBondContact O-N 2.89Å; N179-F181 VanDerWaalsContact C-N 3.26Å; N179-F181 PolarHBondContact O-N 3.49Å
180	S	83	Confident	88.1	Confident	41 Å²	41	29.9 Å²	29.9	29%	0.287	17%	0.17	S	C	.	.	H	α-helix	trans	-76.3	-14	176.7	-60.9	0	0	0	0	113	Y177 P178 K184	Y177-S180 WeakPolarHBondContact O-CB 3.34Å; Y177-S180 PolarHBondContact O-N 2.8Å; P178-S180 PolarHBondContact O-N 3.4Å; S180-K184 WeakPolarHBondContact O-CE 3.39Å
181	F	86	Confident	88.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-111.8	-19.6	-177.2	-70.3	-91	0	0	0	114	M151 L160 L173 I174 Y177 P178 N179 G183 K184 I244	M151-F181 HydrophobicContact CE-CE2 4.36Å; M151-F181 HydrophobicContact SD-CE2 3.92Å; M151-F181 HydrophobicContact SD-CZ 4.29Å; L160-F181 HydrophobicContact CD2-CD1 4.33Å; L160-F181 HydrophobicContact CD2-CE1 3.88Å; L173-F181 HydrophobicContact CB-CE2 3.74Å; L173-F181 HydrophobicContact CB-CZ 3.68Å; L173-F181 HydrophobicContact CD1-CZ 4.2Å; I174-F181 HydrophobicContact CD1-CD1 4.49Å; I174-F181 HydrophobicContact CG1-CB 4.17Å; I174-F181 HydrophobicContact CG1-CD1 3.7Å; I174-F181 HydrophobicContact CG1-CD2 4.1Å; I174-F181 HydrophobicContact CG1-CE1 4.07Å; I174-F181 HydrophobicContact CG1-CE2 4.45Å; I174-F181 HydrophobicContact CG1-CG 3.73Å; I174-F181 HydrophobicContact CG1-CZ 4.44Å; Y177-F181 WeakPolarHBondContact O-CD2 3.27Å; P178-F181 PolarHBondContact O-N 3.44Å; N179-F181 VanDerWaalsContact C-N 3.26Å; N179-F181 PolarHBondContact O-N 3.49Å; F181-G183 PolarHBondContact O-N 3.02Å; F181-K184 HydrophobicContact CD1-CD 4.17Å; F181-K184 VanDerWaalsContact O-CB 3.24Å; F181-K184 WeakPolarHBondContact O-CB 3.29Å; F181-K184 WeakPolarHBondContact O-CG 3.45Å; F181-K184 PolarHBondContact O-N 2.82Å; F181-I244 HydrophobicContact CB-CD1 3.8Å
182	V	85.5	Confident	88	Confident	63 Å²	63	30.1 Å²	30.1	38%	0.382	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	133.3	175.8	171	0	0	0	0	110.8	P178 K184 I244 L246	P178-V182 WeakPolarHBondContact O-CG2 3.48Å; P178-V182 PolarHBondContact O-N 3.04Å; V182-K184 PolarHBondContact O-N 2.98Å; V182-I244 HydrophobicContact CG2-CG2 4.48Å; V182-L246 HydrophobicContact CG2-CB 4.33Å; V182-L246 HydrophobicContact CG2-CD1 3.43Å; V182-L246 VanDerWaalsContact CG2-CD1 3.43Å; V182-L246 HydrophobicContact CG2-CG 3.57Å
183	G	87.6	Confident	88	Confident	53 Å²	53	30.9 Å²	30.9	55%	0.546	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	-11.6	-177.4	0	0	0	0	0	114.6	F181 I244	F181-G183 PolarHBondContact O-N 3.02Å; G183-I244 PolarHBondContact N-O 3.26Å
184	K	91.8	Very high	87.8	Confident	19 Å²	19	33.4 Å²	33.4	8%	0.083	19%	0.185	C	C	.	.			trans	-73.1	146.2	171.2	-62.6	-172.6	173.4	-134.7	0	110.7	Y154 E155 D157 S180 F181 V182 T243 I244	Y154-K184 PolarHBondContact O-NZ 3.32Å; E155-K184 WeakPolarHBondContact O-CE 3.49Å; E155-K184 PolarHBondContact O-NZ 3.44Å; D157-K184 WeakPolarHBondContact O-CD 3.5Å; D157-K184 WeakPolarHBondContact O-CE 3.26Å; D157-K184 PolarHBondContact O-NZ 2.99Å; S180-K184 WeakPolarHBondContact O-CE 3.39Å; F181-K184 HydrophobicContact CD1-CD 4.17Å; F181-K184 VanDerWaalsContact O-CB 3.24Å; F181-K184 WeakPolarHBondContact O-CB 3.29Å; F181-K184 WeakPolarHBondContact O-CG 3.45Å; F181-K184 PolarHBondContact O-N 2.82Å; V182-K184 PolarHBondContact O-N 2.98Å; K184-T243 WeakPolarHBondContact O-CA 3.49Å; K184-I244 PolarHBondContact O-N 2.88Å
185	T	96.1	Very high	87.2	Confident	31 Å²	31	33.5 Å²	33.5	19%	0.19	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.9	169	-52	0	0	0	0	108.3	Q158 K159 L160 E241 G242	Q158-T185 PolarHBondContact O-N 3.27Å; K159-T185 CarbonylContact C-O 3.58Å; K159-T185 VanDerWaalsContact CA-O 3.27Å; K159-T185 WeakPolarHBondContact CA-O 3.3Å; L160-T185 PolarHBondContact N-O 2.64Å; T185-E241 HydrophobicContact CG2-CG 3.64Å; T185-G242 CarbonylContact C-O 3.53Å; T185-G242 WeakPolarHBondContact CA-O 3.44Å
186	I	95.3	Very high	86.5	Confident	8 Å²	8	35.1 Å²	35.1	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.1	172.5	63.1	165.8	0	0	0	110.3	L160 I162 F188 L222 E241 G242 I244	L160-I186 HydrophobicContact CB-CG2 4.2Å; L160-I186 VanDerWaalsContact O-CA 3.22Å; L160-I186 WeakPolarHBondContact O-CA 3.33Å; I162-I186 HydrophobicContact CD1-CB 4.12Å; I162-I186 HydrophobicContact CD1-CD1 3.93Å; I162-I186 HydrophobicContact CD1-CG2 4.35Å; I162-I186 HydrophobicContact CG1-CB 4.45Å; I186-F188 HydrophobicContact CD1-CD1 3.89Å; I186-F188 HydrophobicContact CD1-CE1 3.93Å; I186-F188 HydrophobicContact CG1-CD1 4.44Å; I186-L222 HydrophobicContact CD1-CD1 3.52Å; I186-E241 VanDerWaalsContact O-CA 3.32Å; I186-E241 WeakPolarHBondContact O-CA 3.19Å; I186-G242 PolarHBondContact N-O 3.44Å; I186-G242 PolarHBondContact O-N 3.46Å; I186-I244 HydrophobicContact CD1-CD1 3.92Å; I186-I244 HydrophobicContact CD1-CG1 3.78Å; I186-I244 HydrophobicContact CG1-CD1 4.21Å; I186-I244 HydrophobicContact CG1-CG1 3.89Å; I186-I244 HydrophobicContact CG2-CD1 3.53Å; I186-I244 HydrophobicContact CG2-CG1 4Å
187	S	96.3	Very high	85.5	Confident	18 Å²	18	37.5 Å²	37.5	13%	0.126	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.9	166.3	60.4	0	0	0	0	110.7	L160 I162 V240	L160-S187 PolarHBondContact O-N 3Å; I162-S187 PolarHBondContact N-O 2.9Å; S187-V240 CarbonylContact C-O 3.51Å; S187-V240 WeakPolarHBondContact CA-O 3.18Å
188	F	95.7	Very high	84.2	Confident	5 Å²	5	40.2 Å²	40.2	2%	0.022	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	160.4	-179.9	76.5	-81.2	0	0	0	112.8	I162 Y167 I186 L205 L222 V240	I162-F188 HydrophobicContact CB-CB 3.71Å; I162-F188 HydrophobicContact CD1-CB 4.28Å; I162-F188 HydrophobicContact CG1-CB 4.28Å; I162-F188 HydrophobicContact CG2-CB 4.44Å; Y167-F188 AromaticContact CE2-CD2 3.85Å; Y167-F188 HydrophobicContact CE2-CD2 3.85Å; Y167-F188 HydrophobicContact CE2-CE2 4.45Å; I186-F188 HydrophobicContact CD1-CD1 3.89Å; I186-F188 HydrophobicContact CD1-CE1 3.93Å; I186-F188 HydrophobicContact CG1-CD1 4.44Å; F188-L205 HydrophobicContact CD2-CD2 4.16Å; F188-L205 HydrophobicContact CE1-CD2 4.43Å; F188-L205 HydrophobicContact CE2-CB 3.95Å; F188-L205 HydrophobicContact CE2-CD2 3.67Å; F188-L205 HydrophobicContact CE2-CG 4.03Å; F188-L205 HydrophobicContact CZ-CB 3.89Å; F188-L205 HydrophobicContact CZ-CD2 3.82Å; F188-L205 HydrophobicContact CZ-CG 4.31Å; F188-L222 HydrophobicContact CE1-CD1 4.3Å; F188-L222 HydrophobicContact CZ-CB 4.27Å; F188-L222 HydrophobicContact CZ-CD1 4.45Å; F188-V240 HydrophobicContact CD1-CG2 3.65Å; F188-V240 HydrophobicContact CE1-CG2 3.5Å; F188-V240 VanDerWaalsContact CE1-CG2 3.5Å; F188-V240 HydrophobicContact CG-CG2 4.29Å; F188-V240 HydrophobicContact CZ-CG2 4.06Å; F188-V240 PolarHBondContact N-O 2.98Å; F188-V240 PolarHBondContact O-N 3.42Å
189	N	94.8	Very high	83.2	Confident	59 Å²	59	47.4 Å²	47.4	32%	0.316	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.6	173.6	-61.4	-56.2	0	0	0	110.2	R207 W237 L238 H239	N189-R207 WeakPolarHBondContact O-CD 3.2Å; N189-R207 WeakPolarHBondContact O-CG 3.2Å; N189-W237 HydrophobicContact CB-CE3 4.45Å; N189-W237 HydrophobicContact CB-CZ3 4.46Å; N189-L238 WeakPolarHBondContact CA-O 3.31Å; N189-H239 WeakPolarHBondContact OD1-CA 3.15Å; N189-H239 VanDerWaalsContact OD1-CB 3.26Å; N189-H239 WeakPolarHBondContact OD1-CB 3.22Å; N189-H239 PolarHBondContact OD1-ND1 3.27Å
190	G	93.2	Very high	82.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	169.8	168.4	0	0	0	0	0	112	L205 F206 W237 L238	G190-L205 VanDerWaalsContact O-CD1 3.28Å; G190-L205 WeakPolarHBondContact O-CD1 3.44Å; G190-F206 CarbonylContact C-O 3.58Å; G190-F206 WeakPolarHBondContact CA-O 3.2Å; G190-W237 VanDerWaalsContact C-CE3 3.46Å; G190-W237 CarbonylContact O-C 3.54Å; G190-W237 VanDerWaalsContact O-CA 3.31Å; G190-W237 WeakPolarHBondContact O-CA 3.36Å; G190-L238 PolarHBondContact N-O 2.92Å; G190-L238 VanDerWaalsContact N-O 3.07Å; G190-L238 PolarHBondContact O-N 3.47Å
191	F	91.8	Very high	82	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141.9	173.8	65.1	-93.1	0	0	0	110.8	T103 V106 F206 F208 V219 Q236 W237	T103-F191 HydrophobicContact CG2-CD2 3.9Å; T103-F191 HydrophobicContact CG2-CE2 3.89Å; V106-F191 HydrophobicContact CG2-CE2 4.38Å; V106-F191 HydrophobicContact CG2-CZ 4.42Å; F191-F206 HydrophobicContact CD1-CB 4.39Å; F191-F206 WeakPolarHBondContact CD1-O 2.92Å; F191-F206 HydrophobicContact CD2-CB 4.28Å; F191-F206 HydrophobicContact CE1-CB 3.88Å; F191-F206 WeakPolarHBondContact CE1-O 3.41Å; F191-F206 HydrophobicContact CE2-CB 3.75Å; F191-F206 HydrophobicContact CE2-CD2 4.31Å; F191-F206 HydrophobicContact CZ-CB 3.52Å; F191-F206 PolarHBondContact N-O 3.44Å; F191-F206 PolarHBondContact O-N 3.29Å; F191-F208 AromaticContact CE1-CD2 3.46Å; F191-F208 HydrophobicContact CE1-CD2 3.46Å; F191-F208 VanDerWaalsContact CE1-CD2 3.46Å; F191-F208 AromaticContact CE1-CE2 3.64Å; F191-F208 HydrophobicContact CE1-CE2 3.64Å; F191-F208 HydrophobicContact CE1-CG 4.45Å; F191-F208 HydrophobicContact CE2-CE2 4.29Å; F191-F208 AromaticContact CZ-CD2 3.69Å; F191-F208 HydrophobicContact CZ-CD2 3.69Å; F191-F208 AromaticContact CZ-CE2 3.37Å; F191-F208 HydrophobicContact CZ-CE2 3.37Å; F191-F208 HydrophobicContact CZ-CZ 4.19Å; F191-V219 HydrophobicContact CZ-CG1 4Å; F191-Q236 CarbonylContact C-O 3.53Å; F191-Q236 WeakPolarHBondContact CA-O 3.4Å; F191-W237 HydrophobicContact CB-CD2 4.13Å; F191-W237 HydrophobicContact CB-CG 4.26Å; F191-W237 HydrophobicContact CB-CZ2 4.34Å; F191-W237 HydrophobicContact CD1-CH2 4.28Å; F191-W237 AromaticContact CD1-CZ2 3.86Å; F191-W237 HydrophobicContact CD1-CZ2 3.86Å
192	V	90.4	Very high	81.4	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	132.3	176.9	175.4	0	0	0	0	109.9	F204 L205 V232 N234 N235 Q236 L238	V192-F204 CarbonylContact C-O 3.58Å; V192-F204 WeakPolarHBondContact CA-O 3.37Å; V192-L205 HydrophobicContact CG2-CD1 3.81Å; V192-V232 HydrophobicContact CG1-CB 4.09Å; V192-V232 HydrophobicContact CG1-CG2 3.75Å; V192-V232 HydrophobicContact CG2-CB 4.21Å; V192-V232 HydrophobicContact CG2-CG1 4.39Å; V192-N234 WeakPolarHBondContact O-CA 3.38Å; V192-N235 PolarHBondContact O-N 3.41Å; V192-Q236 WeakPolarHBondContact CG2-O 3.44Å; V192-Q236 PolarHBondContact N-O 3.23Å; V192-L238 HydrophobicContact CG2-CD1 3.45Å; V192-L238 VanDerWaalsContact CG2-CD1 3.45Å; V192-L238 HydrophobicContact CG2-CG 3.94Å
193	Y	86.7	Confident	81.4	Confident	21 Å²	21	49.2 Å²	49.2	8%	0.082	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	112.6	164	174.8	-105.3	0	0	0	108.8	T103 V106 E107 F111 A195 F204 F206	T103-Y193 HydrophobicContact CG2-CD2 3.88Å; V106-Y193 HydrophobicContact CB-CD2 4.33Å; V106-Y193 HydrophobicContact CB-CE2 4.2Å; V106-Y193 HydrophobicContact CG1-CD1 4.24Å; V106-Y193 HydrophobicContact CG1-CD2 4.07Å; V106-Y193 HydrophobicContact CG1-CE1 4.01Å; V106-Y193 HydrophobicContact CG1-CE2 3.86Å; V106-Y193 HydrophobicContact CG1-CG 4.24Å; E107-Y193 HydrophobicContact CG-CE2 3.86Å; F111-Y193 HydrophobicContact CB-CE1 4.2Å; F111-Y193 HydrophobicContact CD1-CE1 4.46Å; F111-Y193 HydrophobicContact CD2-CE1 4.42Å; F111-Y193 HydrophobicContact CG-CE1 4.11Å; Y193-A195 HydrophobicContact CD1-CB 4.38Å; Y193-A195 HydrophobicContact CE1-CB 3.89Å; Y193-F204 HydrophobicContact CD1-CB 4.38Å; Y193-F204 HydrophobicContact CD1-CD2 4.2Å; Y193-F204 PolarHBondContact N-O 2.82Å; Y193-F204 PolarHBondContact O-N 3.44Å; Y193-F206 HydrophobicContact CD1-CD2 4.26Å; Y193-F206 AromaticContact CD1-CE2 3.56Å; Y193-F206 HydrophobicContact CD1-CE2 3.56Å; Y193-F206 HydrophobicContact CD1-CZ 4.47Å; Y193-F206 HydrophobicContact CE1-CE2 4.43Å; Y193-F206 HydrophobicContact CG-CD2 4.17Å; Y193-F206 AromaticContact CG-CE2 3.94Å; Y193-F206 HydrophobicContact CG-CE2 3.94Å
194	E	83.2	Confident	81.4	Confident	53 Å²	53	46.9 Å²	46.9	25%	0.248	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	112.9	175.1	-175.1	-178.6	120.3	0	0	109.2	N196 K201 N234	E194-N196 PolarHBondContact OE1-ND2 2.99Å; E194-K201 HydrophobicContact CG-CD 3.92Å; E194-K201 HydrophobicContact CG-CG 3.82Å; E194-K201 WeakPolarHBondContact OE2-CE 3.16Å; E194-K201 IonicContact OE2-NZ 2.67Å; E194-K201 PolarHBondContact OE2-NZ 3.11Å; E194-N234 WeakPolarHBondContact CB-OD1 3.26Å; E194-N234 PolarHBondContact N-OD1 3.03Å
195	A	75.3	Confident	81.4	Confident	12 Å²	12	46 Å²	46	10%	0.099	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.9	169.8	0	0	0	0	0	109.3	Y193 Y202 F204	Y193-A195 HydrophobicContact CD1-CB 4.38Å; Y193-A195 HydrophobicContact CE1-CB 3.89Å; A195-Y202 PolarHBondContact N-O 3.46Å; A195-Y202 PolarHBondContact O-N 2.69Å; A195-F204 HydrophobicContact CB-CD2 4.16Å; A195-F204 HydrophobicContact CB-CE2 3.98Å
196	N	68.3	Low	81.1	Confident	108 Å²	108	44.6 Å²	44.6	58%	0.578	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.6	173.5	-71.3	-42.5	0	0	0	109.2	E194	E194-N196 PolarHBondContact OE1-ND2 2.99Å
197	K	57.4	Low	80.8	Confident	97 Å²	97	46 Å²	46	42%	0.422	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	132.1	174.9	-164.1	179.4	-177.6	-169.7	0	109.4	N199 Q200 Y202 P251	K197-N199 VanDerWaalsContact C-N 3.28Å; K197-N199 PolarHBondContact O-N 2.86Å; K197-Q200 PolarHBondContact N-O 2.89Å; K197-Q200 WeakPolarHBondContact O-CA 3.47Å; K197-Q200 WeakPolarHBondContact O-CB 3.43Å; K197-Q200 PolarHBondContact O-N 2.91Å; K197-Q200 VanDerWaalsContact O-O 3.07Å; K197-Y202 HydrophobicContact CB-CE2 4.43Å; K197-P251 HydrophobicContact CD-CB 4.05Å
198	N	54.3	Low	80.3	Confident	139 Å²	139	47.1 Å²	47.1	74%	0.743	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	39.8	179.8	-61.5	-12.8	0	0	0	114.4	Q200	N198-Q200 PolarHBondContact O-N 2.74Å; N198-Q200 VanDerWaalsContact O-N 3.08Å
199	N	58.2	Low	79.6	Confident	177 Å²	177	47.2 Å²	47.2	95%	0.947	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	8.3	-172.6	-72.3	12.9	0	0	0	115.3	K197	K197-N199 VanDerWaalsContact C-N 3.28Å; K197-N199 PolarHBondContact O-N 2.86Å
200	Q	60.8	Low	78.9	Confident	94 Å²	94	45.3 Å²	45.3	44%	0.439	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.6	170	-165.8	163.2	-16.6	0	0	109.6	K197 N198 Y202	K197-Q200 PolarHBondContact N-O 2.89Å; K197-Q200 WeakPolarHBondContact O-CA 3.47Å; K197-Q200 WeakPolarHBondContact O-CB 3.43Å; K197-Q200 PolarHBondContact O-N 2.91Å; K197-Q200 VanDerWaalsContact O-O 3.07Å; N198-Q200 PolarHBondContact O-N 2.74Å; N198-Q200 VanDerWaalsContact O-N 3.08Å; Q200-Y202 HydrophobicContact CB-CE2 3.78Å; Q200-Y202 VanDerWaalsContact CD-CZ 3.47Å; Q200-Y202 HydrophobicContact CG-CE1 3.84Å; Q200-Y202 HydrophobicContact CG-CE2 3.85Å; Q200-Y202 VanDerWaalsContact CG-CZ 3.48Å; Q200-Y202 PolarHBondContact OE1-OH 2.92Å
201	K	73.3	Confident	78.1	Confident	87 Å²	87	46 Å²	46	38%	0.378	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.9	177.6	176.6	174.8	158.5	163.5	0	108.9	E194 D203	E194-K201 HydrophobicContact CG-CD 3.92Å; E194-K201 HydrophobicContact CG-CG 3.82Å; E194-K201 WeakPolarHBondContact OE2-CE 3.16Å; E194-K201 IonicContact OE2-NZ 2.67Å; E194-K201 PolarHBondContact OE2-NZ 3.11Å; K201-D203 WeakPolarHBondContact CE-OD1 3.31Å; K201-D203 WeakPolarHBondContact CE-OD2 3.45Å; K201-D203 IonicContact NZ-OD1 3.44Å
202	Y	74.1	Confident	77.2	Confident	22 Å²	22	51.3 Å²	51.3	9%	0.086	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.7	174.8	-54	-86.2	0	0	0	109.3	A195 K197 Q200 M223 F249	A195-Y202 PolarHBondContact N-O 3.46Å; A195-Y202 PolarHBondContact O-N 2.69Å; K197-Y202 HydrophobicContact CB-CE2 4.43Å; Q200-Y202 HydrophobicContact CB-CE2 3.78Å; Q200-Y202 VanDerWaalsContact CD-CZ 3.47Å; Q200-Y202 HydrophobicContact CG-CE1 3.84Å; Q200-Y202 HydrophobicContact CG-CE2 3.85Å; Q200-Y202 VanDerWaalsContact CG-CZ 3.48Å; Q200-Y202 PolarHBondContact OE1-OH 2.92Å; Y202-M223 HydrophobicContact CD1-SD 4.15Å; Y202-F249 AromaticContact CD1-CD2 3.98Å; Y202-F249 HydrophobicContact CD1-CD2 3.98Å; Y202-F249 AromaticContact CD1-CE2 3.4Å; Y202-F249 HydrophobicContact CD1-CE2 3.4Å; Y202-F249 HydrophobicContact CD1-CZ 4.44Å; Y202-F249 AromaticContact CD2-CE2 3.73Å; Y202-F249 HydrophobicContact CD2-CE2 3.73Å; Y202-F249 HydrophobicContact CD2-CZ 4.22Å; Y202-F249 AromaticContact CE1-CD2 3.87Å; Y202-F249 HydrophobicContact CE1-CD2 3.87Å; Y202-F249 AromaticContact CE1-CE2 3.55Å; Y202-F249 HydrophobicContact CE1-CE2 3.55Å; Y202-F249 AromaticContact CE2-CE2 3.86Å; Y202-F249 HydrophobicContact CE2-CE2 3.86Å; Y202-F249 HydrophobicContact CG-CD2 4.46Å; Y202-F249 AromaticContact CG-CE2 3.46Å; Y202-F249 HydrophobicContact CG-CE2 3.46Å; Y202-F249 VanDerWaalsContact CG-CE2 3.46Å; Y202-F249 HydrophobicContact CG-CZ 4.11Å; Y202-F249 AromaticContact CZ-CE2 3.76Å
203	D	85	Confident	76.6	Confident	26 Å²	26	53.4 Å²	53.4	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	123	175.9	-63.7	-56.1	0	0	0	109.1	K201 T224 L226	K201-D203 WeakPolarHBondContact CE-OD1 3.31Å; K201-D203 WeakPolarHBondContact CE-OD2 3.45Å; K201-D203 IonicContact NZ-OD1 3.44Å; D203-T224 PolarHBondContact O-N 2.94Å; D203-L226 HydrophobicContact CB-CD1 3.86Å; D203-L226 HydrophobicContact CB-CG 4.31Å
204	F	87.7	Confident	76.1	Confident	5 Å²	5	55.1 Å²	55.1	2%	0.022	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143	171.1	-71.4	-88.2	0	0	0	110	F111 L130 V192 Y193 A195 F206 M223 F249	F111-F204 HydrophobicContact CE1-CD2 4.49Å; F111-F204 HydrophobicContact CE1-CE1 4.42Å; F111-F204 AromaticContact CE1-CE2 3.79Å; F111-F204 HydrophobicContact CE1-CE2 3.79Å; F111-F204 AromaticContact CE1-CZ 3.77Å; F111-F204 HydrophobicContact CE1-CZ 3.77Å; F111-F204 HydrophobicContact CZ-CD1 4.2Å; F111-F204 HydrophobicContact CZ-CD2 4.29Å; F111-F204 AromaticContact CZ-CE1 3.7Å; F111-F204 HydrophobicContact CZ-CE1 3.7Å; F111-F204 AromaticContact CZ-CE2 3.8Å; F111-F204 HydrophobicContact CZ-CE2 3.8Å; F111-F204 HydrophobicContact CZ-CG 4.48Å; F111-F204 AromaticContact CZ-CZ 3.51Å; F111-F204 HydrophobicContact CZ-CZ 3.51Å; L130-F204 HydrophobicContact CD2-CD1 4.47Å; V192-F204 CarbonylContact C-O 3.58Å; V192-F204 WeakPolarHBondContact CA-O 3.37Å; Y193-F204 HydrophobicContact CD1-CB 4.38Å; Y193-F204 HydrophobicContact CD1-CD2 4.2Å; Y193-F204 PolarHBondContact N-O 2.82Å; Y193-F204 PolarHBondContact O-N 3.44Å; A195-F204 HydrophobicContact CB-CD2 4.16Å; A195-F204 HydrophobicContact CB-CE2 3.98Å; F204-F206 HydrophobicContact CB-CD1 4.1Å; F204-F206 HydrophobicContact CB-CD2 4Å; F204-F206 HydrophobicContact CB-CE1 3.59Å; F204-F206 HydrophobicContact CB-CE2 3.51Å; F204-F206 HydrophobicContact CB-CG 4.27Å; F204-F206 HydrophobicContact CB-CZ 3.27Å; F204-F206 AromaticContact CD1-CE1 3.58Å; F204-F206 HydrophobicContact CD1-CE1 3.58Å; F204-F206 HydrophobicContact CD1-CE2 4.42Å; F204-F206 AromaticContact CD1-CZ 3.41Å; F204-F206 HydrophobicContact CD1-CZ 3.41Å; F204-F206 VanDerWaalsContact CD1-CZ 3.41Å; F204-F206 HydrophobicContact CD2-CZ 4.26Å; F204-F206 HydrophobicContact CE1-CZ 4.34Å; F204-F206 AromaticContact CG-CE1 3.87Å; F204-F206 HydrophobicContact CG-CE1 3.87Å; F204-F206 AromaticContact CG-CE2 3.96Å; F204-F206 HydrophobicContact CG-CE2 3.96Å; F204-F206 AromaticContact CG-CZ 3.37Å; F204-F206 HydrophobicContact CG-CZ 3.37Å; F204-M223 HydrophobicContact CD1-CB 4.02Å; F204-M223 HydrophobicContact CD1-CG 4.47Å; F204-M223 HydrophobicContact CE1-CB 3.62Å; F204-M223 HydrophobicContact CE1-CG 4.02Å; F204-M223 HydrophobicContact CZ-CB 4.16Å; F204-M223 HydrophobicContact CZ-CE 4.29Å; F204-M223 HydrophobicContact CZ-CG 4.06Å; F204-F249 HydrophobicContact CE1-CE1 4.37Å; F204-F249 HydrophobicContact CE2-CE1 4.21Å; F204-F249 AromaticContact CE2-CZ 3.8Å; F204-F249 HydrophobicContact CE2-CZ 3.8Å; F204-F249 HydrophobicContact CZ-CD1 4.24Å; F204-F249 AromaticContact CZ-CE1 3.45Å; F204-F249 HydrophobicContact CZ-CE1 3.45Å; F204-F249 VanDerWaalsContact CZ-CE1 3.45Å; F204-F249 HydrophobicContact CZ-CE2 4.14Å; F204-F249 AromaticContact CZ-CZ 3.41Å; F204-F249 HydrophobicContact CZ-CZ 3.41Å; F204-F249 VanDerWaalsContact CZ-CZ 3.41Å
205	L	91.3	Very high	75.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110	170.5	-155.4	74.8	0	0	0	109.1	F188 G190 V192 G221 L222 T224 L238 V240	F188-L205 HydrophobicContact CD2-CD2 4.16Å; F188-L205 HydrophobicContact CE1-CD2 4.43Å; F188-L205 HydrophobicContact CE2-CB 3.95Å; F188-L205 HydrophobicContact CE2-CD2 3.67Å; F188-L205 HydrophobicContact CE2-CG 4.03Å; F188-L205 HydrophobicContact CZ-CB 3.89Å; F188-L205 HydrophobicContact CZ-CD2 3.82Å; F188-L205 HydrophobicContact CZ-CG 4.31Å; G190-L205 VanDerWaalsContact O-CD1 3.28Å; G190-L205 WeakPolarHBondContact O-CD1 3.44Å; V192-L205 HydrophobicContact CG2-CD1 3.81Å; L205-G221 WeakPolarHBondContact O-CA 3.19Å; L205-L222 PolarHBondContact N-O 3.42Å; L205-L222 PolarHBondContact O-N 3.12Å; L205-L222 VanDerWaalsContact O-N 3.16Å; L205-T224 WeakPolarHBondContact CB-OG1 3.45Å; L205-L238 HydrophobicContact CD1-CB 4.07Å; L205-L238 HydrophobicContact CD1-CD1 4.39Å; L205-L238 HydrophobicContact CD1-CG 4.49Å; L205-V240 HydrophobicContact CD2-CB 4.1Å; L205-V240 HydrophobicContact CD2-CG1 3.6Å; L205-V240 HydrophobicContact CD2-CG2 3.36Å
206	F	90	Very high	75.4	Confident	1 Å²	1	57.9 Å²	57.9	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	160.1	-168.8	-72.5	-29.7	0	0	0	113.4	V106 F111 L130 G190 F191 Y193 F204 V219 F220	V106-F206 HydrophobicContact CG1-CE2 4.38Å; F111-F206 HydrophobicContact CD2-CE2 4.43Å; F111-F206 HydrophobicContact CD2-CZ 4.26Å; F111-F206 HydrophobicContact CE2-CE2 4.18Å; F111-F206 AromaticContact CE2-CZ 3.58Å; F111-F206 HydrophobicContact CE2-CZ 3.58Å; F111-F206 HydrophobicContact CZ-CZ 4.21Å; L130-F206 HydrophobicContact CD2-CD1 4.36Å; L130-F206 HydrophobicContact CD2-CE1 3.23Å; L130-F206 HydrophobicContact CD2-CZ 3.46Å; L130-F206 VanDerWaalsContact CD2-CZ 3.46Å; G190-F206 CarbonylContact C-O 3.58Å; G190-F206 WeakPolarHBondContact CA-O 3.2Å; F191-F206 HydrophobicContact CD1-CB 4.39Å; F191-F206 WeakPolarHBondContact CD1-O 2.92Å; F191-F206 HydrophobicContact CD2-CB 4.28Å; F191-F206 HydrophobicContact CE1-CB 3.88Å; F191-F206 WeakPolarHBondContact CE1-O 3.41Å; F191-F206 HydrophobicContact CE2-CB 3.75Å; F191-F206 HydrophobicContact CE2-CD2 4.31Å; F191-F206 HydrophobicContact CZ-CB 3.52Å; F191-F206 PolarHBondContact N-O 3.44Å; F191-F206 PolarHBondContact O-N 3.29Å; Y193-F206 HydrophobicContact CD1-CD2 4.26Å; Y193-F206 AromaticContact CD1-CE2 3.56Å; Y193-F206 HydrophobicContact CD1-CE2 3.56Å; Y193-F206 HydrophobicContact CD1-CZ 4.47Å; Y193-F206 HydrophobicContact CE1-CE2 4.43Å; Y193-F206 HydrophobicContact CG-CD2 4.17Å; Y193-F206 AromaticContact CG-CE2 3.94Å; Y193-F206 HydrophobicContact CG-CE2 3.94Å; F204-F206 HydrophobicContact CB-CD1 4.1Å; F204-F206 HydrophobicContact CB-CD2 4Å; F204-F206 HydrophobicContact CB-CE1 3.59Å; F204-F206 HydrophobicContact CB-CE2 3.51Å; F204-F206 HydrophobicContact CB-CG 4.27Å; F204-F206 HydrophobicContact CB-CZ 3.27Å; F204-F206 AromaticContact CD1-CE1 3.58Å; F204-F206 HydrophobicContact CD1-CE1 3.58Å; F204-F206 HydrophobicContact CD1-CE2 4.42Å; F204-F206 AromaticContact CD1-CZ 3.41Å; F204-F206 HydrophobicContact CD1-CZ 3.41Å; F204-F206 VanDerWaalsContact CD1-CZ 3.41Å; F204-F206 HydrophobicContact CD2-CZ 4.26Å; F204-F206 HydrophobicContact CE1-CZ 4.34Å; F204-F206 AromaticContact CG-CE1 3.87Å; F204-F206 HydrophobicContact CG-CE1 3.87Å; F204-F206 AromaticContact CG-CE2 3.96Å; F204-F206 HydrophobicContact CG-CE2 3.96Å; F204-F206 AromaticContact CG-CZ 3.37Å; F204-F206 HydrophobicContact CG-CZ 3.37Å; F206-V219 HydrophobicContact CB-CG1 3.44Å; F206-V219 VanDerWaalsContact CB-CG1 3.44Å; F206-V219 HydrophobicContact CD1-CG1 4.05Å; F206-V219 HydrophobicContact CD2-CG1 3.5Å; F206-V219 VanDerWaalsContact CD2-CG1 3.5Å; F206-V219 HydrophobicContact CE2-CG1 4.22Å; F206-V219 HydrophobicContact CG-CG1 3.4Å; F206-F220 CarbonylContact C-O 3.53Å; F206-F220 WeakPolarHBondContact CA-O 3.42Å
207	R	89.4	Confident	75.8	Confident	36 Å²	36	53.3 Å²	53.3	14%	0.136	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.8	161.8	-60.1	-175	77.9	163.3	5.3	109.5	D164 Y167 N189 F220 W237	D164-R207 VanDerWaalsContact CG-NH2 3.26Å; D164-R207 IonicContact OD1-CZ 2.68Å; D164-R207 IonicContact OD1-NH1 2.94Å; D164-R207 PolarHBondContact OD1-NH1 2.88Å; D164-R207 IonicContact OD1-NH2 2.71Å; D164-R207 PolarHBondContact OD1-NH2 2.86Å; D164-R207 IonicContact OD2-NH2 2.85Å; Y167-R207 HydrophobicContact CD1-CB 4.27Å; Y167-R207 HydrophobicContact CD2-CG 4.38Å; Y167-R207 HydrophobicContact CE1-CB 3.64Å; Y167-R207 HydrophobicContact CE1-CG 3.94Å; Y167-R207 HydrophobicContact CE2-CB 4.39Å; Y167-R207 HydrophobicContact CE2-CG 3.77Å; Y167-R207 VanDerWaalsContact CZ-CD 3.43Å; N189-R207 WeakPolarHBondContact O-CD 3.2Å; N189-R207 WeakPolarHBondContact O-CG 3.2Å; R207-F220 PolarHBondContact N-O 3.32Å; R207-F220 PolarHBondContact O-N 3.27Å; R207-W237 HydrophobicContact CG-CH2 4.15Å; R207-W237 HydrophobicContact CG-CZ3 4.14Å
208	F	85.3	Confident	76.8	Confident	42 Å²	42	49 Å²	49	18%	0.184	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.1	164	-77.1	-82.6	0	0	0	108.8	L101 D102 I105 V106 F191 G218 V219	L101-F208 HydrophobicContact CB-CB 4.2Å; L101-F208 HydrophobicContact CB-CD1 3.48Å; L101-F208 VanDerWaalsContact CB-CD1 3.48Å; L101-F208 HydrophobicContact CB-CD2 3.47Å; L101-F208 VanDerWaalsContact CB-CD2 3.47Å; L101-F208 HydrophobicContact CB-CE1 3.58Å; L101-F208 HydrophobicContact CB-CE2 3.6Å; L101-F208 HydrophobicContact CB-CG 3.42Å; L101-F208 VanDerWaalsContact CB-CG 3.42Å; L101-F208 HydrophobicContact CB-CZ 3.66Å; L101-F208 HydrophobicContact CD1-CB 3.82Å; L101-F208 HydrophobicContact CD1-CD1 3.53Å; L101-F208 HydrophobicContact CD1-CE1 4.25Å; L101-F208 HydrophobicContact CD1-CG 3.75Å; L101-F208 HydrophobicContact CG-CD1 4.04Å; L101-F208 HydrophobicContact CG-CE1 4.33Å; L101-F208 HydrophobicContact CG-CG 4.21Å; L101-F208 WeakPolarHBondContact O-CD2 3.15Å; L101-F208 VanDerWaalsContact O-CE2 3.3Å; L101-F208 WeakPolarHBondContact O-CE2 3.34Å; D102-F208 VanDerWaalsContact O-CZ 3.29Å; D102-F208 WeakPolarHBondContact O-CZ 3.42Å; I105-F208 HydrophobicContact CB-CE1 4.45Å; I105-F208 HydrophobicContact CB-CZ 4.24Å; I105-F208 HydrophobicContact CG2-CE1 4.28Å; V106-F208 HydrophobicContact CG2-CZ 4.01Å; F191-F208 AromaticContact CE1-CD2 3.46Å; F191-F208 HydrophobicContact CE1-CD2 3.46Å; F191-F208 VanDerWaalsContact CE1-CD2 3.46Å; F191-F208 AromaticContact CE1-CE2 3.64Å; F191-F208 HydrophobicContact CE1-CE2 3.64Å; F191-F208 HydrophobicContact CE1-CG 4.45Å; F191-F208 HydrophobicContact CE2-CE2 4.29Å; F191-F208 AromaticContact CZ-CD2 3.69Å; F191-F208 HydrophobicContact CZ-CD2 3.69Å; F191-F208 AromaticContact CZ-CE2 3.37Å; F191-F208 HydrophobicContact CZ-CE2 3.37Å; F191-F208 HydrophobicContact CZ-CZ 4.19Å; F208-G218 WeakPolarHBondContact CA-O 3.43Å; F208-V219 HydrophobicContact CD1-CG2 3.47Å; F208-V219 VanDerWaalsContact CD1-CG2 3.47Å; F208-V219 HydrophobicContact CE1-CG2 3.08Å; F208-V219 HydrophobicContact CE2-CG2 4.29Å; F208-V219 HydrophobicContact CG-CG2 4.23Å; F208-V219 HydrophobicContact CZ-CG2 3.54Å
209	G	81.3	Confident	78.1	Confident	7 Å²	7	43.3 Å²	43.3	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.1	172.5	0	0	0	0	0	110.3	S217 G218	G209-S217 VanDerWaalsContact O-CA 3.31Å; G209-S217 WeakPolarHBondContact O-CA 3.17Å; G209-G218 PolarHBondContact N-O 2.9Å; G209-G218 PolarHBondContact O-N 3.47Å
210	I	80.1	Confident	79.5	Confident	19 Å²	19	34.9 Å²	34.9	10%	0.097	19%	0.191	C	C	.	.			trans	-115.4	122.1	172.8	-65.6	173.2	0	0	0	106	N28 C213 V214	N28-I210 HydrophobicContact CB-CG2 4.35Å; N28-I210 WeakPolarHBondContact CB-O 3.34Å; N28-I210 PolarHBondContact ND2-O 3.47Å; I210-C213 VanDerWaalsContact CG2-CA 3.45Å; I210-C213 VanDerWaalsContact CG2-N 3.31Å; I210-V214 HydrophobicContact CD1-CB 4.29Å
211	I	75.4	Confident	80.8	Confident	16 Å²	16	30.4 Å²	30.4	8%	0.082	17%	0.17	C	C	.	.	S	Bend	trans	-78.5	-50.1	178.5	-57.4	176.4	0	0	0	108.7	N28 T134 Y137 D216	N28-I211 WeakPolarHBondContact CB-O 3.31Å; N28-I211 PolarHBondContact ND2-O 2.84Å; T134-I211 HydrophobicContact CG2-CG2 4.27Å; Y137-I211 HydrophobicContact CD2-CG2 3.98Å; Y137-I211 HydrophobicContact CE2-CB 4.19Å; Y137-I211 HydrophobicContact CE2-CD1 3.93Å; Y137-I211 HydrophobicContact CE2-CG2 3.47Å; Y137-I211 VanDerWaalsContact CE2-CG2 3.47Å; I211-D216 PolarHBondContact N-OD1 3.21Å
212	H	73.8	Confident	81.6	Confident	114 Å²	114	27.5 Å²	27.5	53%	0.528	16%	0.158	S	C	.	.	S	Bend	trans	-124.6	-56.1	178.3	-175	70.8	0	0	0	112.3	N28 D216	N28-H212 PolarHBondContact N-O 3.5Å; H212-D216 WeakPolarHBondContact CA-OD2 3.11Å; H212-D216 WeakPolarHBondContact CB-OD2 3.08Å; H212-D216 PolarHBondContact N-OD1 2.72Å; H212-D216 PolarHBondContact N-OD2 3.21Å
213	C	77.3	Confident	82.2	Confident	44 Å²	44	29.5 Å²	29.5	30%	0.297	17%	0.169	S	C	.	.	B	Isolated β-bridge	trans	-144.6	159	-178.6	73.2	0	0	0	0	112.6	Y26 I210 A215 D216	Y26-C213 CarbonylContact O-C 3.38Å; Y26-C213 WeakPolarHBondContact O-CA 3.46Å; I210-C213 VanDerWaalsContact CG2-CA 3.45Å; I210-C213 VanDerWaalsContact CG2-N 3.31Å; C213-A215 PolarHBondContact O-N 2.76Å; C213-D216 PolarHBondContact N-OD2 2.77Å; C213-D216 PolarHBondContact O-N 2.8Å
214	V	76.5	Confident	82.4	Confident	57 Å²	57	29.4 Å²	29.4	35%	0.345	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-49.8	-24.8	-175.5	70.9	0	0	0	0	115.5	Y26 I210 D216 S217	Y26-V214 PolarHBondContact O-N 3.43Å; I210-V214 HydrophobicContact CD1-CB 4.29Å; V214-D216 VanDerWaalsContact C-N 3.29Å; V214-D216 PolarHBondContact O-N 2.81Å; V214-S217 WeakPolarHBondContact O-CB 3.27Å; V214-S217 PolarHBondContact O-N 3.46Å; V214-S217 VanDerWaalsContact O-N 3.12Å; V214-S217 PolarHBondContact O-OG 3.01Å
215	A	73.6	Confident	82.4	Confident	87 Å²	87	36.7 Å²	36.7	72%	0.719	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-64.7	-30.3	174.4	0	0	0	0	0	113.5	C213 S217	C213-A215 PolarHBondContact O-N 2.76Å; A215-S217 VanDerWaalsContact C-N 3.29Å
216	D	71.2	Confident	82.2	Confident	37 Å²	37	38.1 Å²	38.1	20%	0.198	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-88.2	6.9	173.6	67.2	38.4	0	0	0	113.6	I211 H212 C213 V214 G218	I211-D216 PolarHBondContact N-OD1 3.21Å; H212-D216 WeakPolarHBondContact CA-OD2 3.11Å; H212-D216 WeakPolarHBondContact CB-OD2 3.08Å; H212-D216 PolarHBondContact N-OD1 2.72Å; H212-D216 PolarHBondContact N-OD2 3.21Å; C213-D216 PolarHBondContact N-OD2 2.77Å; C213-D216 PolarHBondContact O-N 2.8Å; V214-D216 VanDerWaalsContact C-N 3.29Å; V214-D216 PolarHBondContact O-N 2.81Å; D216-G218 PolarHBondContact O-N 3.21Å
217	S	75.9	Confident	82.1	Confident	11 Å²	11	41.8 Å²	41.8	8%	0.077	23%	0.233	C	C	.	.			trans	-59.1	126.8	-174.7	59.3	0	0	0	0	112.2	K109 G209 V214 A215	K109-S217 PolarHBondContact NZ-O 3.08Å; G209-S217 VanDerWaalsContact O-CA 3.31Å; G209-S217 WeakPolarHBondContact O-CA 3.17Å; V214-S217 WeakPolarHBondContact O-CB 3.27Å; V214-S217 PolarHBondContact O-N 3.46Å; V214-S217 VanDerWaalsContact O-N 3.12Å; V214-S217 PolarHBondContact O-OG 3.01Å; A215-S217 VanDerWaalsContact C-N 3.29Å
218	G	77.7	Confident	81.6	Confident	8 Å²	8	45.6 Å²	45.6	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	166.7	176.3	0	0	0	0	0	111.4	F208 G209 D216	F208-G218 WeakPolarHBondContact CA-O 3.43Å; G209-G218 PolarHBondContact N-O 2.9Å; G209-G218 PolarHBondContact O-N 3.47Å; D216-G218 PolarHBondContact O-N 3.21Å
219	V	83.2	Confident	81.3	Confident	18 Å²	18	50.4 Å²	50.4	11%	0.109	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.1	173.8	-175.5	0	0	0	0	108.6	V106 L130 F191 F206 F208	V106-V219 HydrophobicContact CG2-CB 4.34Å; V106-V219 HydrophobicContact CG2-CG1 4.08Å; V106-V219 HydrophobicContact CG2-CG2 3.75Å; L130-V219 WeakPolarHBondContact CA-O 3.42Å; L130-V219 PolarHBondContact N-O 3.13Å; L130-V219 VanDerWaalsContact N-O 3.12Å; F191-V219 HydrophobicContact CZ-CG1 4Å; F206-V219 HydrophobicContact CB-CG1 3.44Å; F206-V219 VanDerWaalsContact CB-CG1 3.44Å; F206-V219 HydrophobicContact CD1-CG1 4.05Å; F206-V219 HydrophobicContact CD2-CG1 3.5Å; F206-V219 VanDerWaalsContact CD2-CG1 3.5Å; F206-V219 HydrophobicContact CE2-CG1 4.22Å; F206-V219 HydrophobicContact CG-CG1 3.4Å; F208-V219 HydrophobicContact CD1-CG2 3.47Å; F208-V219 VanDerWaalsContact CD1-CG2 3.47Å; F208-V219 HydrophobicContact CE1-CG2 3.08Å; F208-V219 HydrophobicContact CE2-CG2 4.29Å; F208-V219 HydrophobicContact CG-CG2 4.23Å; F208-V219 HydrophobicContact CZ-CG2 3.54Å
220	F	86.7	Confident	81.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.9	-171.5	-46.7	-67.6	0	0	0	109.9	Q128 L130 P132 Y167 L168 F206 R207	Q128-F220 HydrophobicContact CB-CE1 4.17Å; L130-F220 WeakPolarHBondContact O-CA 3.35Å; P132-F220 VanDerWaalsContact CA-CE1 3.46Å; P132-F220 HydrophobicContact CB-CD1 4.06Å; P132-F220 HydrophobicContact CB-CE1 4Å; P132-F220 HydrophobicContact CB-CG 4.37Å; P132-F220 HydrophobicContact CB-CZ 4.26Å; P132-F220 HydrophobicContact CG-CB 4.01Å; P132-F220 HydrophobicContact CG-CD1 3.66Å; P132-F220 HydrophobicContact CG-CD2 4.28Å; P132-F220 HydrophobicContact CG-CE1 4.14Å; P132-F220 HydrophobicContact CG-CG 3.72Å; P132-F220 VanDerWaalsContact N-CD1 3.29Å; Y167-F220 HydrophobicContact CE1-CB 4.13Å; Y167-F220 PolarHBondContact OH-O 2.89Å; L168-F220 HydrophobicContact CD2-CD2 3.4Å; L168-F220 HydrophobicContact CD2-CE2 3.58Å; L168-F220 HydrophobicContact CD2-CG 4.18Å; L168-F220 HydrophobicContact CD2-CZ 4.48Å; F206-F220 CarbonylContact C-O 3.53Å; F206-F220 WeakPolarHBondContact CA-O 3.42Å; R207-F220 PolarHBondContact N-O 3.32Å; R207-F220 PolarHBondContact O-N 3.27Å
221	G	89	Confident	81.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-166.4	177.3	0	0	0	0	0	111.6	Y167 Y175 L205	Y167-G221 WeakPolarHBondContact OH-CA 3.44Å; Y175-G221 PolarHBondContact OH-O 2.81Å; L205-G221 WeakPolarHBondContact O-CA 3.19Å
222	L	89.2	Confident	82.1	Confident	27 Å²	27	58.1 Å²	58.1	14%	0.141	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148.1	-166.6	-59.2	173.3	0	0	0	111.4	M171 I174 Y175 I186 F188 L205 T224	M171-L222 HydrophobicContact CE-CD1 4.08Å; M171-L222 HydrophobicContact CE-CG 4.21Å; M171-L222 HydrophobicContact SD-CD1 4.4Å; M171-L222 HydrophobicContact SD-CD2 4.24Å; M171-L222 HydrophobicContact SD-CG 3.99Å; I174-L222 HydrophobicContact CD1-CD1 4.45Å; I174-L222 HydrophobicContact CG2-CD2 4.13Å; Y175-L222 HydrophobicContact CE2-CD2 4.15Å; I186-L222 HydrophobicContact CD1-CD1 3.52Å; F188-L222 HydrophobicContact CE1-CD1 4.3Å; F188-L222 HydrophobicContact CZ-CB 4.27Å; F188-L222 HydrophobicContact CZ-CD1 4.45Å; L205-L222 PolarHBondContact N-O 3.42Å; L205-L222 PolarHBondContact O-N 3.12Å; L205-L222 VanDerWaalsContact O-N 3.16Å; L222-T224 PolarHBondContact O-N 3.33Å; L222-T224 PolarHBondContact O-OG1 3.4Å
223	M	86.4	Confident	82.7	Confident	63 Å²	63	60.2 Å²	60.2	31%	0.31	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130.8	163.2	-166.3	-163.2	-46.1	0	0	108.8	Y202 F204 F249	Y202-M223 HydrophobicContact CD1-SD 4.15Å; F204-M223 HydrophobicContact CD1-CB 4.02Å; F204-M223 HydrophobicContact CD1-CG 4.47Å; F204-M223 HydrophobicContact CE1-CB 3.62Å; F204-M223 HydrophobicContact CE1-CG 4.02Å; F204-M223 HydrophobicContact CZ-CB 4.16Å; F204-M223 HydrophobicContact CZ-CE 4.29Å; F204-M223 HydrophobicContact CZ-CG 4.06Å; M223-F249 HydrophobicContact CE-CB 3.56Å; M223-F249 HydrophobicContact CE-CD1 3.89Å; M223-F249 HydrophobicContact CE-CD2 3.1Å; M223-F249 HydrophobicContact CE-CE1 4.4Å; M223-F249 HydrophobicContact CE-CE2 3.74Å; M223-F249 HydrophobicContact CE-CG 3.21Å; M223-F249 HydrophobicContact CE-CZ 4.35Å; M223-F249 HydrophobicContact SD-CD2 4.15Å; M223-F249 HydrophobicContact SD-CE2 4.48Å
224	T	89.5	Confident	83.1	Confident	25 Å²	25	60.7 Å²	60.7	15%	0.153	35%	0.351	C	S	.	.			trans	-126.3	117.9	-172.3	-56.2	0	0	0	0	109.7	D203 L205 L222 L226 V240	D203-T224 PolarHBondContact O-N 2.94Å; L205-T224 WeakPolarHBondContact CB-OG1 3.45Å; L222-T224 PolarHBondContact O-N 3.33Å; L222-T224 PolarHBondContact O-OG1 3.4Å; T224-L226 HydrophobicContact CG2-CD2 3.76Å; T224-L226 HydrophobicContact CG2-CG 4.17Å; T224-L226 PolarHBondContact O-N 3.19Å; T224-L226 VanDerWaalsContact O-N 3.07Å; T224-V240 HydrophobicContact CG2-CG1 4.45Å
225	K	87.5	Confident	83.6	Confident	157 Å²	157	61 Å²	61	68%	0.683	35%	0.351	S	S	*	.			trans	-77.1	92.3	172.2	-69	-178.1	-178.6	174.3	0	109.3	D247	K225-D247 WeakPolarHBondContact CE-OD2 3.37Å; K225-D247 IonicContact NZ-OD2 2.7Å; K225-D247 PolarHBondContact NZ-OD2 3.17Å
226	L	88	Confident	84.5	Confident	31 Å²	31	60.3 Å²	60.3	16%	0.162	33%	0.333	C	S	.	.			trans	-75.5	155.2	176.6	-64.5	174.6	0	0	0	111.4	D203 T224 A228 L230 V232 L238 V240	D203-L226 HydrophobicContact CB-CD1 3.86Å; D203-L226 HydrophobicContact CB-CG 4.31Å; T224-L226 HydrophobicContact CG2-CD2 3.76Å; T224-L226 HydrophobicContact CG2-CG 4.17Å; T224-L226 PolarHBondContact O-N 3.19Å; T224-L226 VanDerWaalsContact O-N 3.07Å; L226-A228 PolarHBondContact O-N 2.87Å; L226-L230 HydrophobicContact CB-CD2 4.48Å; L226-L230 HydrophobicContact CD2-CD2 4.4Å; L226-V232 HydrophobicContact CD1-CB 4.48Å; L226-V232 HydrophobicContact CD1-CG1 3.84Å; L226-V232 HydrophobicContact CD1-CG2 3.95Å; L226-L238 HydrophobicContact CD1-CD1 4.21Å; L226-L238 HydrophobicContact CD2-CD1 4.24Å; L226-V240 HydrophobicContact CD2-CG1 4.36Å
227	P	86.6	Confident	85.5	Confident	79 Å²	79	65.4 Å²	65.4	51%	0.513	35%	0.349	S	S	.	.			trans	-56.4	137.1	174.3	-23.5	33.9	0	0	0	111.9	D229 L230	P227-D229 VanDerWaalsContact CB-OD1 3.28Å; P227-D229 WeakPolarHBondContact CB-OD1 3.33Å; P227-D229 PolarHBondContact O-N 3.32Å; P227-D229 VanDerWaalsContact O-N 3.16Å; P227-L230 HydrophobicContact CB-CB 4.3Å; P227-L230 VanDerWaalsContact O-CB 3.31Å; P227-L230 WeakPolarHBondContact O-CB 3.23Å; P227-L230 PolarHBondContact O-N 2.96Å
228	A	78.7	Confident	86.4	Confident	115 Å²	115	66.3 Å²	66.3	95%	0.95	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.8	-173.5	0	0	0	0	0	114.3	L226	L226-A228 PolarHBondContact O-N 2.87Å
229	D	80.8	Confident	87.2	Confident	144 Å²	144	71.2 Å²	71.2	77%	0.77	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-9.8	176.1	61.6	-42.7	0	0	0	113.3	P227 T231	P227-D229 VanDerWaalsContact CB-OD1 3.28Å; P227-D229 WeakPolarHBondContact CB-OD1 3.33Å; P227-D229 PolarHBondContact O-N 3.32Å; P227-D229 VanDerWaalsContact O-N 3.16Å; D229-T231 PolarHBondContact O-N 3.37Å
230	L	84.8	Confident	87.8	Confident	73 Å²	73	71.4 Å²	71.4	38%	0.382	38%	0.375	S	S	.	.			trans	-84.7	108.2	179.2	-170.7	68.9	0	0	0	110.6	L226 P227 V232	L226-L230 HydrophobicContact CB-CD2 4.48Å; L226-L230 HydrophobicContact CD2-CD2 4.4Å; P227-L230 HydrophobicContact CB-CB 4.3Å; P227-L230 VanDerWaalsContact O-CB 3.31Å; P227-L230 WeakPolarHBondContact O-CB 3.23Å; P227-L230 PolarHBondContact O-N 2.96Å; L230-V232 HydrophobicContact CD2-CG1 3.79Å; L230-V232 HydrophobicContact CG-CG1 3.84Å; L230-V232 PolarHBondContact O-N 2.83Å
231	T	82.6	Confident	88.2	Confident	124 Å²	124	77.3 Å²	77.3	76%	0.761	40%	0.402	S	S	*	.			trans	-84.2	115.1	169.4	-51.9	0	0	0	0	109.8	D229	D229-T231 PolarHBondContact O-N 3.37Å
232	V	85.8	Confident	88.4	Confident	6 Å²	6	79 Å²	79	4%	0.036	42%	0.42	C	S	.	.			trans	-110	159.3	177.5	-66.4	0	0	0	0	111.6	V192 L226 L230 L238	V192-V232 HydrophobicContact CG1-CB 4.09Å; V192-V232 HydrophobicContact CG1-CG2 3.75Å; V192-V232 HydrophobicContact CG2-CB 4.21Å; V192-V232 HydrophobicContact CG2-CG1 4.39Å; L226-V232 HydrophobicContact CD1-CB 4.48Å; L226-V232 HydrophobicContact CD1-CG1 3.84Å; L226-V232 HydrophobicContact CD1-CG2 3.95Å; L230-V232 HydrophobicContact CD2-CG1 3.79Å; L230-V232 HydrophobicContact CG-CG1 3.84Å; L230-V232 PolarHBondContact O-N 2.83Å; V232-L238 HydrophobicContact CG1-CD1 3.95Å
233	K	86.5	Confident	88.7	Confident	159 Å²	159	81.8 Å²	81.8	69%	0.691	44%	0.438	S	S	*	.			trans	-123	150.4	174.9	-63.8	-178.8	-179.2	179.4	0	110.6	N235 Q236	K233-N235 PolarHBondContact O-N 3.04Å; K233-Q236 WeakPolarHBondContact O-CB 3.36Å; K233-Q236 PolarHBondContact O-N 2.99Å
234	N	86.1	Confident	88.8	Confident	53 Å²	53	79.7 Å²	79.7	28%	0.283	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	139.2	169.8	-78.7	0.2	0	0	0	111.1	T103 V192 E194 Q236	T103-N234 HydrophobicContact CG2-CB 4.04Å; V192-N234 WeakPolarHBondContact O-CA 3.38Å; E194-N234 WeakPolarHBondContact CB-OD1 3.26Å; E194-N234 PolarHBondContact N-OD1 3.03Å; N234-Q236 PolarHBondContact O-N 3.41Å
235	N	86.7	Confident	88.5	Confident	64 Å²	64	83 Å²	83	34%	0.342	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	1	-173.9	-52.6	-67.6	0	0	0	116	D102 T103 V192 K233 W237	D102-N235 WeakPolarHBondContact CB-OD1 3.33Å; T103-N235 VanDerWaalsContact CG2-OD1 3.27Å; T103-N235 WeakPolarHBondContact CG2-OD1 3.23Å; T103-N235 PolarHBondContact N-OD1 3.47Å; T103-N235 PolarHBondContact OG1-ND2 3.19Å; T103-N235 PolarHBondContact OG1-OD1 3.14Å; V192-N235 PolarHBondContact O-N 3.41Å; K233-N235 PolarHBondContact O-N 3.04Å; N235-W237 PolarHBondContact O-N 3.3Å
236	Q	91.4	Very high	87.8	Confident	73 Å²	73	80 Å²	80	34%	0.341	44%	0.439	S	S	.	.			trans	-70.8	121	173.1	-176.1	174.9	-10.9	0	0	109.7	F191 V192 K233 N234 L238	F191-Q236 CarbonylContact C-O 3.53Å; F191-Q236 WeakPolarHBondContact CA-O 3.4Å; V192-Q236 WeakPolarHBondContact CG2-O 3.44Å; V192-Q236 PolarHBondContact N-O 3.23Å; K233-Q236 WeakPolarHBondContact O-CB 3.36Å; K233-Q236 PolarHBondContact O-N 2.99Å; N234-Q236 PolarHBondContact O-N 3.41Å; Q236-L238 HydrophobicContact CG-CD2 4.12Å
237	W	93.2	Very high	86.7	Confident	143 Å²	143	83 Å²	83	54%	0.542	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.2	174.2	-77.4	78.4	0	0	0	110.9	N189 G190 F191 R207 N235	N189-W237 HydrophobicContact CB-CE3 4.45Å; N189-W237 HydrophobicContact CB-CZ3 4.46Å; G190-W237 VanDerWaalsContact C-CE3 3.46Å; G190-W237 CarbonylContact O-C 3.54Å; G190-W237 VanDerWaalsContact O-CA 3.31Å; G190-W237 WeakPolarHBondContact O-CA 3.36Å; F191-W237 HydrophobicContact CB-CD2 4.13Å; F191-W237 HydrophobicContact CB-CG 4.26Å; F191-W237 HydrophobicContact CB-CZ2 4.34Å; F191-W237 HydrophobicContact CD1-CH2 4.28Å; F191-W237 AromaticContact CD1-CZ2 3.86Å; F191-W237 HydrophobicContact CD1-CZ2 3.86Å; R207-W237 HydrophobicContact CG-CH2 4.15Å; R207-W237 HydrophobicContact CG-CZ3 4.14Å; N235-W237 PolarHBondContact O-N 3.3Å
238	L	93.9	Very high	85.4	Confident	30 Å²	30	84.6 Å²	84.6	16%	0.157	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145	176.4	-58.6	176.9	0	0	0	109.8	N189 G190 V192 L205 L226 V232 Q236 V240	N189-L238 WeakPolarHBondContact CA-O 3.31Å; G190-L238 PolarHBondContact N-O 2.92Å; G190-L238 VanDerWaalsContact N-O 3.07Å; G190-L238 PolarHBondContact O-N 3.47Å; V192-L238 HydrophobicContact CG2-CD1 3.45Å; V192-L238 VanDerWaalsContact CG2-CD1 3.45Å; V192-L238 HydrophobicContact CG2-CG 3.94Å; L205-L238 HydrophobicContact CD1-CB 4.07Å; L205-L238 HydrophobicContact CD1-CD1 4.39Å; L205-L238 HydrophobicContact CD1-CG 4.49Å; L226-L238 HydrophobicContact CD1-CD1 4.21Å; L226-L238 HydrophobicContact CD2-CD1 4.24Å; V232-L238 HydrophobicContact CG1-CD1 3.95Å; Q236-L238 HydrophobicContact CG-CD2 4.12Å; L238-V240 HydrophobicContact CB-CG1 4.14Å
239	H	95.6	Very high	84.1	Confident	111 Å²	111	80.2 Å²	80.2	51%	0.514	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.2	159.1	-174	72.8	0	0	0	107.5	N189	N189-H239 WeakPolarHBondContact OD1-CA 3.15Å; N189-H239 VanDerWaalsContact OD1-CB 3.26Å; N189-H239 WeakPolarHBondContact OD1-CB 3.22Å; N189-H239 PolarHBondContact OD1-ND1 3.27Å
240	V	94.3	Very high	82.6	Confident	22 Å²	22	77.7 Å²	77.7	13%	0.133	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.1	179.1	-60.1	0	0	0	0	109.8	S187 F188 L205 T224 L226 L238	S187-V240 CarbonylContact C-O 3.51Å; S187-V240 WeakPolarHBondContact CA-O 3.18Å; F188-V240 HydrophobicContact CD1-CG2 3.65Å; F188-V240 HydrophobicContact CE1-CG2 3.5Å; F188-V240 VanDerWaalsContact CE1-CG2 3.5Å; F188-V240 HydrophobicContact CG-CG2 4.29Å; F188-V240 HydrophobicContact CZ-CG2 4.06Å; F188-V240 PolarHBondContact N-O 2.98Å; F188-V240 PolarHBondContact O-N 3.42Å; L205-V240 HydrophobicContact CD2-CB 4.1Å; L205-V240 HydrophobicContact CD2-CG1 3.6Å; L205-V240 HydrophobicContact CD2-CG2 3.36Å; T224-V240 HydrophobicContact CG2-CG1 4.45Å; L226-V240 HydrophobicContact CD2-CG1 4.36Å; L238-V240 HydrophobicContact CB-CG1 4.14Å
241	E	96	Very high	80.8	Confident	124 Å²	124	76 Å²	76	58%	0.579	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.1	165.3	-175.7	179.3	175.7	0	0	107.2	K159 T185 I186	K159-E241 IonicContact NZ-OE1 3.05Å; K159-E241 PolarHBondContact NZ-OE1 3.1Å; T185-E241 HydrophobicContact CG2-CG 3.64Å; I186-E241 VanDerWaalsContact O-CA 3.32Å; I186-E241 WeakPolarHBondContact O-CA 3.19Å
242	G	94.1	Very high	79	Confident	36 Å²	36	75 Å²	75	37%	0.371	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	168	-176.2	0	0	0	0	0	112.7	T185 I186	T185-G242 CarbonylContact C-O 3.53Å; T185-G242 WeakPolarHBondContact CA-O 3.44Å; I186-G242 PolarHBondContact N-O 3.44Å; I186-G242 PolarHBondContact O-N 3.46Å
243	T	94.2	Very high	76.9	Confident	85 Å²	85	77.9 Å²	77.9	52%	0.521	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.3	178.3	-54.4	0	0	0	0	110.2	K184 T245	K184-T243 WeakPolarHBondContact O-CA 3.49Å; T243-T245 PolarHBondContact O-N 3.23Å
244	I	89.3	Confident	74.8	Confident	19 Å²	19	75.3 Å²	75.3	10%	0.097	38%	0.382	C	S	.	.			trans	-68	126.1	173.6	-65.4	173.9	0	0	0	108.9	I174 F181 V182 G183 K184 I186	I174-I244 HydrophobicContact CD1-CD1 3.87Å; I174-I244 HydrophobicContact CG1-CD1 4.16Å; I174-I244 HydrophobicContact CG2-CD1 4.48Å; F181-I244 HydrophobicContact CB-CD1 3.8Å; V182-I244 HydrophobicContact CG2-CG2 4.48Å; G183-I244 PolarHBondContact N-O 3.26Å; K184-I244 PolarHBondContact O-N 2.88Å; I186-I244 HydrophobicContact CD1-CD1 3.92Å; I186-I244 HydrophobicContact CD1-CG1 3.78Å; I186-I244 HydrophobicContact CG1-CD1 4.21Å; I186-I244 HydrophobicContact CG1-CG1 3.89Å; I186-I244 HydrophobicContact CG2-CD1 3.53Å; I186-I244 HydrophobicContact CG2-CG1 4Å
245	T	82.4	Confident	72.9	Confident	94 Å²	94	77.8 Å²	77.8	58%	0.577	40%	0.395	S	S	*	.			trans	-121.6	147.8	169.1	59	0	0	0	0	109	T243	T243-T245 PolarHBondContact O-N 3.23Å
246	L	73.6	Confident	71.1	Confident	95 Å²	95	79.2 Å²	79.2	50%	0.497	40%	0.403	S	S	.	.			trans	-83	125.2	163.4	-83.9	159.6	0	0	0	107.8	P178 V182	P178-L246 HydrophobicContact CB-CD1 4.43Å; P178-L246 HydrophobicContact CB-CD2 3.95Å; P178-L246 HydrophobicContact CB-CG 4.42Å; P178-L246 HydrophobicContact CG-CD2 4.42Å; V182-L246 HydrophobicContact CG2-CB 4.33Å; V182-L246 HydrophobicContact CG2-CD1 3.43Å; V182-L246 VanDerWaalsContact CG2-CD1 3.43Å; V182-L246 HydrophobicContact CG2-CG 3.57Å
247	D	65.1	Low	69.4	Low	93 Å²	93	79.1 Å²	79.1	50%	0.497	42%	0.415	S	S	.	.			trans	-128.2	149.4	170.4	-150.7	-16.7	0	0	0	108.6	K225	K225-D247 WeakPolarHBondContact CE-OD2 3.37Å; K225-D247 IonicContact NZ-OD2 2.7Å; K225-D247 PolarHBondContact NZ-OD2 3.17Å
248	F	57.3	Low	67.9	Low	114 Å²	114	74.4 Å²	74.4	50%	0.5	40%	0.402	S	S	.	.			trans	-80	126.9	171.9	-177.2	-103.8	0	0	0	108.2	E250 D253	F248-E250 HydrophobicContact CD1-CG 4.42Å; F248-E250 HydrophobicContact CE1-CG 4.28Å; F248-D253 HydrophobicContact CE1-CB 4.5Å; F248-D253 WeakPolarHBondContact CZ-OD1 3.17Å
249	F	53.1	Low	66.7	Low	22 Å²	22	74.6 Å²	74.6	10%	0.096	40%	0.403	C	S	.	.			trans	-103.2	115.7	176.7	-169.6	-138.1	0	0	0	109	F111 Y202 F204 M223 P251 F252	F111-F249 AromaticContact CE1-CE1 3.83Å; F111-F249 HydrophobicContact CE1-CE1 3.83Å; F111-F249 HydrophobicContact CE1-CZ 4.22Å; F111-F249 HydrophobicContact CZ-CE1 4.25Å; Y202-F249 AromaticContact CD1-CD2 3.98Å; Y202-F249 HydrophobicContact CD1-CD2 3.98Å; Y202-F249 AromaticContact CD1-CE2 3.4Å; Y202-F249 HydrophobicContact CD1-CE2 3.4Å; Y202-F249 HydrophobicContact CD1-CZ 4.44Å; Y202-F249 AromaticContact CD2-CE2 3.73Å; Y202-F249 HydrophobicContact CD2-CE2 3.73Å; Y202-F249 HydrophobicContact CD2-CZ 4.22Å; Y202-F249 AromaticContact CE1-CD2 3.87Å; Y202-F249 HydrophobicContact CE1-CD2 3.87Å; Y202-F249 AromaticContact CE1-CE2 3.55Å; Y202-F249 HydrophobicContact CE1-CE2 3.55Å; Y202-F249 AromaticContact CE2-CE2 3.86Å; Y202-F249 HydrophobicContact CE2-CE2 3.86Å; Y202-F249 HydrophobicContact CG-CD2 4.46Å; Y202-F249 AromaticContact CG-CE2 3.46Å; Y202-F249 HydrophobicContact CG-CE2 3.46Å; Y202-F249 VanDerWaalsContact CG-CE2 3.46Å; Y202-F249 HydrophobicContact CG-CZ 4.11Å; Y202-F249 AromaticContact CZ-CE2 3.76Å; F204-F249 HydrophobicContact CE1-CE1 4.37Å; F204-F249 HydrophobicContact CE2-CE1 4.21Å; F204-F249 AromaticContact CE2-CZ 3.8Å; F204-F249 HydrophobicContact CE2-CZ 3.8Å; F204-F249 HydrophobicContact CZ-CD1 4.24Å; F204-F249 AromaticContact CZ-CE1 3.45Å; F204-F249 HydrophobicContact CZ-CE1 3.45Å; F204-F249 VanDerWaalsContact CZ-CE1 3.45Å; F204-F249 HydrophobicContact CZ-CE2 4.14Å; F204-F249 AromaticContact CZ-CZ 3.41Å; F204-F249 HydrophobicContact CZ-CZ 3.41Å; F204-F249 VanDerWaalsContact CZ-CZ 3.41Å; M223-F249 HydrophobicContact CE-CB 3.56Å; M223-F249 HydrophobicContact CE-CD1 3.89Å; M223-F249 HydrophobicContact CE-CD2 3.1Å; M223-F249 HydrophobicContact CE-CE1 4.4Å; M223-F249 HydrophobicContact CE-CE2 3.74Å; M223-F249 HydrophobicContact CE-CG 3.21Å; M223-F249 HydrophobicContact CE-CZ 4.35Å; M223-F249 HydrophobicContact SD-CD2 4.15Å; M223-F249 HydrophobicContact SD-CE2 4.48Å; F249-P251 HydrophobicContact CD1-CG 3.21Å; F249-P251 HydrophobicContact CD2-CG 4.09Å; F249-P251 HydrophobicContact CE1-CB 4.35Å; F249-P251 VanDerWaalsContact CE1-CD 3.41Å; F249-P251 HydrophobicContact CE1-CG 2.92Å; F249-P251 HydrophobicContact CE2-CG 3.84Å; F249-P251 HydrophobicContact CG-CG 3.79Å; F249-P251 HydrophobicContact CZ-CG 3.27Å; F249-P251 VanDerWaalsContact O-CD 3.24Å; F249-P251 WeakPolarHBondContact O-CD 3.31Å; F249-F252 HydrophobicContact CB-CD2 4.33Å; F249-F252 HydrophobicContact CD1-CE2 4.26Å; F249-F252 WeakPolarHBondContact O-CD2 3.31Å; F249-F252 PolarHBondContact O-N 3.37Å
250	E	49	Very low	65.8	Low	91 Å²	91	72.1 Å²	72.1	43%	0.425	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-61.9	-14.1	-175.8	-84.3	179.4	-178.2	0	0	117.8	F248 F252 D253	F248-E250 HydrophobicContact CD1-CG 4.42Å; F248-E250 HydrophobicContact CE1-CG 4.28Å; E250-F252 PolarHBondContact O-N 3.09Å; E250-D253 WeakPolarHBondContact O-CB 3.21Å; E250-D253 PolarHBondContact O-N 3.32Å
251	P	47.1	Very low	64.8	Low	39 Å²	39	73.5 Å²	73.5	25%	0.253	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-69	-1.8	170.7	23.8	-20.7	0	0	0	112.9	K197 F249	K197-P251 HydrophobicContact CD-CB 4.05Å; F249-P251 HydrophobicContact CD1-CG 3.21Å; F249-P251 HydrophobicContact CD2-CG 4.09Å; F249-P251 HydrophobicContact CE1-CB 4.35Å; F249-P251 VanDerWaalsContact CE1-CD 3.41Å; F249-P251 HydrophobicContact CE1-CG 2.92Å; F249-P251 HydrophobicContact CE2-CG 3.84Å; F249-P251 HydrophobicContact CG-CG 3.79Å; F249-P251 HydrophobicContact CZ-CG 3.27Å; F249-P251 VanDerWaalsContact O-CD 3.24Å; F249-P251 WeakPolarHBondContact O-CD 3.31Å
252	F	44.3	Very low	63.8	Low	102 Å²	102	69.8 Å²	69.8	45%	0.447	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-94.5	-5.2	165.1	-60.2	-69.4	0	0	0	114.6	F113 F249 E250 Q254	F113-F252 AromaticContact CD2-CE1 3.67Å; F113-F252 HydrophobicContact CD2-CE1 3.67Å; F113-F252 HydrophobicContact CD2-CZ 4.1Å; F113-F252 HydrophobicContact CE1-CE1 4.21Å; F113-F252 HydrophobicContact CE2-CD1 4.32Å; F113-F252 AromaticContact CE2-CE1 3.16Å; F113-F252 HydrophobicContact CE2-CE1 3.16Å; F113-F252 HydrophobicContact CE2-CE2 4.32Å; F113-F252 AromaticContact CE2-CZ 3.17Å; F113-F252 HydrophobicContact CE2-CZ 3.17Å; F113-F252 HydrophobicContact CG-CE1 4.41Å; F113-F252 AromaticContact CZ-CE1 3.47Å; F113-F252 HydrophobicContact CZ-CE1 3.47Å; F113-F252 VanDerWaalsContact CZ-CE1 3.47Å; F113-F252 AromaticContact CZ-CZ 3.43Å; F113-F252 HydrophobicContact CZ-CZ 3.43Å; F113-F252 VanDerWaalsContact CZ-CZ 3.43Å; F249-F252 HydrophobicContact CB-CD2 4.33Å; F249-F252 HydrophobicContact CD1-CE2 4.26Å; F249-F252 WeakPolarHBondContact O-CD2 3.31Å; F249-F252 PolarHBondContact O-N 3.37Å; E250-F252 PolarHBondContact O-N 3.09Å; F252-Q254 PolarHBondContact O-N 2.9Å
253	D	41.3	Very low	63.3	Low	66 Å²	66	69.1 Å²	69.1	35%	0.353	38%	0.379	S	S	.	.			trans	-69.7	80.8	165	-101	-7.7	0	0	0	108	F248 E250 D255	F248-D253 HydrophobicContact CE1-CB 4.5Å; F248-D253 WeakPolarHBondContact CZ-OD1 3.17Å; E250-D253 WeakPolarHBondContact O-CB 3.21Å; E250-D253 PolarHBondContact O-N 3.32Å; D253-D255 PolarHBondContact O-N 3.05Å
254	Q	42.1	Very low	62.7	Low	106 Å²	106	68 Å²	68	50%	0.495	37%	0.368	S	S	.	.				-52.6	109.6	123	-81.1	-170.2	-8.7	0	0	104.1	F252 D256 T258 I259	F252-Q254 PolarHBondContact O-N 2.9Å; Q254-D256 PolarHBondContact O-N 3.25Å; Q254-T258 HydrophobicContact CB-CG2 3.72Å; Q254-T258 HydrophobicContact CG-CG2 3.8Å; Q254-I259 HydrophobicContact CB-CG1 4.12Å
255	D	46.8	Very low	62.1	Low	105 Å²	105	72.9 Å²	72.9	56%	0.561	39%	0.39	S	S	*	.			trans	-33.3	140.2	177.7	-71.5	-48.1	0	0	0	108.8	D253 A257 T258 I259	D253-D255 PolarHBondContact O-N 3.05Å; D255-A257 HydrophobicContact CB-CB 4.07Å; D255-A257 CarbonylContact O-C 3.57Å; D255-A257 PolarHBondContact O-N 3.12Å; D255-T258 CarbonylContact O-C 3.59Å; D255-T258 WeakPolarHBondContact O-CA 3.47Å; D255-T258 WeakPolarHBondContact O-CB 3.38Å; D255-T258 PolarHBondContact O-N 3.43Å; D255-I259 PolarHBondContact O-N 3.43Å
256	D	49.6	Very low	61.9	Low	93 Å²	93	70 Å²	70	50%	0.497	37%	0.371	S	S	.	.	H	α-helix	trans	-52	-27.1	174.3	-95	-32.3	0	0	0	110.8	Q254 I259 V260 K330	Q254-D256 PolarHBondContact O-N 3.25Å; D256-I259 PolarHBondContact O-N 3.15Å; D256-V260 WeakPolarHBondContact O-CB 3.32Å; D256-V260 WeakPolarHBondContact O-CG2 3.49Å; D256-V260 PolarHBondContact O-N 3.18Å; D256-K330 IonicContact OD1-NZ 3.65Å; D256-K330 PolarHBondContact OD1-NZ 3.17Å
257	A	54.5	Low	62.2	Low	72 Å²	72	66.5 Å²	66.5	60%	0.595	35%	0.352	S	S	*	.	H	α-helix	trans	-59.2	-41.2	166.3	0	0	0	0	0	114.5	D255 S261	D255-A257 HydrophobicContact CB-CB 4.07Å; D255-A257 CarbonylContact O-C 3.57Å; D255-A257 PolarHBondContact O-N 3.12Å; A257-S261 VanDerWaalsContact O-CB 3.32Å; A257-S261 WeakPolarHBondContact O-CB 3.48Å; A257-S261 PolarHBondContact O-N 3.49Å; A257-S261 PolarHBondContact O-OG 3.49Å
258	T	61.9	Low	62.7	Low	44 Å²	44	65.5 Å²	65.5	27%	0.27	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-47.2	170.2	-53.1	0	0	0	0	111.6	Q254 D255 V260 S261 V262	Q254-T258 HydrophobicContact CB-CG2 3.72Å; Q254-T258 HydrophobicContact CG-CG2 3.8Å; D255-T258 CarbonylContact O-C 3.59Å; D255-T258 WeakPolarHBondContact O-CA 3.47Å; D255-T258 WeakPolarHBondContact O-CB 3.38Å; D255-T258 PolarHBondContact O-N 3.43Å; T258-V260 VanDerWaalsContact C-N 3.34Å; T258-V260 PolarHBondContact O-N 2.84Å; T258-S261 VanDerWaalsContact CA-OG 3.31Å; T258-S261 WeakPolarHBondContact CA-OG 3.36Å; T258-S261 PolarHBondContact O-N 3.22Å; T258-S261 PolarHBondContact O-OG 3.37Å; T258-V262 HydrophobicContact CG2-CG2 4.12Å; T258-V262 VanDerWaalsContact O-CB 3.31Å; T258-V262 WeakPolarHBondContact O-CB 3.35Å; T258-V262 WeakPolarHBondContact O-CG2 3.48Å; T258-V262 PolarHBondContact O-N 2.83Å
259	I	69.2	Low	63.2	Low	34 Å²	34	64.9 Å²	64.9	17%	0.174	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-46.4	178	-68.1	174.3	0	0	0	110.4	Q254 D255 D256 V262 I263 F332	Q254-I259 HydrophobicContact CB-CG1 4.12Å; D255-I259 PolarHBondContact O-N 3.43Å; D256-I259 PolarHBondContact O-N 3.15Å; I259-V262 PolarHBondContact O-N 2.66Å; I259-I263 HydrophobicContact CG2-CD1 3.66Å; I259-I263 HydrophobicContact CG2-CG1 4.3Å; I259-I263 WeakPolarHBondContact O-CB 3.35Å; I259-I263 WeakPolarHBondContact O-CG1 3.41Å; I259-I263 PolarHBondContact O-N 3.32Å; I259-F332 HydrophobicContact CG2-CZ 4.47Å
260	V	76.4	Confident	63.6	Low	59 Å²	59	67.2 Å²	67.2	36%	0.358	36%	0.356	S	S	.	.	H	α-helix	trans	-61.5	-45.6	178.9	171.3	0	0	0	0	111	D256 T258 I263 Q264 I276	D256-V260 WeakPolarHBondContact O-CB 3.32Å; D256-V260 WeakPolarHBondContact O-CG2 3.49Å; D256-V260 PolarHBondContact O-N 3.18Å; T258-V260 VanDerWaalsContact C-N 3.34Å; T258-V260 PolarHBondContact O-N 2.84Å; V260-I263 PolarHBondContact O-N 3.03Å; V260-Q264 WeakPolarHBondContact O-CB 3.48Å; V260-Q264 PolarHBondContact O-N 3.23Å; V260-I276 HydrophobicContact CG1-CB 4.23Å; V260-I276 HydrophobicContact CG1-CD1 3.61Å; V260-I276 HydrophobicContact CG1-CG1 3.6Å; V260-I276 HydrophobicContact CG1-CG2 3.6Å
261	S	73.5	Confident	64.4	Low	51 Å²	51	65.2 Å²	65.2	36%	0.357	36%	0.36	S	S	.	.	H	α-helix	trans	-67	-36.6	176.9	56.3	0	0	0	0	113.1	A257 T258 Q264 Q265	A257-S261 VanDerWaalsContact O-CB 3.32Å; A257-S261 WeakPolarHBondContact O-CB 3.48Å; A257-S261 PolarHBondContact O-N 3.49Å; A257-S261 PolarHBondContact O-OG 3.49Å; T258-S261 VanDerWaalsContact CA-OG 3.31Å; T258-S261 WeakPolarHBondContact CA-OG 3.36Å; T258-S261 PolarHBondContact O-N 3.22Å; T258-S261 PolarHBondContact O-OG 3.37Å; S261-Q264 PolarHBondContact O-N 3.21Å; S261-Q265 WeakPolarHBondContact O-CB 3.5Å; S261-Q265 PolarHBondContact O-N 2.98Å
262	V	75	Confident	65.7	Low	45 Å²	45	65 Å²	65	27%	0.273	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-43.7	174.1	168	0	0	0	0	110.7	T258 I259 H266 L334	T258-V262 HydrophobicContact CG2-CG2 4.12Å; T258-V262 VanDerWaalsContact O-CB 3.31Å; T258-V262 WeakPolarHBondContact O-CB 3.35Å; T258-V262 WeakPolarHBondContact O-CG2 3.48Å; T258-V262 PolarHBondContact O-N 2.83Å; I259-V262 PolarHBondContact O-N 2.66Å; V262-H266 VanDerWaalsContact O-CB 3.29Å; V262-H266 WeakPolarHBondContact O-CB 3.46Å; V262-H266 PolarHBondContact O-N 3.13Å; V262-L334 HydrophobicContact CG1-CD1 3.71Å; V262-L334 HydrophobicContact CG1-CD2 4.3Å
263	I	83.3	Confident	67	Low	23 Å²	23	67.4 Å²	67.4	12%	0.118	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-51.1	175	-67.3	166.2	0	0	0	109.9	I259 V260 Q265 H266 L267 L307 F332 L334 L337	I259-I263 HydrophobicContact CG2-CD1 3.66Å; I259-I263 HydrophobicContact CG2-CG1 4.3Å; I259-I263 WeakPolarHBondContact O-CB 3.35Å; I259-I263 WeakPolarHBondContact O-CG1 3.41Å; I259-I263 PolarHBondContact O-N 3.32Å; V260-I263 PolarHBondContact O-N 3.03Å; I263-Q265 PolarHBondContact O-N 3.38Å; I263-H266 PolarHBondContact O-N 3.28Å; I263-H266 VanDerWaalsContact O-N 3.16Å; I263-L267 HydrophobicContact CG2-CD1 3.63Å; I263-L267 HydrophobicContact CG2-CG 4.05Å; I263-L267 WeakPolarHBondContact O-CB 3.29Å; I263-L267 VanDerWaalsContact O-CG 3.28Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.1Å; I263-L307 HydrophobicContact CD1-CD1 3.67Å; I263-F332 HydrophobicContact CD1-CE2 4.3Å; I263-F332 HydrophobicContact CD1-CZ 3.88Å; I263-F332 HydrophobicContact CG1-CE2 4.47Å; I263-F332 HydrophobicContact CG1-CZ 4.5Å; I263-L334 HydrophobicContact CG1-CD2 3.98Å; I263-L337 HydrophobicContact CD1-CD2 4.14Å; I263-L337 HydrophobicContact CG1-CD2 4.02Å; I263-L337 HydrophobicContact CG2-CD2 4.05Å
264	Q	81.9	Confident	68.8	Low	62 Å²	62	65.4 Å²	65.4	29%	0.29	37%	0.365	S	S	.	.	H	α-helix	trans	-55.7	-52.3	179	-173.1	-169.7	35.2	0	0	110.3	V260 S261 H266 L267 T268 C274 I276	V260-Q264 WeakPolarHBondContact O-CB 3.48Å; V260-Q264 PolarHBondContact O-N 3.23Å; S261-Q264 PolarHBondContact O-N 3.21Å; Q264-H266 VanDerWaalsContact C-N 3.29Å; Q264-H266 PolarHBondContact O-N 2.93Å; Q264-L267 PolarHBondContact O-N 3.23Å; Q264-T268 WeakPolarHBondContact O-CB 3.4Å; Q264-T268 PolarHBondContact O-N 2.94Å; Q264-T268 PolarHBondContact O-OG1 3.36Å; Q264-C274 HydrophobicContact CG-CB 3.77Å; Q264-C274 PolarHBondContact NE2-O 2.96Å; Q264-I276 HydrophobicContact CB-CD1 4.16Å; Q264-I276 HydrophobicContact CB-CG1 4.39Å; Q264-I276 VanDerWaalsContact CD-CD1 3.45Å; Q264-I276 HydrophobicContact CG-CD1 4.3Å; Q264-I276 HydrophobicContact CG-CG1 4.38Å
265	Q	77.6	Confident	70.6	Confident	120 Å²	120	68.7 Å²	68.7	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-56.6	-43.8	178.4	-176.9	-179.6	-4	0	0	111.5	S261 I263 Q269	S261-Q265 WeakPolarHBondContact O-CB 3.5Å; S261-Q265 PolarHBondContact O-N 2.98Å; I263-Q265 PolarHBondContact O-N 3.38Å; Q265-Q269 WeakPolarHBondContact O-CB 3.28Å; Q265-Q269 WeakPolarHBondContact O-CG 3.47Å; Q265-Q269 PolarHBondContact O-N 2.82Å
266	H	76.8	Confident	72	Confident	35 Å²	35	66.4 Å²	66.4	16%	0.162	37%	0.367	C	S	.	.	H	α-helix	trans	-66.5	-45.7	178.9	-166.9	57.6	0	0	0	112.1	V262 I263 Q264 Q269 W270 L334	V262-H266 VanDerWaalsContact O-CB 3.29Å; V262-H266 WeakPolarHBondContact O-CB 3.46Å; V262-H266 PolarHBondContact O-N 3.13Å; I263-H266 PolarHBondContact O-N 3.28Å; I263-H266 VanDerWaalsContact O-N 3.16Å; Q264-H266 VanDerWaalsContact C-N 3.29Å; Q264-H266 PolarHBondContact O-N 2.93Å; H266-Q269 WeakPolarHBondContact O-CB 3.39Å; H266-Q269 PolarHBondContact O-N 3.45Å; H266-W270 AromaticContact CE1-CD1 3.99Å; H266-W270 AromaticContact CE1-NE1 3.58Å; H266-W270 AromaticContact NE2-NE1 3.74Å; H266-W270 VanDerWaalsContact O-CD1 3.27Å; H266-W270 PolarHBondContact O-N 3.3Å; H266-L334 HydrophobicContact CB-CD1 4.36Å
267	L	79.9	Confident	73.1	Confident	20 Å²	20	64.3 Å²	64.3	11%	0.105	36%	0.363	C	S	.	.	H	α-helix	trans	-67.2	-42	179.8	-64.7	-180	0	0	0	111.8	I263 Q264 Q269 W270 G271 L272 C274 L338 I341	I263-L267 HydrophobicContact CG2-CD1 3.63Å; I263-L267 HydrophobicContact CG2-CG 4.05Å; I263-L267 WeakPolarHBondContact O-CB 3.29Å; I263-L267 VanDerWaalsContact O-CG 3.28Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.1Å; Q264-L267 PolarHBondContact O-N 3.23Å; L267-Q269 VanDerWaalsContact C-N 3.32Å; L267-Q269 PolarHBondContact O-N 3.45Å; L267-W270 CarbonylContact O-C 3.55Å; L267-W270 WeakPolarHBondContact O-CA 3.47Å; L267-W270 PolarHBondContact O-N 2.95Å; L267-G271 PolarHBondContact O-N 2.87Å; L267-L272 HydrophobicContact CB-CB 4.27Å; L267-L272 HydrophobicContact CB-CD1 4.17Å; L267-L272 HydrophobicContact CD2-CD1 3.89Å; L267-L272 WeakPolarHBondContact O-CB 3.25Å; L267-L272 PolarHBondContact O-N 2.91Å; L267-C274 WeakPolarHBondContact CB-SG 3.32Å; L267-L338 HydrophobicContact CD2-CD1 3.83Å; L267-I341 HydrophobicContact CD1-CD1 3.87Å; L267-I341 HydrophobicContact CD2-CD1 3.68Å; L267-I341 HydrophobicContact CG-CD1 4.43Å
268	T	75.5	Confident	73.7	Confident	73 Å²	73	67.8 Å²	67.8	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.4	-57.3	0	0	0	0	112	Q264 W270 G271 L272	Q264-T268 WeakPolarHBondContact O-CB 3.4Å; Q264-T268 PolarHBondContact O-N 2.94Å; Q264-T268 PolarHBondContact O-OG1 3.36Å; T268-W270 PolarHBondContact O-N 3.29Å; T268-G271 PolarHBondContact O-N 2.9Å; T268-L272 WeakPolarHBondContact CA-O 3.34Å
269	Q	68.1	Low	74	Confident	100 Å²	100	68.7 Å²	68.7	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-56.4	-37.5	170.4	-78.7	170.5	3.5	0	0	111.3	Q265 H266 L267 G271 P382	Q265-Q269 WeakPolarHBondContact O-CB 3.28Å; Q265-Q269 WeakPolarHBondContact O-CG 3.47Å; Q265-Q269 PolarHBondContact O-N 2.82Å; H266-Q269 WeakPolarHBondContact O-CB 3.39Å; H266-Q269 PolarHBondContact O-N 3.45Å; L267-Q269 VanDerWaalsContact C-N 3.32Å; L267-Q269 PolarHBondContact O-N 3.45Å; Q269-G271 PolarHBondContact O-N 3.5Å; Q269-P382 WeakPolarHBondContact O-CA 3.36Å; Q269-P382 WeakPolarHBondContact O-CB 3.4Å; Q269-P382 WeakPolarHBondContact O-CG 3.49Å
270	W	61.8	Low	73.8	Confident	72 Å²	72	76.1 Å²	76.1	27%	0.273	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	11.6	177.4	-77.9	96.7	0	0	0	115.2	H266 L267 T268 L272 L338 N369 P382	H266-W270 AromaticContact CE1-CD1 3.99Å; H266-W270 AromaticContact CE1-NE1 3.58Å; H266-W270 AromaticContact NE2-NE1 3.74Å; H266-W270 VanDerWaalsContact O-CD1 3.27Å; H266-W270 PolarHBondContact O-N 3.3Å; L267-W270 CarbonylContact O-C 3.55Å; L267-W270 WeakPolarHBondContact O-CA 3.47Å; L267-W270 PolarHBondContact O-N 2.95Å; T268-W270 PolarHBondContact O-N 3.29Å; W270-L272 VanDerWaalsContact C-N 3.35Å; W270-L338 HydrophobicContact CB-CD1 4.18Å; W270-L338 HydrophobicContact CB-CD2 4.47Å; W270-L338 HydrophobicContact CD2-CD2 3.63Å; W270-L338 VanDerWaalsContact CE2-CD2 3.5Å; W270-L338 HydrophobicContact CE3-CD2 4.35Å; W270-L338 HydrophobicContact CG-CD1 4.2Å; W270-L338 HydrophobicContact CG-CD2 3.65Å; W270-L338 HydrophobicContact CZ2-CD2 4.12Å; W270-N369 PolarHBondContact O-ND2 3.04Å; W270-P382 HydrophobicContact CD2-CG 4.3Å; W270-P382 HydrophobicContact CE3-CG 4.46Å
271	G	67	Low	73.1	Confident	48 Å²	48	81.3 Å²	81.3	50%	0.495	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	12.3	177	0	0	0	0	0	114.3	L267 T268 Q269	L267-G271 PolarHBondContact O-N 2.87Å; T268-G271 PolarHBondContact O-N 2.9Å; Q269-G271 PolarHBondContact O-N 3.5Å
272	L	72.9	Confident	72.8	Confident	35 Å²	35	82.3 Å²	82.3	18%	0.183	43%	0.425	C	S	.	.			trans	-86.1	127.5	173.2	-68.8	159.9	0	0	0	110	L267 T268 W270 C274 L338 I341 L345	L267-L272 HydrophobicContact CB-CB 4.27Å; L267-L272 HydrophobicContact CB-CD1 4.17Å; L267-L272 HydrophobicContact CD2-CD1 3.89Å; L267-L272 WeakPolarHBondContact O-CB 3.25Å; L267-L272 PolarHBondContact O-N 2.91Å; T268-L272 WeakPolarHBondContact CA-O 3.34Å; W270-L272 VanDerWaalsContact C-N 3.35Å; L272-C274 PolarHBondContact O-N 3.37Å; L272-C274 PolarHBondContact O-SG 3.08Å; L272-C274 VanDerWaalsContact O-SG 3.32Å; L272-L338 HydrophobicContact CD1-CD1 4.01Å; L272-I341 HydrophobicContact CD1-CG2 4.37Å; L272-L345 HydrophobicContact CD2-CD1 3.78Å
273	D	72.3	Confident	72.4	Confident	153 Å²	153	82.1 Å²	82.1	82%	0.818	42%	0.424	S	S	*	.			trans	-73	125.5	170.7	-161.3	6.9	0	0	0	109.6
274	C	78.4	Confident	71.3	Confident	24 Å²	24	82.6 Å²	82.6	16%	0.162	43%	0.425	C	S	.	.			trans	-135	117.5	-167.2	-65.7	0	0	0	0	111.1	Q264 L267 L272	Q264-C274 HydrophobicContact CG-CB 3.77Å; Q264-C274 PolarHBondContact NE2-O 2.96Å; L267-C274 WeakPolarHBondContact CB-SG 3.32Å; L272-C274 PolarHBondContact O-N 3.37Å; L272-C274 PolarHBondContact O-SG 3.08Å; L272-C274 VanDerWaalsContact O-SG 3.32Å
275	E	79.6	Confident	70.5	Confident	174 Å²	174	85.1 Å²	85.1	81%	0.813	44%	0.437	S	S	*	.			trans	-107	141.1	174.3	-69.5	-67.4	169.2	0	0	110.4
276	I	77.6	Confident	69.8	Low	57 Å²	57	83.4 Å²	83.4	29%	0.292	43%	0.429	S	S	.	.			trans	-101.1	124.6	177.5	-63.8	168.7	0	0	0	108.5	V260 Q264 N278	V260-I276 HydrophobicContact CG1-CB 4.23Å; V260-I276 HydrophobicContact CG1-CD1 3.61Å; V260-I276 HydrophobicContact CG1-CG1 3.6Å; V260-I276 HydrophobicContact CG1-CG2 3.6Å; Q264-I276 HydrophobicContact CB-CD1 4.16Å; Q264-I276 HydrophobicContact CB-CG1 4.39Å; Q264-I276 VanDerWaalsContact CD-CD1 3.45Å; Q264-I276 HydrophobicContact CG-CD1 4.3Å; Q264-I276 HydrophobicContact CG-CG1 4.38Å; I276-N278 PolarHBondContact O-ND2 3.16Å
277	A	72.6	Confident	69.1	Low	49 Å²	49	86.7 Å²	86.7	41%	0.405	44%	0.441	S	S	.	.			trans	-73	126.4	168.4	0	0	0	0	0	109.9	V283 E286	A277-V283 HydrophobicContact CB-CG1 4.3Å; A277-V283 HydrophobicContact CB-CG2 4.02Å; A277-E286 VanDerWaalsContact CA-OE2 3.31Å; A277-E286 WeakPolarHBondContact CA-OE2 3.49Å
278	N	67.3	Low	67.9	Low	145 Å²	145	89.3 Å²	89.3	78%	0.775	45%	0.452	S	S	*	.	S	Bend	trans	-86	-28.9	-174.5	-60.3	-79.9	0	0	0	112.5	I276 E286	I276-N278 PolarHBondContact O-ND2 3.16Å; N278-E286 VanDerWaalsContact N-CD 3.32Å; N278-E286 PolarHBondContact N-OE1 3.33Å; N278-E286 PolarHBondContact N-OE2 2.83Å; N278-E286 PolarHBondContact ND2-OE2 2.93Å; N278-E286 VanDerWaalsContact ND2-OE2 3.14Å
279	D	67.7	Low	66.4	Low	64 Å²	64	90.9 Å²	90.9	34%	0.342	47%	0.473	S	S	.	.			trans	-127	110.5	178.9	-170.3	-19.7	0	0	0	111.1	Q281 H282 V283 E286	D279-Q281 PolarHBondContact O-N 2.92Å; D279-Q281 WeakPolarHBondContact OD1-CB 3.42Å; D279-Q281 PolarHBondContact OD1-N 3.23Å; D279-H282 HydrophobicContact CB-CB 4.26Å; D279-H282 CarbonylContact O-C 3.4Å; D279-H282 PolarHBondContact O-N 3.45Å; D279-H282 IonicContact OD1-ND1 3.11Å; D279-H282 IonicContact OD2-CE1 2.64Å; D279-H282 IonicContact OD2-CG 3.41Å; D279-H282 IonicContact OD2-ND1 3.75Å; D279-H282 PolarHBondContact OD2-ND1 2.82Å; D279-V283 PolarHBondContact O-N 3.05Å; D279-E286 PolarHBondContact N-OE1 2.82Å
280	F	64.1	Low	65.1	Low	190 Å²	190	91.7 Å²	91.7	83%	0.833	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-60.6	-29.2	179	-173.1	-101.6	0	0	0	113.3	H282 V283	F280-H282 VanDerWaalsContact C-N 3.27Å; F280-V283 HydrophobicContact CD2-CG2 4.16Å; F280-V283 WeakPolarHBondContact O-CG2 3.33Å
281	Q	63.4	Low	64.1	Low	168 Å²	168	96.1 Å²	96.1	79%	0.785	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-74.1	-22.5	177.4	-63.4	-170.4	-21.9	0	0	112.2	D279	D279-Q281 PolarHBondContact O-N 2.92Å; D279-Q281 WeakPolarHBondContact OD1-CB 3.42Å; D279-Q281 PolarHBondContact OD1-N 3.23Å
282	H	66.8	Low	62.7	Low	72 Å²	72	98.7 Å²	98.7	33%	0.333	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-120.8	22.5	-175.3	-54.9	96.2	0	0	0	112.6	D279 F280 F284 E285 E286	D279-H282 HydrophobicContact CB-CB 4.26Å; D279-H282 CarbonylContact O-C 3.4Å; D279-H282 PolarHBondContact O-N 3.45Å; D279-H282 IonicContact OD1-ND1 3.11Å; D279-H282 IonicContact OD2-CE1 2.64Å; D279-H282 IonicContact OD2-CG 3.41Å; D279-H282 IonicContact OD2-ND1 3.75Å; D279-H282 PolarHBondContact OD2-ND1 2.82Å; F280-H282 VanDerWaalsContact C-N 3.27Å; H282-F284 PolarHBondContact O-N 2.84Å; H282-F284 VanDerWaalsContact O-N 3.08Å; H282-E285 HydrophobicContact CB-CB 4.29Å; H282-E285 HydrophobicContact CB-CG 4.34Å; H282-E285 IonicContact CD2-OE1 2.68Å; H282-E285 IonicContact CD2-OE2 2.7Å; H282-E285 PolarHBondContact CD2-OE2 3.43Å; H282-E285 IonicContact CG-OE2 3.5Å; H282-E285 WeakPolarHBondContact O-CA 3.28Å; H282-E285 WeakPolarHBondContact O-CB 3.37Å; H282-E285 PolarHBondContact O-N 3.3Å; H282-E286 PolarHBondContact O-N 3.16Å
283	V	65.2	Low	61.2	Low	40 Å²	40	104.2 Å²	104.2	24%	0.242	54%	0.541	C	S	.	.	H	α-helix	trans	-51.3	-38.4	177.9	176.8	0	0	0	0	111.4	A277 D279 F280 E286 Y287	A277-V283 HydrophobicContact CB-CG1 4.3Å; A277-V283 HydrophobicContact CB-CG2 4.02Å; D279-V283 PolarHBondContact O-N 3.05Å; F280-V283 HydrophobicContact CD2-CG2 4.16Å; F280-V283 WeakPolarHBondContact O-CG2 3.33Å; V283-E286 PolarHBondContact O-N 2.96Å; V283-Y287 WeakPolarHBondContact O-CB 3.35Å; V283-Y287 PolarHBondContact O-N 2.9Å
284	F	61.1	Low	59.6	Low	33 Å²	33	101.1 Å²	101.1	15%	0.145	52%	0.524	C	S	.	.	H	α-helix	trans	-68.1	-36.1	179.4	-167.2	-103	0	0	0	112.7	H282 Y287 Q288 Q291 I296 V299	H282-F284 PolarHBondContact O-N 2.84Å; H282-F284 VanDerWaalsContact O-N 3.08Å; F284-Y287 HydrophobicContact CD2-CD1 4.32Å; F284-Y287 HydrophobicContact CE2-CD1 4.27Å; F284-Y287 PolarHBondContact O-N 2.88Å; F284-Q288 PolarHBondContact O-N 3.32Å; F284-Q291 WeakPolarHBondContact CE1-O 3.27Å; F284-I296 HydrophobicContact CD2-CG1 3.86Å; F284-V299 HydrophobicContact CE2-CG2 3.53Å; F284-V299 HydrophobicContact CZ-CG2 3.68Å
285	E	64.6	Low	58.3	Low	115 Å²	115	106.1 Å²	106.1	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-70.5	-37.8	176.6	-57.8	-177	171.1	0	0	111.3	H282 Y287 Q288	H282-E285 HydrophobicContact CB-CB 4.29Å; H282-E285 HydrophobicContact CB-CG 4.34Å; H282-E285 IonicContact CD2-OE1 2.68Å; H282-E285 IonicContact CD2-OE2 2.7Å; H282-E285 PolarHBondContact CD2-OE2 3.43Å; H282-E285 IonicContact CG-OE2 3.5Å; H282-E285 WeakPolarHBondContact O-CA 3.28Å; H282-E285 WeakPolarHBondContact O-CB 3.37Å; H282-E285 PolarHBondContact O-N 3.3Å; E285-Y287 VanDerWaalsContact C-N 3.32Å; E285-Q288 CarbonylContact O-C 3.5Å
286	E	64.1	Low	57.3	Low	84 Å²	84	100.4 Å²	100.4	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-66.3	-35.1	170.9	-67.9	-170.9	-131.5	0	0	111.6	A277 N278 D279 H282 V283	A277-E286 VanDerWaalsContact CA-OE2 3.31Å; A277-E286 WeakPolarHBondContact CA-OE2 3.49Å; N278-E286 VanDerWaalsContact N-CD 3.32Å; N278-E286 PolarHBondContact N-OE1 3.33Å; N278-E286 PolarHBondContact N-OE2 2.83Å; N278-E286 PolarHBondContact ND2-OE2 2.93Å; N278-E286 VanDerWaalsContact ND2-OE2 3.14Å; D279-E286 PolarHBondContact N-OE1 2.82Å; H282-E286 PolarHBondContact O-N 3.16Å; V283-E286 PolarHBondContact O-N 2.96Å
287	Y	60.2	Low	56.5	Low	104 Å²	104	100.6 Å²	100.6	41%	0.408	52%	0.516	S	S	.	.	H	α-helix	trans	-76.9	-37.8	179.9	-178.8	-107.3	0	0	0	113.2	V283 F284 E285 S300	V283-Y287 WeakPolarHBondContact O-CB 3.35Å; V283-Y287 PolarHBondContact O-N 2.9Å; F284-Y287 HydrophobicContact CD2-CD1 4.32Å; F284-Y287 HydrophobicContact CE2-CD1 4.27Å; F284-Y287 PolarHBondContact O-N 2.88Å; E285-Y287 VanDerWaalsContact C-N 3.32Å; Y287-S300 PolarHBondContact OH-OG 3.46Å
288	Q	55	Low	56	Low	75 Å²	75	104.9 Å²	104.9	35%	0.35	53%	0.526	S	S	.	.			trans	-148.5	125.9	176.6	-73.1	-168	21	0	0	112.3	F284 E285 I290	F284-Q288 PolarHBondContact O-N 3.32Å; E285-Q288 CarbonylContact O-C 3.5Å; Q288-I290 PolarHBondContact O-N 3.48Å
289	A	45.3	Very low	56	Low	106 Å²	106	101.3 Å²	101.3	88%	0.876	51%	0.509	S	S	*	.	S	Bend	trans	-70.1	31.7	169	0	0	0	0	0	114.2
290	I	40.5	Very low	56	Low	118 Å²	118	99 Å²	99	61%	0.605	50%	0.498	S	S	*	.	S	Bend	trans	-139.1	105.2	-173	-56.7	178.6	0	0	0	111.2	Q288	Q288-I290 PolarHBondContact O-N 3.48Å
291	Q	41.1	Very low	56.4	Low	165 Å²	165	97.8 Å²	97.8	77%	0.771	50%	0.495	S	S	*	.			trans	63.2	129.3	164.8	-80.1	-164.5	-40.5	0	0	120.7	F284	F284-Q291 WeakPolarHBondContact CE1-O 3.27Å
292	P	38	Very low	56.9	Low	101 Å²	101	92.6 Å²	92.6	66%	0.656	47%	0.474	S	S	*	.	S	Bend	trans	-97.8	10.9	-153.9	-3	26.3	0	0	0	118.3
293	D	40.4	Very low	57.6	Low	152 Å²	152	90.8 Å²	90.8	81%	0.813	47%	0.469	S	S	*	.	S	Bend	trans	-127.2	20.3	-167.3	-80.4	-36.6	0	0	0	116.5
294	L	37.8	Very low	58.5	Low	87 Å²	87	90.6 Å²	90.6	46%	0.455	47%	0.466	S	S	.	.			trans	-120.5	132.5	179.7	-89.9	85.5	0	0	0	114	I296 K298 V299	L294-I296 PolarHBondContact O-N 2.96Å; L294-K298 HydrophobicContact CD2-CB 3.78Å; L294-K298 HydrophobicContact CD2-CD 4.4Å; L294-K298 HydrophobicContact CG-CB 4.46Å; L294-K298 HydrophobicContact CG-CD 4.5Å; L294-V299 HydrophobicContact CB-CG1 3.91Å; L294-V299 HydrophobicContact CD2-CG1 3.48Å; L294-V299 VanDerWaalsContact CD2-CG1 3.48Å; L294-V299 HydrophobicContact CG-CG1 4.3Å
295	E	52.5	Low	59.7	Low	129 Å²	129	91.3 Å²	91.3	60%	0.603	47%	0.471	S	S	*	.			trans	-52.7	131.8	165.2	-66.3	168.8	157.8	0	0	109.8	R297 K298	E295-R297 PolarHBondContact O-N 2.96Å; E295-K298 HydrophobicContact CB-CD 4.3Å; E295-K298 HydrophobicContact CB-CG 4.41Å; E295-K298 WeakPolarHBondContact O-CB 3.4Å; E295-K298 PolarHBondContact O-N 2.94Å; E295-K298 WeakPolarHBondContact OE2-CE 3.29Å; E295-K298 IonicContact OE2-NZ 3.95Å; E295-K298 PolarHBondContact OE2-NZ 2.85Å
296	I	57.8	Low	60.7	Low	55 Å²	55	89.9 Å²	89.9	28%	0.282	46%	0.463	S	S	.	.	H	α-helix	trans	-43.5	-42.8	-175.7	-65.8	165.6	0	0	0	112.1	F284 L294 K298 V299 S300 V302 I304	F284-I296 HydrophobicContact CD2-CG1 3.86Å; L294-I296 PolarHBondContact O-N 2.96Å; I296-K298 VanDerWaalsContact C-N 3.3Å; I296-K298 PolarHBondContact O-N 3.31Å; I296-V299 VanDerWaalsContact O-CG2 3.29Å; I296-V299 WeakPolarHBondContact O-CG2 3.18Å; I296-V299 PolarHBondContact O-N 3.24Å; I296-S300 WeakPolarHBondContact O-CB 3.47Å; I296-S300 PolarHBondContact O-N 3.46Å; I296-V302 HydrophobicContact CG2-CG1 4.4Å; I296-I304 HydrophobicContact CB-CD1 4.43Å; I296-I304 HydrophobicContact CG2-CD1 3.99Å
297	R	60.8	Low	61.4	Low	60 Å²	60	88.7 Å²	88.7	23%	0.226	46%	0.459	C	S	.	.	H	α-helix	trans	-65.6	-24.4	-178.7	-82.8	-73.1	-178.9	-126.4	-5.5	115.7	E295 V299 V302 I304 G323 D325	E295-R297 PolarHBondContact O-N 2.96Å; R297-V299 PolarHBondContact O-N 2.82Å; R297-V302 PolarHBondContact NH1-O 2.88Å; R297-I304 HydrophobicContact CG-CD1 4.03Å; R297-G323 PolarHBondContact NE-O 3.01Å; R297-G323 PolarHBondContact NH2-O 3.44Å; R297-D325 IonicContact CZ-OD2 2.72Å; R297-D325 IonicContact NH1-OD2 3.4Å; R297-D325 IonicContact NH2-OD1 3.8Å; R297-D325 IonicContact NH2-OD2 3.59Å; R297-D325 PolarHBondContact NH2-OD2 3Å
298	K	63.2	Low	62	Low	139 Å²	139	85.2 Å²	85.2	60%	0.604	45%	0.45	S	S	*	.	H	α-helix	trans	-75.4	-18.4	177.5	-70.5	175.6	170.5	144.4	0	112.4	L294 E295 I296	L294-K298 HydrophobicContact CD2-CB 3.78Å; L294-K298 HydrophobicContact CD2-CD 4.4Å; L294-K298 HydrophobicContact CG-CB 4.46Å; L294-K298 HydrophobicContact CG-CD 4.5Å; E295-K298 HydrophobicContact CB-CD 4.3Å; E295-K298 HydrophobicContact CB-CG 4.41Å; E295-K298 WeakPolarHBondContact O-CB 3.4Å; E295-K298 PolarHBondContact O-N 2.94Å; E295-K298 WeakPolarHBondContact OE2-CE 3.29Å; E295-K298 IonicContact OE2-NZ 3.95Å; E295-K298 PolarHBondContact OE2-NZ 2.85Å; I296-K298 VanDerWaalsContact C-N 3.3Å; I296-K298 PolarHBondContact O-N 3.31Å
299	V	65.5	Low	62.6	Low	70 Å²	70	85.3 Å²	85.3	42%	0.424	46%	0.459	S	S	.	.	H	α-helix	trans	-123.8	-17.4	-174	-66.2	0	0	0	0	113.8	F284 L294 I296 R297	F284-V299 HydrophobicContact CE2-CG2 3.53Å; F284-V299 HydrophobicContact CZ-CG2 3.68Å; L294-V299 HydrophobicContact CB-CG1 3.91Å; L294-V299 HydrophobicContact CD2-CG1 3.48Å; L294-V299 VanDerWaalsContact CD2-CG1 3.48Å; L294-V299 HydrophobicContact CG-CG1 4.3Å; I296-V299 VanDerWaalsContact O-CG2 3.29Å; I296-V299 WeakPolarHBondContact O-CG2 3.18Å; I296-V299 PolarHBondContact O-N 3.24Å; R297-V299 PolarHBondContact O-N 2.82Å
300	S	69.1	Low	63.3	Low	15 Å²	15	81.4 Å²	81.4	11%	0.105	43%	0.427	C	S	.	.			trans	-137	133.8	-176.6	-171.3	0	0	0	0	112.3	Y287 I296 V302	Y287-S300 PolarHBondContact OH-OG 3.46Å; I296-S300 WeakPolarHBondContact O-CB 3.47Å; I296-S300 PolarHBondContact O-N 3.46Å; S300-V302 VanDerWaalsContact C-N 3.3Å; S300-V302 WeakPolarHBondContact OG-CB 3.43Å; S300-V302 VanDerWaalsContact OG-CG1 3.27Å; S300-V302 WeakPolarHBondContact OG-CG1 3.28Å; S300-V302 PolarHBondContact OG-N 3.26Å
301	E	71.3	Confident	64.2	Low	166 Å²	166	78.9 Å²	78.9	78%	0.776	41%	0.411	S	S	*	.			trans	-91	9.6	172.3	-64.2	-69.2	168.3	0	0	111.8
302	V	75.1	Confident	65.4	Low	58 Å²	58	74.3 Å²	74.3	35%	0.352	39%	0.392	S	S	.	.			trans	-60.3	133.3	179.6	70	0	0	0	0	110.4	I296 R297 S300 I304	I296-V302 HydrophobicContact CG2-CG1 4.4Å; R297-V302 PolarHBondContact NH1-O 2.88Å; S300-V302 VanDerWaalsContact C-N 3.3Å; S300-V302 WeakPolarHBondContact OG-CB 3.43Å; S300-V302 VanDerWaalsContact OG-CG1 3.27Å; S300-V302 WeakPolarHBondContact OG-CG1 3.28Å; S300-V302 PolarHBondContact OG-N 3.26Å; V302-I304 PolarHBondContact O-N 3.3Å
303	P	81.8	Confident	66.7	Low	34 Å²	34	76.8 Å²	76.8	22%	0.221	40%	0.395	C	S	.	.			trans	-60.5	137.1	179.7	-26.3	34.9	0	0	0	113	D325 L344	P303-D325 WeakPolarHBondContact CA-OD2 3.3Å; P303-L344 HydrophobicContact CB-CB 4.13Å; P303-L344 HydrophobicContact CG-CB 4.49Å
304	I	83.4	Confident	67.7	Low	37 Å²	37	76.7 Å²	76.7	19%	0.19	39%	0.392	C	S	.	.			trans	-117.2	122.5	-179.3	-57.4	173.8	0	0	0	109.1	I296 R297 V302 F306 D325 E326	I296-I304 HydrophobicContact CB-CD1 4.43Å; I296-I304 HydrophobicContact CG2-CD1 3.99Å; R297-I304 HydrophobicContact CG-CD1 4.03Å; V302-I304 PolarHBondContact O-N 3.3Å; I304-F306 HydrophobicContact CG2-CD2 3.93Å; I304-F306 HydrophobicContact CG2-CE2 3.67Å; I304-D325 PolarHBondContact N-OD2 3.41Å; I304-D325 PolarHBondContact O-N 3.36Å; I304-E326 PolarHBondContact O-N 3.17Å
305	I	87.1	Confident	69	Low	47 Å²	47	75.6 Å²	75.6	24%	0.241	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.7	176.3	-52.6	179.3	0	0	0	108.7	L307 E326 I328 I341 L344	I305-L307 HydrophobicContact CG2-CD2 4.01Å; I305-E326 WeakPolarHBondContact CA-O 3.33Å; I305-E326 HydrophobicContact CG1-CB 4.3Å; I305-E326 HydrophobicContact CG2-CB 4.28Å; I305-E326 HydrophobicContact CG2-CG 4.36Å; I305-I328 HydrophobicContact CG2-CD1 3.71Å; I305-I328 HydrophobicContact CG2-CG1 4.04Å; I305-I341 HydrophobicContact CD1-CB 4.49Å; I305-I341 HydrophobicContact CD1-CG1 3.52Å; I305-L344 HydrophobicContact CD1-CD1 3.55Å; I305-L344 HydrophobicContact CG1-CD1 3.48Å; I305-L344 VanDerWaalsContact CG1-CD1 3.48Å
306	F	84.5	Confident	69.9	Low	86 Å²	86	72 Å²	72	38%	0.377	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.5	172.6	-85.8	-121.3	0	0	0	109.7	I304 A319 A324 E326 F327 I328	I304-F306 HydrophobicContact CG2-CD2 3.93Å; I304-F306 HydrophobicContact CG2-CE2 3.67Å; F306-A319 HydrophobicContact CD1-CB 4.16Å; F306-A319 HydrophobicContact CG-CB 4.25Å; F306-A324 HydrophobicContact CD2-CB 3.44Å; F306-A324 VanDerWaalsContact CD2-CB 3.44Å; F306-A324 HydrophobicContact CE2-CB 3.78Å; F306-A324 HydrophobicContact CG-CB 4.24Å; F306-E326 PolarHBondContact N-O 3.02Å; F306-F327 HydrophobicContact CB-CD2 3.72Å; F306-F327 HydrophobicContact CB-CE2 4.24Å; F306-I328 PolarHBondContact O-N 3.44Å
307	L	79.8	Confident	70.5	Confident	58 Å²	58	72.9 Å²	72.9	30%	0.304	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	104.1	169.1	-54.9	-175.5	0	0	0	108	I263 I305 I328 F332 L337	I263-L307 HydrophobicContact CD1-CD1 3.67Å; I305-L307 HydrophobicContact CG2-CD2 4.01Å; L307-I328 WeakPolarHBondContact CA-O 3.33Å; L307-I328 HydrophobicContact CD2-CB 3.68Å; L307-I328 HydrophobicContact CD2-CD1 3.93Å; L307-I328 HydrophobicContact CD2-CG1 4.23Å; L307-I328 HydrophobicContact CD2-CG2 4.19Å; L307-F332 HydrophobicContact CB-CE1 4.24Å; L307-F332 HydrophobicContact CD1-CE1 4.09Å; L307-F332 HydrophobicContact CD1-CZ 3.88Å; L307-F332 HydrophobicContact CD2-CE1 4.16Å; L307-F332 HydrophobicContact CD2-CZ 4.5Å; L307-F332 HydrophobicContact CG-CE1 4.4Å; L307-L337 HydrophobicContact CD1-CD2 4.41Å; L307-L337 HydrophobicContact CD2-CD1 3.87Å
308	S	73	Confident	70.7	Confident	31 Å²	31	74.9 Å²	74.9	22%	0.217	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.9	-172.1	-178.1	0	0	0	0	112	A310 I328 E329 K330	S308-A310 VanDerWaalsContact C-N 3.26Å; S308-A310 WeakPolarHBondContact OG-CB 3.33Å; S308-A310 PolarHBondContact OG-N 3.32Å; S308-I328 PolarHBondContact N-O 3.24Å; S308-E329 CarbonylContact O-C 3.56Å; S308-E329 VanDerWaalsContact O-CA 3.28Å; S308-E329 WeakPolarHBondContact O-CA 3.39Å; S308-K330 PolarHBondContact O-N 3.08Å
309	S	65.7	Low	71.1	Confident	78 Å²	78	68.6 Å²	68.6	55%	0.545	36%	0.364	S	S	.	.	S	Bend	trans	-79.9	-8.2	169	52.5	0	0	0	0	112.8	K311	S309-K311 PolarHBondContact O-N 2.83Å
310	A	61.2	Low	71.5	Confident	24 Å²	24	69.2 Å²	69.2	20%	0.198	37%	0.365	C	S	.	.			trans	-74.5	105.3	-177.9	0	0	0	0	0	111.4	S308 N315 F327	S308-A310 VanDerWaalsContact C-N 3.26Å; S308-A310 WeakPolarHBondContact OG-CB 3.33Å; S308-A310 PolarHBondContact OG-N 3.32Å; A310-N315 HydrophobicContact CB-CB 4.06Å; A310-N315 WeakPolarHBondContact CB-ND2 3.35Å; A310-F327 WeakPolarHBondContact O-CE1 3.47Å; A310-F327 WeakPolarHBondContact O-CZ 3.49Å
311	K	58.4	Low	71.6	Confident	64 Å²	64	74.8 Å²	74.8	28%	0.278	39%	0.393	S	S	.	.			trans	-90.9	-6.9	-174.2	-61.4	-171.5	176.6	-179.6	0	114.9	S309 Q313	S309-K311 PolarHBondContact O-N 2.83Å; K311-Q313 PolarHBondContact O-N 3.16Å
312	D	67.5	Low	71.4	Confident	69 Å²	69	73.1 Å²	73.1	37%	0.369	39%	0.387	S	S	.	.			trans	-70.6	137.5	-179	66.5	-73.2	0	0	0	110.5	M314 N315 Q316	D312-M314 PolarHBondContact O-N 3.02Å; D312-M314 VanDerWaalsContact O-N 3.09Å; D312-M314 WeakPolarHBondContact OD2-CB 3.38Å; D312-M314 PolarHBondContact OD2-N 2.94Å; D312-N315 PolarHBondContact O-N 3.31Å; D312-N315 VanDerWaalsContact O-N 3.08Å; D312-N315 WeakPolarHBondContact OD1-CB 3.36Å; D312-N315 PolarHBondContact OD1-ND2 3.44Å; D312-N315 WeakPolarHBondContact OD2-CB 3.32Å; D312-N315 PolarHBondContact OD2-N 3.39Å; D312-Q316 PolarHBondContact O-N 2.82Å
313	Q	64.4	Low	71.3	Confident	154 Å²	154	71.4 Å²	71.4	72%	0.72	38%	0.382	S	S	*	.	H	α-helix	trans	-57.9	-26.7	-180	-163.4	175.8	2.5	0	0	111.6	K311 Q316 V317	K311-Q313 PolarHBondContact O-N 3.16Å; Q313-Q316 PolarHBondContact O-N 3.08Å; Q313-V317 WeakPolarHBondContact O-CB 3.35Å; Q313-V317 WeakPolarHBondContact O-CG2 3.44Å; Q313-V317 PolarHBondContact O-N 2.99Å
314	M	62.2	Low	71.3	Confident	150 Å²	150	70.2 Å²	70.2	74%	0.739	37%	0.374	S	S	*	.	H	α-helix	trans	-69.6	-39.6	178.4	-172.4	159.2	179.7	0	0	112	D312 V317 M318	D312-M314 PolarHBondContact O-N 3.02Å; D312-M314 VanDerWaalsContact O-N 3.09Å; D312-M314 WeakPolarHBondContact OD2-CB 3.38Å; D312-M314 PolarHBondContact OD2-N 2.94Å; M314-V317 PolarHBondContact O-N 3.17Å; M314-M318 WeakPolarHBondContact O-CB 3.28Å; M314-M318 PolarHBondContact O-N 2.9Å
315	N	65.2	Low	71.3	Confident	63 Å²	63	71.2 Å²	71.2	34%	0.337	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-36.4	173.8	-82.4	-25.3	0	0	0	112.5	A310 D312 M318 A319	A310-N315 HydrophobicContact CB-CB 4.06Å; A310-N315 WeakPolarHBondContact CB-ND2 3.35Å; D312-N315 PolarHBondContact O-N 3.31Å; D312-N315 VanDerWaalsContact O-N 3.08Å; D312-N315 WeakPolarHBondContact OD1-CB 3.36Å; D312-N315 PolarHBondContact OD1-ND2 3.44Å; D312-N315 WeakPolarHBondContact OD2-CB 3.32Å; D312-N315 PolarHBondContact OD2-N 3.39Å; N315-M318 PolarHBondContact O-N 2.9Å; N315-A319 VanDerWaalsContact O-CB 3.32Å; N315-A319 WeakPolarHBondContact O-CB 3.24Å; N315-A319 PolarHBondContact O-N 3.41Å
316	Q	71.9	Confident	71.3	Confident	55 Å²	55	71.6 Å²	71.6	26%	0.257	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-49.7	172.2	-59.6	-177.2	24	0	0	110.9	D312 Q313 M318 A319 L320 F327 E329	D312-Q316 PolarHBondContact O-N 2.82Å; Q313-Q316 PolarHBondContact O-N 3.08Å; Q316-M318 VanDerWaalsContact C-N 3.3Å; Q316-M318 PolarHBondContact O-N 2.97Å; Q316-A319 PolarHBondContact O-N 2.94Å; Q316-L320 VanDerWaalsContact O-CG 3.28Å; Q316-L320 WeakPolarHBondContact O-CG 3.36Å; Q316-L320 PolarHBondContact O-N 3.08Å; Q316-F327 HydrophobicContact CB-CD1 4.45Å; Q316-F327 HydrophobicContact CB-CG 4.49Å; Q316-F327 HydrophobicContact CG-CD1 3.67Å; Q316-F327 HydrophobicContact CG-CE1 3.71Å; Q316-F327 HydrophobicContact CG-CG 4.17Å; Q316-F327 HydrophobicContact CG-CZ 4.24Å; Q316-E329 PolarHBondContact NE2-OE1 2.88Å
317	V	68.5	Low	71.3	Confident	72 Å²	72	68.4 Å²	68.4	44%	0.436	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-41	177.2	169.9	0	0	0	0	110.8	Q313 M314 N321	Q313-V317 WeakPolarHBondContact O-CB 3.35Å; Q313-V317 WeakPolarHBondContact O-CG2 3.44Å; Q313-V317 PolarHBondContact O-N 2.99Å; M314-V317 PolarHBondContact O-N 3.17Å; V317-N321 WeakPolarHBondContact CG1-ND2 3.22Å; V317-N321 VanDerWaalsContact O-CB 3.27Å; V317-N321 WeakPolarHBondContact O-CB 3.46Å; V317-N321 PolarHBondContact O-N 3.27Å; V317-N321 PolarHBondContact O-ND2 2.92Å; V317-N321 VanDerWaalsContact O-ND2 3.17Å
318	M	66.7	Low	71.6	Confident	103 Å²	103	66.1 Å²	66.1	51%	0.507	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-47.8	177.7	-177.1	170.6	175.3	0	0	111.4	M314 N315 Q316 L320 N321 M322	M314-M318 WeakPolarHBondContact O-CB 3.28Å; M314-M318 PolarHBondContact O-N 2.9Å; N315-M318 PolarHBondContact O-N 2.9Å; Q316-M318 VanDerWaalsContact C-N 3.3Å; Q316-M318 PolarHBondContact O-N 2.97Å; M318-L320 VanDerWaalsContact C-N 3.34Å; M318-L320 PolarHBondContact O-N 3.06Å; M318-N321 PolarHBondContact O-N 3.14Å; M318-M322 HydrophobicContact CE-SD 3.63Å; M318-M322 HydrophobicContact CG-CG 4.31Å; M318-M322 HydrophobicContact CG-SD 3.85Å; M318-M322 WeakPolarHBondContact O-CB 3.27Å; M318-M322 VanDerWaalsContact O-CG 3.23Å; M318-M322 WeakPolarHBondContact O-CG 3.43Å; M318-M322 PolarHBondContact O-N 3.32Å
319	A	70.1	Confident	71.7	Confident	7 Å²	7	68 Å²	68	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-58.1	-46.6	177.5	0	0	0	0	0	111.4	F306 N315 Q316 M322 G323 A324 F327	F306-A319 HydrophobicContact CD1-CB 4.16Å; F306-A319 HydrophobicContact CG-CB 4.25Å; N315-A319 VanDerWaalsContact O-CB 3.32Å; N315-A319 WeakPolarHBondContact O-CB 3.24Å; N315-A319 PolarHBondContact O-N 3.41Å; Q316-A319 PolarHBondContact O-N 2.94Å; A319-M322 PolarHBondContact O-N 3.28Å; A319-G323 PolarHBondContact O-N 2.88Å; A319-A324 HydrophobicContact CB-CB 4.22Å; A319-A324 WeakPolarHBondContact O-CB 3.32Å; A319-A324 PolarHBondContact O-N 3.44Å; A319-F327 HydrophobicContact CB-CD2 3.65Å; A319-F327 HydrophobicContact CB-CE2 4.13Å
320	L	74.3	Confident	72.1	Confident	82 Å²	82	66.8 Å²	66.8	43%	0.429	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-43.1	176.9	-66.1	173.8	0	0	0	111.9	Q316 M318 M322 G323 A324	Q316-L320 VanDerWaalsContact O-CG 3.28Å; Q316-L320 WeakPolarHBondContact O-CG 3.36Å; Q316-L320 PolarHBondContact O-N 3.08Å; M318-L320 VanDerWaalsContact C-N 3.34Å; M318-L320 PolarHBondContact O-N 3.06Å; L320-M322 VanDerWaalsContact C-N 3.29Å; L320-M322 PolarHBondContact O-N 2.97Å; L320-G323 PolarHBondContact O-N 3.05Å; L320-A324 WeakPolarHBondContact CD2-O 3.47Å
321	N	70.7	Confident	72.5	Confident	133 Å²	133	71.6 Å²	71.6	71%	0.711	37%	0.374	S	S	*	.	H	α-helix	trans	-67.5	-27.4	176.2	-74.8	-28	0	0	0	113.2	V317 M318 G323	V317-N321 WeakPolarHBondContact CG1-ND2 3.22Å; V317-N321 VanDerWaalsContact O-CB 3.27Å; V317-N321 WeakPolarHBondContact O-CB 3.46Å; V317-N321 PolarHBondContact O-N 3.27Å; V317-N321 PolarHBondContact O-ND2 2.92Å; V317-N321 VanDerWaalsContact O-ND2 3.17Å; M318-N321 PolarHBondContact O-N 3.14Å; N321-G323 PolarHBondContact O-N 3.38Å
322	M	68.8	Low	73.3	Confident	130 Å²	130	70.7 Å²	70.7	64%	0.64	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	1	172.3	-70.6	-178.9	77.5	0	0	112.7	M318 A319 L320	M318-M322 HydrophobicContact CE-SD 3.63Å; M318-M322 HydrophobicContact CG-CG 4.31Å; M318-M322 HydrophobicContact CG-SD 3.85Å; M318-M322 WeakPolarHBondContact O-CB 3.27Å; M318-M322 VanDerWaalsContact O-CG 3.23Å; M318-M322 WeakPolarHBondContact O-CG 3.43Å; M318-M322 PolarHBondContact O-N 3.32Å; A319-M322 PolarHBondContact O-N 3.28Å; L320-M322 VanDerWaalsContact C-N 3.29Å; L320-M322 PolarHBondContact O-N 2.97Å
323	G	71.9	Confident	73.7	Confident	23 Å²	23	73.6 Å²	73.6	24%	0.237	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	13.3	174.2	0	0	0	0	0	114.5	R297 A319 L320 N321	R297-G323 PolarHBondContact NE-O 3.01Å; R297-G323 PolarHBondContact NH2-O 3.44Å; A319-G323 PolarHBondContact O-N 2.88Å; L320-G323 PolarHBondContact O-N 3.05Å; N321-G323 PolarHBondContact O-N 3.38Å
324	A	81.2	Confident	74.5	Confident	8 Å²	8	68.6 Å²	68.6	7%	0.066	36%	0.36	C	S	.	.			trans	-62.6	138.3	164.4	0	0	0	0	0	109.9	F306 A319 L320	F306-A324 HydrophobicContact CD2-CB 3.44Å; F306-A324 VanDerWaalsContact CD2-CB 3.44Å; F306-A324 HydrophobicContact CE2-CB 3.78Å; F306-A324 HydrophobicContact CG-CB 4.24Å; A319-A324 HydrophobicContact CB-CB 4.22Å; A319-A324 WeakPolarHBondContact O-CB 3.32Å; A319-A324 PolarHBondContact O-N 3.44Å; L320-A324 WeakPolarHBondContact CD2-O 3.47Å
325	D	84.2	Confident	75.3	Confident	58 Å²	58	65.8 Å²	65.8	31%	0.31	35%	0.351	S	S	.	.	S	Bend	trans	-80.6	-26.2	170.6	-65.7	-78.7	0	0	0	111.8	R297 P303 I304 L344	R297-D325 IonicContact CZ-OD2 2.72Å; R297-D325 IonicContact NH1-OD2 3.4Å; R297-D325 IonicContact NH2-OD1 3.8Å; R297-D325 IonicContact NH2-OD2 3.59Å; R297-D325 PolarHBondContact NH2-OD2 3Å; P303-D325 WeakPolarHBondContact CA-OD2 3.3Å; I304-D325 PolarHBondContact N-OD2 3.41Å; I304-D325 PolarHBondContact O-N 3.36Å; D325-L344 HydrophobicContact CB-CD1 4.38Å; D325-L344 HydrophobicContact CB-CD2 3.77Å
326	E	87.3	Confident	75.8	Confident	55 Å²	55	67.2 Å²	67.2	26%	0.257	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147	-174.4	-175.1	62.1	-76.4	0	0	111	I304 I305 F306 I328 K340 L344	I304-E326 PolarHBondContact O-N 3.17Å; I305-E326 WeakPolarHBondContact CA-O 3.33Å; I305-E326 HydrophobicContact CG1-CB 4.3Å; I305-E326 HydrophobicContact CG2-CB 4.28Å; I305-E326 HydrophobicContact CG2-CG 4.36Å; F306-E326 PolarHBondContact N-O 3.02Å; E326-I328 HydrophobicContact CG-CD1 4.47Å; E326-I328 HydrophobicContact CG-CG1 4.1Å; E326-K340 HydrophobicContact CG-CD 4.05Å; E326-K340 IonicContact OE1-NZ 3.37Å; E326-K340 PolarHBondContact OE1-NZ 3.24Å; E326-K340 WeakPolarHBondContact OE2-CE 3.44Å; E326-K340 IonicContact OE2-NZ 3.8Å; E326-K340 PolarHBondContact OE2-NZ 3.46Å; E326-L344 HydrophobicContact CB-CD1 3.87Å
327	F	85.3	Confident	76.4	Confident	19 Å²	19	64.8 Å²	64.8	8%	0.083	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.8	175.6	-171.9	-83.4	0	0	0	108.9	F306 A310 Q316 A319 E329	F306-F327 HydrophobicContact CB-CD2 3.72Å; F306-F327 HydrophobicContact CB-CE2 4.24Å; A310-F327 WeakPolarHBondContact O-CE1 3.47Å; A310-F327 WeakPolarHBondContact O-CZ 3.49Å; Q316-F327 HydrophobicContact CB-CD1 4.45Å; Q316-F327 HydrophobicContact CB-CG 4.49Å; Q316-F327 HydrophobicContact CG-CD1 3.67Å; Q316-F327 HydrophobicContact CG-CE1 3.71Å; Q316-F327 HydrophobicContact CG-CG 4.17Å; Q316-F327 HydrophobicContact CG-CZ 4.24Å; A319-F327 HydrophobicContact CB-CD2 3.65Å; A319-F327 HydrophobicContact CB-CE2 4.13Å; F327-E329 HydrophobicContact CD1-CG 4.25Å; F327-E329 HydrophobicContact CE1-CG 3.76Å
328	I	85.1	Confident	77.1	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.051	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.1	179.3	-55.9	174.8	0	0	0	108.1	I305 F306 L307 S308 E326 F332 L337 K340	I305-I328 HydrophobicContact CG2-CD1 3.71Å; I305-I328 HydrophobicContact CG2-CG1 4.04Å; F306-I328 PolarHBondContact O-N 3.44Å; L307-I328 WeakPolarHBondContact CA-O 3.33Å; L307-I328 HydrophobicContact CD2-CB 3.68Å; L307-I328 HydrophobicContact CD2-CD1 3.93Å; L307-I328 HydrophobicContact CD2-CG1 4.23Å; L307-I328 HydrophobicContact CD2-CG2 4.19Å; S308-I328 PolarHBondContact N-O 3.24Å; E326-I328 HydrophobicContact CG-CD1 4.47Å; E326-I328 HydrophobicContact CG-CG1 4.1Å; I328-F332 HydrophobicContact CG2-CB 3.66Å; I328-F332 HydrophobicContact CG2-CD1 3.87Å; I328-F332 HydrophobicContact CG2-CG 3.87Å; I328-L337 HydrophobicContact CD1-CD1 3.44Å; I328-L337 VanDerWaalsContact CD1-CD1 3.44Å; I328-K340 HydrophobicContact CD1-CB 4.33Å; I328-K340 HydrophobicContact CD1-CD 3.52Å; I328-K340 HydrophobicContact CG1-CD 3.76Å
329	E	75.9	Confident	77.7	Confident	71 Å²	71	59.4 Å²	59.4	33%	0.332	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	137.4	176.4	-69.2	176.9	-152	0	0	111	S308 Q316 F327 P331	S308-E329 CarbonylContact O-C 3.56Å; S308-E329 VanDerWaalsContact O-CA 3.28Å; S308-E329 WeakPolarHBondContact O-CA 3.39Å; Q316-E329 PolarHBondContact NE2-OE1 2.88Å; F327-E329 HydrophobicContact CD1-CG 4.25Å; F327-E329 HydrophobicContact CE1-CG 3.76Å; E329-P331 CarbonylContact O-C 3.57Å
330	K	72.8	Confident	78.5	Confident	53 Å²	53	62 Å²	62	23%	0.23	33%	0.334	C	S	.	.	S	Bend	trans	-80.7	140.4	164.9	-70.2	179	179.8	-177.5	0	109.7	D256 S308 F332	D256-K330 IonicContact OD1-NZ 3.65Å; D256-K330 PolarHBondContact OD1-NZ 3.17Å; S308-K330 PolarHBondContact O-N 3.08Å; K330-F332 HydrophobicContact CG-CD1 3.96Å; K330-F332 HydrophobicContact CG-CE1 3.68Å
331	P	69.9	Low	79	Confident	124 Å²	124	59.4 Å²	59.4	81%	0.805	32%	0.321	S	S	*	.	S	Bend	cis	-76.8	151.6	-5.9	33.4	-34.9	0	0	0	112	E329	E329-P331 CarbonylContact O-C 3.57Å
332	F	75.1	Confident	79.4	Confident	46 Å²	46	54.9 Å²	54.9	20%	0.202	30%	0.295	C	S	.	.			trans	-132.1	154.6	177.6	53.2	-99.7	0	0	0	111.4	I259 I263 L307 I328 K330 L334 L337	I259-F332 HydrophobicContact CG2-CZ 4.47Å; I263-F332 HydrophobicContact CD1-CE2 4.3Å; I263-F332 HydrophobicContact CD1-CZ 3.88Å; I263-F332 HydrophobicContact CG1-CE2 4.47Å; I263-F332 HydrophobicContact CG1-CZ 4.5Å; L307-F332 HydrophobicContact CB-CE1 4.24Å; L307-F332 HydrophobicContact CD1-CE1 4.09Å; L307-F332 HydrophobicContact CD1-CZ 3.88Å; L307-F332 HydrophobicContact CD2-CE1 4.16Å; L307-F332 HydrophobicContact CD2-CZ 4.5Å; L307-F332 HydrophobicContact CG-CE1 4.4Å; I328-F332 HydrophobicContact CG2-CB 3.66Å; I328-F332 HydrophobicContact CG2-CD1 3.87Å; I328-F332 HydrophobicContact CG2-CG 3.87Å; K330-F332 HydrophobicContact CG-CD1 3.96Å; K330-F332 HydrophobicContact CG-CE1 3.68Å; F332-L334 HydrophobicContact CE2-CD2 4.3Å; F332-L337 HydrophobicContact CD2-CB 4.13Å; F332-L337 HydrophobicContact CD2-CD2 4.18Å; F332-L337 HydrophobicContact CE2-CB 4.39Å; F332-L337 HydrophobicContact CE2-CD2 3.6Å; F332-L337 HydrophobicContact CZ-CD2 4.21Å
333	E	77.1	Confident	79.8	Confident	129 Å²	129	50.4 Å²	50.4	60%	0.603	28%	0.279	S	S	*	.			trans	-78.9	129.2	170.5	-70.7	-66.3	154.9	0	0	110.4	T335 I336 L337	E333-T335 PolarHBondContact O-N 2.96Å; E333-I336 HydrophobicContact CB-CB 4.23Å; E333-I336 HydrophobicContact CB-CD1 3.94Å; E333-I336 HydrophobicContact CB-CG1 3.9Å; E333-I336 HydrophobicContact CG-CD1 4.29Å; E333-I336 PolarHBondContact O-N 3.17Å; E333-L337 PolarHBondContact O-N 2.9Å
334	L	79.5	Confident	80.2	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-57.3	-33.3	179.4	-72.6	171.9	0	0	0	112.6	V262 I263 H266 F332 L337 L338	V262-L334 HydrophobicContact CG1-CD1 3.71Å; V262-L334 HydrophobicContact CG1-CD2 4.3Å; I263-L334 HydrophobicContact CG1-CD2 3.98Å; H266-L334 HydrophobicContact CB-CD1 4.36Å; F332-L334 HydrophobicContact CE2-CD2 4.3Å; L334-L337 PolarHBondContact O-N 2.88Å; L334-L338 WeakPolarHBondContact O-CB 3.28Å; L334-L338 PolarHBondContact O-N 3.5Å
335	T	78.8	Confident	79.9	Confident	91 Å²	91	51.5 Å²	51.5	56%	0.558	28%	0.278	S	S	*	.	H	α-helix	trans	-68.5	-37	177.5	54.1	0	0	0	0	112.4	E333 A339	E333-T335 PolarHBondContact O-N 2.96Å; T335-A339 WeakPolarHBondContact O-CB 3.22Å; T335-A339 PolarHBondContact O-N 3.21Å
336	I	77.6	Confident	79.2	Confident	93 Å²	93	53.6 Å²	53.6	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-69.5	-42.8	174.6	-62.7	179.4	0	0	0	109.8	E333 A339 K340	E333-I336 HydrophobicContact CB-CB 4.23Å; E333-I336 HydrophobicContact CB-CD1 3.94Å; E333-I336 HydrophobicContact CB-CG1 3.9Å; E333-I336 HydrophobicContact CG-CD1 4.29Å; E333-I336 PolarHBondContact O-N 3.17Å; I336-A339 PolarHBondContact O-N 2.9Å; I336-K340 HydrophobicContact CG2-CD 4.45Å; I336-K340 WeakPolarHBondContact O-CG 3.41Å; I336-K340 PolarHBondContact O-N 3.32Å
337	L	84.6	Confident	78.2	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-50.3	174.6	174.1	61.7	0	0	0	111.1	I263 L307 I328 F332 E333 L334 A339 K340 I341	I263-L337 HydrophobicContact CD1-CD2 4.14Å; I263-L337 HydrophobicContact CG1-CD2 4.02Å; I263-L337 HydrophobicContact CG2-CD2 4.05Å; L307-L337 HydrophobicContact CD1-CD2 4.41Å; L307-L337 HydrophobicContact CD2-CD1 3.87Å; I328-L337 HydrophobicContact CD1-CD1 3.44Å; I328-L337 VanDerWaalsContact CD1-CD1 3.44Å; F332-L337 HydrophobicContact CD2-CB 4.13Å; F332-L337 HydrophobicContact CD2-CD2 4.18Å; F332-L337 HydrophobicContact CE2-CB 4.39Å; F332-L337 HydrophobicContact CE2-CD2 3.6Å; F332-L337 HydrophobicContact CZ-CD2 4.21Å; E333-L337 PolarHBondContact O-N 2.9Å; L334-L337 PolarHBondContact O-N 2.88Å; L337-A339 PolarHBondContact O-N 2.83Å; L337-K340 PolarHBondContact O-N 3.36Å; L337-I341 HydrophobicContact CD1-CD1 3.89Å; L337-I341 HydrophobicContact CD1-CG1 4.24Å; L337-I341 HydrophobicContact CG-CD1 3.84Å; L337-I341 WeakPolarHBondContact O-CG1 3.38Å; L337-I341 PolarHBondContact O-N 2.95Å
338	L	82	Confident	77.3	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-57	-46.8	176.9	176.8	67.1	0	0	0	111.9	L267 W270 L272 L334 K340 I341 Q342	L267-L338 HydrophobicContact CD2-CD1 3.83Å; W270-L338 HydrophobicContact CB-CD1 4.18Å; W270-L338 HydrophobicContact CB-CD2 4.47Å; W270-L338 HydrophobicContact CD2-CD2 3.63Å; W270-L338 VanDerWaalsContact CE2-CD2 3.5Å; W270-L338 HydrophobicContact CE3-CD2 4.35Å; W270-L338 HydrophobicContact CG-CD1 4.2Å; W270-L338 HydrophobicContact CG-CD2 3.65Å; W270-L338 HydrophobicContact CZ2-CD2 4.12Å; L272-L338 HydrophobicContact CD1-CD1 4.01Å; L334-L338 WeakPolarHBondContact O-CB 3.28Å; L334-L338 PolarHBondContact O-N 3.5Å; L338-K340 VanDerWaalsContact C-N 3.32Å; L338-K340 PolarHBondContact O-N 2.91Å; L338-I341 PolarHBondContact O-N 3.5Å; L338-Q342 HydrophobicContact CD1-CG 4.27Å; L338-Q342 HydrophobicContact CG-CG 4.48Å; L338-Q342 WeakPolarHBondContact O-CB 3.44Å; L338-Q342 WeakPolarHBondContact O-CG 3.46Å; L338-Q342 PolarHBondContact O-N 3.09Å
339	A	79.2	Confident	76	Confident	52 Å²	52	64.7 Å²	64.7	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-40	179.5	0	0	0	0	0	112.2	T335 I336 L337 A343	T335-A339 WeakPolarHBondContact O-CB 3.22Å; T335-A339 PolarHBondContact O-N 3.21Å; I336-A339 PolarHBondContact O-N 2.9Å; L337-A339 PolarHBondContact O-N 2.83Å; A339-A343 WeakPolarHBondContact O-CB 3.29Å; A339-A343 PolarHBondContact O-N 2.87Å
340	K	86.2	Confident	74.8	Confident	61 Å²	61	69 Å²	69	27%	0.265	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-44.5	175.1	-75.6	-175.8	168.8	-132.9	0	111.8	E326 I328 I336 L337 L338 A343 L344	E326-K340 HydrophobicContact CG-CD 4.05Å; E326-K340 IonicContact OE1-NZ 3.37Å; E326-K340 PolarHBondContact OE1-NZ 3.24Å; E326-K340 WeakPolarHBondContact OE2-CE 3.44Å; E326-K340 IonicContact OE2-NZ 3.8Å; E326-K340 PolarHBondContact OE2-NZ 3.46Å; I328-K340 HydrophobicContact CD1-CB 4.33Å; I328-K340 HydrophobicContact CD1-CD 3.52Å; I328-K340 HydrophobicContact CG1-CD 3.76Å; I336-K340 HydrophobicContact CG2-CD 4.45Å; I336-K340 WeakPolarHBondContact O-CG 3.41Å; I336-K340 PolarHBondContact O-N 3.32Å; L337-K340 PolarHBondContact O-N 3.36Å; L338-K340 VanDerWaalsContact C-N 3.32Å; L338-K340 PolarHBondContact O-N 2.91Å; K340-A343 PolarHBondContact O-N 3.5Å; K340-L344 WeakPolarHBondContact O-CG 3.32Å; K340-L344 PolarHBondContact O-N 2.88Å
341	I	85.8	Confident	73.7	Confident	28 Å²	28	76.6 Å²	76.6	14%	0.144	37%	0.372	C	S	.	.	H	α-helix	trans	-57.3	-53.1	174.4	-70.5	165.4	0	0	0	110.1	L267 L272 I305 L337 L338 A343 L344 L345	L267-I341 HydrophobicContact CD1-CD1 3.87Å; L267-I341 HydrophobicContact CD2-CD1 3.68Å; L267-I341 HydrophobicContact CG-CD1 4.43Å; L272-I341 HydrophobicContact CD1-CG2 4.37Å; I305-I341 HydrophobicContact CD1-CB 4.49Å; I305-I341 HydrophobicContact CD1-CG1 3.52Å; L337-I341 HydrophobicContact CD1-CD1 3.89Å; L337-I341 HydrophobicContact CD1-CG1 4.24Å; L337-I341 HydrophobicContact CG-CD1 3.84Å; L337-I341 WeakPolarHBondContact O-CG1 3.38Å; L337-I341 PolarHBondContact O-N 2.95Å; L338-I341 PolarHBondContact O-N 3.5Å; I341-A343 VanDerWaalsContact C-N 3.26Å; I341-A343 PolarHBondContact O-N 2.95Å; I341-L344 PolarHBondContact O-N 3.14Å; I341-L344 VanDerWaalsContact O-N 3.1Å; I341-L345 HydrophobicContact CG2-CD1 3.81Å; I341-L345 HydrophobicContact CG2-CG 4.19Å; I341-L345 WeakPolarHBondContact O-CG 3.41Å; I341-L345 PolarHBondContact O-N 3.19Å
342	Q	78.5	Confident	72.6	Confident	38 Å²	38	72.4 Å²	72.4	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-36.9	178.6	-72.4	176.2	-12.9	0	0	112.5	L338 R346	L338-Q342 HydrophobicContact CD1-CG 4.27Å; L338-Q342 HydrophobicContact CG-CG 4.48Å; L338-Q342 WeakPolarHBondContact O-CB 3.44Å; L338-Q342 WeakPolarHBondContact O-CG 3.46Å; L338-Q342 PolarHBondContact O-N 3.09Å; Q342-R346 WeakPolarHBondContact O-CB 3.11Å; Q342-R346 PolarHBondContact O-N 3.45Å
343	A	77.6	Confident	71.3	Confident	36 Å²	36	79.5 Å²	79.5	30%	0.298	39%	0.385	S	S	.	.	H	α-helix	trans	-66	-41.5	176	0	0	0	0	0	112.6	A339 K340 I341 R347	A339-A343 WeakPolarHBondContact O-CB 3.29Å; A339-A343 PolarHBondContact O-N 2.87Å; K340-A343 PolarHBondContact O-N 3.5Å; I341-A343 VanDerWaalsContact C-N 3.26Å; I341-A343 PolarHBondContact O-N 2.95Å; A343-R347 PolarHBondContact O-N 3.24Å; A343-R347 VanDerWaalsContact O-N 3.17Å
344	L	81	Confident	70	Confident	20 Å²	20	78.9 Å²	78.9	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-69	-43.9	176.7	-72.4	171.4	0	0	0	112.1	P303 I305 D325 E326 K340 I341 R346 R347 S348	P303-L344 HydrophobicContact CB-CB 4.13Å; P303-L344 HydrophobicContact CG-CB 4.49Å; I305-L344 HydrophobicContact CD1-CD1 3.55Å; I305-L344 HydrophobicContact CG1-CD1 3.48Å; I305-L344 VanDerWaalsContact CG1-CD1 3.48Å; D325-L344 HydrophobicContact CB-CD1 4.38Å; D325-L344 HydrophobicContact CB-CD2 3.77Å; E326-L344 HydrophobicContact CB-CD1 3.87Å; K340-L344 WeakPolarHBondContact O-CG 3.32Å; K340-L344 PolarHBondContact O-N 2.88Å; I341-L344 PolarHBondContact O-N 3.14Å; I341-L344 VanDerWaalsContact O-N 3.1Å; L344-R346 VanDerWaalsContact C-N 3.32Å; L344-R346 PolarHBondContact O-N 2.75Å; L344-R347 WeakPolarHBondContact O-CA 3.45Å; L344-R347 WeakPolarHBondContact O-CB 3.12Å; L344-R347 PolarHBondContact O-N 2.94Å; L344-S348 PolarHBondContact O-N 2.9Å; L344-S348 PolarHBondContact O-OG 3.13Å
345	L	74.9	Confident	68.5	Low	33 Å²	33	82.1 Å²	82.1	17%	0.173	40%	0.399	C	S	.	.	H	α-helix	trans	-61.1	-41.7	174.9	-63.4	178.8	0	0	0	110.9	L272 I341 R347 S348 Y349 A367	L272-L345 HydrophobicContact CD2-CD1 3.78Å; I341-L345 HydrophobicContact CG2-CD1 3.81Å; I341-L345 HydrophobicContact CG2-CG 4.19Å; I341-L345 WeakPolarHBondContact O-CG 3.41Å; I341-L345 PolarHBondContact O-N 3.19Å; L345-R347 PolarHBondContact O-N 2.9Å; L345-S348 WeakPolarHBondContact CA-OG 3.44Å; L345-S348 PolarHBondContact O-N 2.96Å; L345-S348 PolarHBondContact O-OG 2.7Å; L345-S348 VanDerWaalsContact O-OG 3.09Å; L345-Y349 HydrophobicContact CB-CD2 4.27Å; L345-Y349 HydrophobicContact CD2-CE2 4.02Å; L345-Y349 WeakPolarHBondContact O-CB 3.37Å; L345-Y349 VanDerWaalsContact O-CD2 3.28Å; L345-Y349 WeakPolarHBondContact O-CD2 3.24Å; L345-Y349 PolarHBondContact O-N 3.4Å; L345-A367 WeakPolarHBondContact CD1-O 3.39Å
346	R	68.2	Low	67.3	Low	102 Å²	102	78.7 Å²	78.7	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-58.2	-36.9	173.8	-170.6	171	55.1	-104	-1.7	112.3	Q342 L344 K350 I368	Q342-R346 WeakPolarHBondContact O-CB 3.11Å; Q342-R346 PolarHBondContact O-N 3.45Å; L344-R346 VanDerWaalsContact C-N 3.32Å; L344-R346 PolarHBondContact O-N 2.75Å; R346-K350 WeakPolarHBondContact O-CB 3.38Å; R346-K350 PolarHBondContact O-N 3.04Å; R346-I368 HydrophobicContact CB-CG2 3.81Å; R346-I368 HydrophobicContact CG-CG2 4.45Å
347	R	67.8	Low	66.3	Low	166 Å²	166	79.7 Å²	79.7	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-73.5	-44.2	179.6	-176	-178.8	176	-167.5	-3.4	111.6	A343 L344 L345 Y351	A343-R347 PolarHBondContact O-N 3.24Å; A343-R347 VanDerWaalsContact O-N 3.17Å; L344-R347 WeakPolarHBondContact O-CA 3.45Å; L344-R347 WeakPolarHBondContact O-CB 3.12Å; L344-R347 PolarHBondContact O-N 2.94Å; L345-R347 PolarHBondContact O-N 2.9Å; R347-Y351 WeakPolarHBondContact O-CD2 2.96Å
348	S	65.5	Low	64.9	Low	35 Å²	35	83.9 Å²	83.9	25%	0.245	41%	0.407	C	S	.	.	H	α-helix	trans	-69.4	-45.4	-179.3	60.4	0	0	0	0	112.1	L344 L345 K350 Y351 G352	L344-S348 PolarHBondContact O-N 2.9Å; L344-S348 PolarHBondContact O-OG 3.13Å; L345-S348 WeakPolarHBondContact CA-OG 3.44Å; L345-S348 PolarHBondContact O-N 2.96Å; L345-S348 PolarHBondContact O-OG 2.7Å; L345-S348 VanDerWaalsContact O-OG 3.09Å; S348-K350 VanDerWaalsContact C-N 3.33Å; S348-K350 PolarHBondContact O-N 2.87Å; S348-Y351 PolarHBondContact O-N 2.88Å; S348-G352 PolarHBondContact O-N 2.76Å; S348-G352 VanDerWaalsContact O-N 3.12Å
349	Y	58.8	Low	63.4	Low	117 Å²	117	88.6 Å²	88.6	46%	0.459	43%	0.428	S	S	.	.	H	α-helix	trans	-79.2	-10.5	-179.2	-72.1	-80.4	0	0	0	114.3	L345 Y351 G352 A367	L345-Y349 HydrophobicContact CB-CD2 4.27Å; L345-Y349 HydrophobicContact CD2-CE2 4.02Å; L345-Y349 WeakPolarHBondContact O-CB 3.37Å; L345-Y349 VanDerWaalsContact O-CD2 3.28Å; L345-Y349 WeakPolarHBondContact O-CD2 3.24Å; L345-Y349 PolarHBondContact O-N 3.4Å; Y349-Y351 PolarHBondContact O-N 2.82Å; Y349-G352 VanDerWaalsContact O-O 3.05Å; Y349-A367 HydrophobicContact CD1-CB 4.47Å; Y349-A367 HydrophobicContact CD2-CB 3.47Å; Y349-A367 VanDerWaalsContact CD2-CB 3.47Å; Y349-A367 HydrophobicContact CE2-CB 3.88Å; Y349-A367 HydrophobicContact CG-CB 3.81Å
350	K	50.7	Low	62.8	Low	160 Å²	160	89.7 Å²	89.7	70%	0.696	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23	165.3	-106.9	-173.4	173.4	-176.2	0	112.6	R346 S348	R346-K350 WeakPolarHBondContact O-CB 3.38Å; R346-K350 PolarHBondContact O-N 3.04Å; S348-K350 VanDerWaalsContact C-N 3.33Å; S348-K350 PolarHBondContact O-N 2.87Å
351	Y	48.7	Very low	61.7	Low	214 Å²	214	92.9 Å²	92.9	84%	0.839	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-25.9	179.5	-74.9	-78.8	0	0	0	113.3	R347 S348 Y349	R347-Y351 WeakPolarHBondContact O-CD2 2.96Å; S348-Y351 PolarHBondContact O-N 2.88Å; Y349-Y351 PolarHBondContact O-N 2.82Å
352	G	46.4	Very low	60.5	Low	36 Å²	36	96.6 Å²	96.6	37%	0.371	47%	0.473	S	S	.	.	S	Bend	trans	-81.7	151	171	0	0	0	0	0	112.6	S348 Y349 Q354	S348-G352 PolarHBondContact O-N 2.76Å; S348-G352 VanDerWaalsContact O-N 3.12Å; Y349-G352 VanDerWaalsContact O-O 3.05Å; G352-Q354 PolarHBondContact O-N 2.91Å
353	Q	49.4	Very low	59.9	Low	194 Å²	194	97.4 Å²	97.4	91%	0.907	48%	0.477	S	S	*	.			trans	-40	111.2	176.3	-70.2	172	3.4	0	0	111.5	L355	Q353-L355 PolarHBondContact O-N 3.3Å
354	Q	48.3	Very low	59.1	Low	116 Å²	116	97.3 Å²	97.3	54%	0.542	47%	0.47	S	S	.	.			trans	-59	101.9	179.1	-100	-176.5	-73.1	0	0	109.7	G352 S356 Q363	G352-Q354 PolarHBondContact O-N 2.91Å; Q354-S356 VanDerWaalsContact CB-OG 3.29Å; Q354-S356 WeakPolarHBondContact CB-OG 3.45Å; Q354-S356 WeakPolarHBondContact CG-OG 3.3Å; Q354-S356 PolarHBondContact NE2-OG 3.44Å; Q354-S356 PolarHBondContact O-N 3.35Å; Q354-Q363 VanDerWaalsContact NE2-NE2 3.2Å
355	L	49.4	Very low	58.3	Low	118 Å²	118	97 Å²	97	62%	0.618	47%	0.469	S	S	*	.			trans	-70.9	75.4	149.3	-76.9	165.9	0	0	0	105.7	Q353 P366	Q353-L355 PolarHBondContact O-N 3.3Å; L355-P366 WeakPolarHBondContact O-CD 3.4Å
356	S	53.5	Low	57.6	Low	20 Å²	20	98 Å²	98	14%	0.14	48%	0.477	C	S	.	.			trans	-122	114.8	177.6	-61.6	0	0	0	0	107.2	Q354 S358 Q363 F364	Q354-S356 VanDerWaalsContact CB-OG 3.29Å; Q354-S356 WeakPolarHBondContact CB-OG 3.45Å; Q354-S356 WeakPolarHBondContact CG-OG 3.3Å; Q354-S356 PolarHBondContact NE2-OG 3.44Å; Q354-S356 PolarHBondContact O-N 3.35Å; S356-S358 PolarHBondContact O-N 2.99Å; S356-Q363 VanDerWaalsContact CB-CD 3.43Å; S356-Q363 VanDerWaalsContact CB-CG 3.5Å; S356-F364 WeakPolarHBondContact CA-O 3.13Å
357	Y	56.7	Low	57.2	Low	113 Å²	113	94 Å²	94	44%	0.443	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	104.8	-177	-58.3	-84.3	0	0	0	107.2	Q363 F364 P366	Y357-Q363 WeakPolarHBondContact O-CA 3.35Å; Y357-F364 HydrophobicContact CD2-CD1 4.06Å; Y357-F364 PolarHBondContact N-O 3.2Å; Y357-F364 PolarHBondContact O-N 2.88Å; Y357-P366 HydrophobicContact CD2-CG 3.97Å; Y357-P366 HydrophobicContact CE2-CG 3.7Å
358	S	53.8	Low	57	Low	92 Å²	92	86.2 Å²	86.2	64%	0.643	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.1	179.4	56.6	0	0	0	0	111	S356 Y362	S356-S358 PolarHBondContact O-N 2.99Å; S358-Y362 CarbonylContact C-O 3.43Å; S358-Y362 WeakPolarHBondContact CA-O 3.34Å
359	F	51.4	Low	56.9	Low	110 Å²	110	85.2 Å²	85.2	48%	0.482	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	106.8	167.8	-170.3	-90.4	0	0	0	110.5	E361 Y362	F359-E361 PolarHBondContact O-N 3.38Å; F359-Y362 CarbonylContact C-O 3.52Å; F359-Y362 PolarHBondContact N-O 3.43Å; F359-Y362 PolarHBondContact O-N 2.94Å; F359-Y362 VanDerWaalsContact O-N 3.1Å
360	G	65.2	Low	57.2	Low	75 Å²	75	81 Å²	81	77%	0.773	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	-129	-173.5	0	0	0	0	0	111.1	Y362	G360-Y362 VanDerWaalsContact C-N 3.28Å
361	E	64.4	Low	57.8	Low	127 Å²	127	73.6 Å²	73.6	59%	0.593	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.8	174.5	-64.4	-105.8	144.6	0	0	112.7	F359 S373 T374	F359-E361 PolarHBondContact O-N 3.38Å; E361-S373 WeakPolarHBondContact O-CA 3.4Å; E361-T374 PolarHBondContact OE2-OG1 3.18Å
362	Y	60.7	Low	58.5	Low	107 Å²	107	65.1 Å²	65.1	42%	0.42	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	142.9	-175	-61.1	-79.5	0	0	0	111.8	S358 F359 G360 I371 Q372	S358-Y362 CarbonylContact C-O 3.43Å; S358-Y362 WeakPolarHBondContact CA-O 3.34Å; F359-Y362 CarbonylContact C-O 3.52Å; F359-Y362 PolarHBondContact N-O 3.43Å; F359-Y362 PolarHBondContact O-N 2.94Å; F359-Y362 VanDerWaalsContact O-N 3.1Å; G360-Y362 VanDerWaalsContact C-N 3.28Å; Y362-I371 HydrophobicContact CD1-CG2 3.8Å; Y362-I371 HydrophobicContact CG-CG2 4.24Å; Y362-Q372 CarbonylContact C-O 3.46Å; Y362-Q372 VanDerWaalsContact CA-O 3.25Å; Y362-Q372 WeakPolarHBondContact CA-O 3.09Å
363	Q	64.6	Low	59.3	Low	55 Å²	55	64.3 Å²	64.3	26%	0.257	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	110.3	-179.7	-172.7	172.6	42.9	0	0	108.7	Q354 S356 Y357 V365 Q372	Q354-Q363 VanDerWaalsContact NE2-NE2 3.2Å; S356-Q363 VanDerWaalsContact CB-CD 3.43Å; S356-Q363 VanDerWaalsContact CB-CG 3.5Å; Y357-Q363 WeakPolarHBondContact O-CA 3.35Å; Q363-V365 HydrophobicContact CG-CG2 4.49Å; Q363-Q372 PolarHBondContact N-O 3.17Å; Q363-Q372 PolarHBondContact O-N 2.79Å
364	F	61.3	Low	59.8	Low	33 Å²	33	59.7 Å²	59.7	15%	0.145	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.9	171.4	174.8	-122.5	0	0	0	109.6	S356 Y357 P366 Q370 I371 L380 P386	S356-F364 WeakPolarHBondContact CA-O 3.13Å; Y357-F364 HydrophobicContact CD2-CD1 4.06Å; Y357-F364 PolarHBondContact N-O 3.2Å; Y357-F364 PolarHBondContact O-N 2.88Å; F364-P366 HydrophobicContact CD1-CG 3.95Å; F364-P366 HydrophobicContact CE1-CB 3.89Å; F364-P366 HydrophobicContact CE1-CG 3.6Å; F364-P366 HydrophobicContact CZ-CB 4.11Å; F364-P366 HydrophobicContact CZ-CG 4.27Å; F364-Q370 WeakPolarHBondContact CD2-O 3.33Å; F364-I371 HydrophobicContact CB-CG1 4.47Å; F364-I371 HydrophobicContact CD2-CG1 4.14Å; F364-L380 HydrophobicContact CD2-CD1 4.07Å; F364-L380 HydrophobicContact CE2-CD1 3.68Å; F364-P386 HydrophobicContact CE1-CG 4.48Å
365	V	64.7	Low	60.2	Low	15 Å²	15	60.6 Å²	60.6	9%	0.091	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	96.9	177.1	-170.8	0	0	0	0	107.9	Q363 A367 I368 N369 Q370 Q372	Q363-V365 HydrophobicContact CG-CG2 4.49Å; V365-A367 HydrophobicContact CG1-CB 4.42Å; V365-A367 PolarHBondContact O-N 3Å; V365-I368 HydrophobicContact CB-CD1 3.9Å; V365-I368 HydrophobicContact CB-CG1 3.67Å; V365-I368 HydrophobicContact CG1-CD1 4Å; V365-I368 HydrophobicContact CG1-CG1 3.69Å; V365-I368 HydrophobicContact CG2-CD1 4.47Å; V365-I368 WeakPolarHBondContact O-CG1 3.25Å; V365-I368 PolarHBondContact O-N 2.83Å; V365-N369 PolarHBondContact O-N 2.89Å; V365-Q370 PolarHBondContact N-O 3.45Å; V365-Q370 PolarHBondContact O-N 3.22Å; V365-Q372 HydrophobicContact CG2-CG 4.25Å
366	P	60.7	Low	60.6	Low	53 Å²	53	58.8 Å²	58.8	34%	0.344	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-54.6	-39.8	-176.8	-20.9	28.2	0	0	0	112.9	L355 Y357 F364 I368 N369	L355-P366 WeakPolarHBondContact O-CD 3.4Å; Y357-P366 HydrophobicContact CD2-CG 3.97Å; Y357-P366 HydrophobicContact CE2-CG 3.7Å; F364-P366 HydrophobicContact CD1-CG 3.95Å; F364-P366 HydrophobicContact CE1-CB 3.89Å; F364-P366 HydrophobicContact CE1-CG 3.6Å; F364-P366 HydrophobicContact CZ-CB 4.11Å; F364-P366 HydrophobicContact CZ-CG 4.27Å; P366-I368 PolarHBondContact O-N 3.45Å; P366-N369 PolarHBondContact O-N 3.44Å; P366-N369 VanDerWaalsContact O-N 3.08Å
367	A	59.5	Low	60.9	Low	18 Å²	18	63.6 Å²	63.6	15%	0.149	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-57.2	-19.5	-177.3	0	0	0	0	0	114.8	L345 Y349 V365	L345-A367 WeakPolarHBondContact CD1-O 3.39Å; Y349-A367 HydrophobicContact CD1-CB 4.47Å; Y349-A367 HydrophobicContact CD2-CB 3.47Å; Y349-A367 VanDerWaalsContact CD2-CB 3.47Å; Y349-A367 HydrophobicContact CE2-CB 3.88Å; Y349-A367 HydrophobicContact CG-CB 3.81Å; V365-A367 HydrophobicContact CG1-CB 4.42Å; V365-A367 PolarHBondContact O-N 3Å
368	I	63.4	Low	61.1	Low	3 Å²	3	59.3 Å²	59.3	2%	0.015	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-127.5	7.4	-178.9	54.6	170.3	0	0	0	112.5	R346 V365 P366 Q370 Q372	R346-I368 HydrophobicContact CB-CG2 3.81Å; R346-I368 HydrophobicContact CG-CG2 4.45Å; V365-I368 HydrophobicContact CB-CD1 3.9Å; V365-I368 HydrophobicContact CB-CG1 3.67Å; V365-I368 HydrophobicContact CG1-CD1 4Å; V365-I368 HydrophobicContact CG1-CG1 3.69Å; V365-I368 HydrophobicContact CG2-CD1 4.47Å; V365-I368 WeakPolarHBondContact O-CG1 3.25Å; V365-I368 PolarHBondContact O-N 2.83Å; P366-I368 PolarHBondContact O-N 3.45Å; I368-Q370 HydrophobicContact CD1-CB 3.78Å; I368-Q370 HydrophobicContact CD1-CG 4.34Å; I368-Q370 HydrophobicContact CG1-CB 3.86Å; I368-Q370 HydrophobicContact CG1-CG 4.39Å; I368-Q370 WeakPolarHBondContact O-CG 3.47Å; I368-Q370 PolarHBondContact O-N 2.91Å; I368-Q370 VanDerWaalsContact O-N 3.17Å; I368-Q372 VanDerWaalsContact CD1-NE2 3.3Å
369	N	63.7	Low	61.4	Low	13 Å²	13	58.6 Å²	58.6	7%	0.07	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.7	45.9	-175	-156.6	26.5	0	0	0	112.7	W270 V365 P366 L380 S385	W270-N369 PolarHBondContact O-ND2 3.04Å; V365-N369 PolarHBondContact O-N 2.89Å; P366-N369 PolarHBondContact O-N 3.44Å; P366-N369 VanDerWaalsContact O-N 3.08Å; N369-L380 PolarHBondContact ND2-O 2.97Å; N369-L380 WeakPolarHBondContact O-CB 3.27Å; N369-L380 PolarHBondContact O-N 3.44Å; N369-S385 VanDerWaalsContact CG-OG 3.26Å; N369-S385 PolarHBondContact ND2-OG 3.46Å; N369-S385 PolarHBondContact OD1-OG 2.86Å
370	Q	64.7	Low	61.6	Low	28 Å²	28	53.5 Å²	53.5	13%	0.131	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149	-176.7	-79.4	170	19.5	0	0	111.4	F364 V365 I368 L378 P379	F364-Q370 WeakPolarHBondContact CD2-O 3.33Å; V365-Q370 PolarHBondContact N-O 3.45Å; V365-Q370 PolarHBondContact O-N 3.22Å; I368-Q370 HydrophobicContact CD1-CB 3.78Å; I368-Q370 HydrophobicContact CD1-CG 4.34Å; I368-Q370 HydrophobicContact CG1-CB 3.86Å; I368-Q370 HydrophobicContact CG1-CG 4.39Å; I368-Q370 WeakPolarHBondContact O-CG 3.47Å; I368-Q370 PolarHBondContact O-N 2.91Å; I368-Q370 VanDerWaalsContact O-N 3.17Å; Q370-L378 VanDerWaalsContact CA-O 3.3Å; Q370-L378 WeakPolarHBondContact CA-O 3.49Å; Q370-P379 HydrophobicContact CG-CB 4.03Å
371	I	62.9	Low	61.1	Low	6 Å²	6	52.8 Å²	52.8	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.9	166.1	-61	155.6	0	0	0	107.8	Y362 F364 L378 L380 L398 L402	Y362-I371 HydrophobicContact CD1-CG2 3.8Å; Y362-I371 HydrophobicContact CG-CG2 4.24Å; F364-I371 HydrophobicContact CB-CG1 4.47Å; F364-I371 HydrophobicContact CD2-CG1 4.14Å; I371-L378 PolarHBondContact N-O 2.76Å; I371-L378 PolarHBondContact O-N 2.76Å; I371-L380 HydrophobicContact CD1-CD1 4.21Å; I371-L380 HydrophobicContact CD1-CD2 3.78Å; I371-L380 HydrophobicContact CD1-CG 4.28Å; I371-L380 HydrophobicContact CG1-CD1 4.27Å; I371-L398 HydrophobicContact CD1-CD1 3.5Å; I371-L398 HydrophobicContact CD1-CD2 3.23Å; I371-L398 HydrophobicContact CD1-CG 3.62Å; I371-L398 HydrophobicContact CG1-CD2 4.18Å; I371-L402 HydrophobicContact CD1-CD1 3.95Å
372	Q	64	Low	60.5	Low	36 Å²	36	49 Å²	49	17%	0.168	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.9	175.6	-59.8	-176.8	8.3	0	0	109.3	Y362 Q363 V365 I368 D376	Y362-Q372 CarbonylContact C-O 3.46Å; Y362-Q372 VanDerWaalsContact CA-O 3.25Å; Y362-Q372 WeakPolarHBondContact CA-O 3.09Å; Q363-Q372 PolarHBondContact N-O 3.17Å; Q363-Q372 PolarHBondContact O-N 2.79Å; V365-Q372 HydrophobicContact CG2-CG 4.25Å; I368-Q372 VanDerWaalsContact CD1-NE2 3.3Å; Q372-D376 CarbonylContact C-O 3.36Å; Q372-D376 WeakPolarHBondContact CA-O 3.4Å
373	S	62.1	Low	60.1	Low	19 Å²	19	51.7 Å²	51.7	13%	0.133	29%	0.287	C	S	.	.			trans	-120.9	174	163.8	178.6	0	0	0	0	108.3	E361 N375 D376	E361-S373 WeakPolarHBondContact O-CA 3.4Å; S373-N375 PolarHBondContact O-N 2.68Å; S373-N375 VanDerWaalsContact O-N 3.13Å; S373-D376 PolarHBondContact N-O 3.1Å
374	T	59.8	Low	59.6	Low	96 Å²	96	50.9 Å²	50.9	59%	0.589	28%	0.283	S	S	*	.	S	Bend	trans	-52.2	-31.6	170.8	48.9	0	0	0	0	112.4	E361	E361-T374 PolarHBondContact OE2-OG1 3.18Å
375	N	57.9	Low	59	Low	136 Å²	136	51.1 Å²	51.1	73%	0.727	29%	0.289	S	S	*	.	S	Bend	trans	-114.3	-19.4	-176.4	-63.9	-32.4	0	0	0	115.4	S373	S373-N375 PolarHBondContact O-N 2.68Å; S373-N375 VanDerWaalsContact O-N 3.13Å
376	D	56.6	Low	58.4	Low	79 Å²	79	53.2 Å²	53.2	42%	0.422	30%	0.303	S	S	.	.			trans	-130.9	148.2	-167.3	-72.7	-45.3	0	0	0	113.5	Q372 S373 L378	Q372-D376 CarbonylContact C-O 3.36Å; Q372-D376 WeakPolarHBondContact CA-O 3.4Å; S373-D376 PolarHBondContact N-O 3.1Å; D376-L378 HydrophobicContact CB-CD1 4.45Å
377	H	60.5	Low	57.6	Low	121 Å²	121	55.3 Å²	55.3	56%	0.56	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	109.9	172.7	-61.3	69.5	0	0	0	108.2
378	L	60.9	Low	56.9	Low	24 Å²	24	60.3 Å²	60.3	13%	0.126	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	111.6	-174.7	-85.3	143.8	0	0	0	110.3	Q370 I371 D376 L402	Q370-L378 VanDerWaalsContact CA-O 3.3Å; Q370-L378 WeakPolarHBondContact CA-O 3.49Å; I371-L378 PolarHBondContact N-O 2.76Å; I371-L378 PolarHBondContact O-N 2.76Å; D376-L378 HydrophobicContact CB-CD1 4.45Å; L378-L402 HydrophobicContact CB-CD2 4.29Å; L378-L402 HydrophobicContact CD1-CD1 4.33Å; L378-L402 HydrophobicContact CD1-CD2 3.8Å; L378-L402 HydrophobicContact CD2-CD2 3.89Å; L378-L402 HydrophobicContact CG-CD2 4.2Å
379	P	60.2	Low	55.9	Low	76 Å²	76	68.7 Å²	68.7	49%	0.494	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	134.3	170.1	28.7	-31.6	0	0	0	111.2	Q370	Q370-P379 HydrophobicContact CG-CB 4.03Å
380	L	55.2	Low	55.2	Low	4 Å²	4	71 Å²	71	2%	0.021	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-89.6	146.1	173.9	-62.7	174.8	0	0	0	110.5	F364 N369 I371 E384 Y394 L398	F364-L380 HydrophobicContact CD2-CD1 4.07Å; F364-L380 HydrophobicContact CE2-CD1 3.68Å; N369-L380 PolarHBondContact ND2-O 2.97Å; N369-L380 WeakPolarHBondContact O-CB 3.27Å; N369-L380 PolarHBondContact O-N 3.44Å; I371-L380 HydrophobicContact CD1-CD1 4.21Å; I371-L380 HydrophobicContact CD1-CD2 3.78Å; I371-L380 HydrophobicContact CD1-CG 4.28Å; I371-L380 HydrophobicContact CG1-CD1 4.27Å; L380-E384 WeakPolarHBondContact CA-OE2 3.1Å; L380-E384 HydrophobicContact CB-CB 4.12Å; L380-E384 HydrophobicContact CD2-CB 4.05Å; L380-Y394 WeakPolarHBondContact CD1-OH 3.49Å; L380-L398 HydrophobicContact CD2-CD1 3.61Å
381	T	56.1	Low	54.5	Low	59 Å²	59	74 Å²	74	36%	0.362	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-83	159.4	170.2	61.6	0	0	0	0	110.6	N383 E384	T381-N383 VanDerWaalsContact C-N 3.25Å; T381-N383 PolarHBondContact O-N 2.75Å; T381-N383 VanDerWaalsContact O-N 3.14Å; T381-E384 PolarHBondContact N-OE2 3.36Å; T381-E384 WeakPolarHBondContact O-CA 3.3Å; T381-E384 WeakPolarHBondContact O-CB 3.49Å; T381-E384 PolarHBondContact O-N 3.29Å; T381-E384 WeakPolarHBondContact OG1-CG 3.42Å; T381-E384 PolarHBondContact OG1-OE2 3.26Å
382	P	50.4	Low	53.9	Low	48 Å²	48	81.1 Å²	81.1	31%	0.312	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-40.4	-46.6	173.7	-39.1	40.7	0	0	0	116.2	Q269 W270 E384 S385	Q269-P382 WeakPolarHBondContact O-CA 3.36Å; Q269-P382 WeakPolarHBondContact O-CB 3.4Å; Q269-P382 WeakPolarHBondContact O-CG 3.49Å; W270-P382 HydrophobicContact CD2-CG 4.3Å; W270-P382 HydrophobicContact CE3-CG 4.46Å; P382-E384 PolarHBondContact O-N 3.03Å; P382-S385 PolarHBondContact O-N 3.35Å
383	N	52.1	Low	53.1	Low	164 Å²	164	83.9 Å²	83.9	88%	0.877	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-71.4	-10.7	-176.4	-68.6	-14.2	0	0	0	112.8	T381	T381-N383 VanDerWaalsContact C-N 3.25Å; T381-N383 PolarHBondContact O-N 2.75Å; T381-N383 VanDerWaalsContact O-N 3.14Å
384	E	54	Low	52.8	Low	38 Å²	38	84.9 Å²	84.9	18%	0.178	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-101	4.6	178.8	-61	164.9	149.3	0	0	111.3	L380 T381 P382 Y394 V401	L380-E384 WeakPolarHBondContact CA-OE2 3.1Å; L380-E384 HydrophobicContact CB-CB 4.12Å; L380-E384 HydrophobicContact CD2-CB 4.05Å; T381-E384 PolarHBondContact N-OE2 3.36Å; T381-E384 WeakPolarHBondContact O-CA 3.3Å; T381-E384 WeakPolarHBondContact O-CB 3.49Å; T381-E384 PolarHBondContact O-N 3.29Å; T381-E384 WeakPolarHBondContact OG1-CG 3.42Å; T381-E384 PolarHBondContact OG1-OE2 3.26Å; P382-E384 PolarHBondContact O-N 3.03Å; E384-Y394 WeakPolarHBondContact O-CE2 3.32Å; E384-Y394 VanDerWaalsContact O-CZ 3.24Å; E384-Y394 PolarHBondContact O-OH 2.95Å; E384-V401 VanDerWaalsContact OE1-CG1 3.32Å; E384-V401 WeakPolarHBondContact OE1-CG1 3.46Å
385	S	49.6	Very low	52.7	Low	38 Å²	38	82.5 Å²	82.5	27%	0.266	46%	0.464	S	S	.	.			trans	-87.3	125.7	178.4	-66.3	0	0	0	0	112.8	N369 P382	N369-S385 VanDerWaalsContact CG-OG 3.26Å; N369-S385 PolarHBondContact ND2-OG 3.46Å; N369-S385 PolarHBondContact OD1-OG 2.86Å; P382-S385 PolarHBondContact O-N 3.35Å
386	P	52	Low	52.7	Low	59 Å²	59	80.7 Å²	80.7	38%	0.383	45%	0.454	S	S	.	.			trans	-90.6	139.9	-172.3	32.5	-33.1	0	0	0	114.2	F364 Y394	F364-P386 HydrophobicContact CE1-CG 4.48Å; P386-Y394 HydrophobicContact CB-CD1 3.97Å; P386-Y394 HydrophobicContact CB-CD2 3.88Å; P386-Y394 HydrophobicContact CB-CE1 4.03Å; P386-Y394 HydrophobicContact CB-CE2 3.95Å; P386-Y394 HydrophobicContact CB-CG 3.9Å; P386-Y394 HydrophobicContact CG-CD1 4.07Å; P386-Y394 HydrophobicContact CG-CD2 4.5Å; P386-Y394 HydrophobicContact CG-CE1 3.69Å; P386-Y394 HydrophobicContact CG-CE2 4.16Å; P386-Y394 HydrophobicContact CG-CG 4.47Å
387	A	45.1	Very low	52.7	Low	96 Å²	96	79.3 Å²	79.3	79%	0.793	45%	0.454	S	S	*	.			trans	-112.2	-16.4	-178.5	0	0	0	0	0	116.7
388	T	44.7	Very low	52.8	Low	124 Å²	124	74.6 Å²	74.6	76%	0.761	43%	0.433	S	S	*	.	S	Bend	trans	-161.8	174.8	-175.9	35.1	0	0	0	0	112.3	S390	T388-S390 PolarHBondContact O-N 3.17Å
389	L	40.6	Very low	53	Low	178 Å²	178	79.1 Å²	79.1	93%	0.932	45%	0.449	S	S	*	.	S	Bend	trans	-46	17.7	-171.6	-152.8	73.6	0	0	0	119	E391	L389-E391 PolarHBondContact O-N 2.78Å
390	S	50.9	Low	53.2	Low	63 Å²	63	80.8 Å²	80.8	44%	0.441	45%	0.453	S	S	.	.			trans	-81.1	18.7	166.8	-164.5	0	0	0	0	112.2	T388 Q392 T393 Y394	T388-S390 PolarHBondContact O-N 3.17Å; S390-Q392 PolarHBondContact O-N 3.1Å; S390-T393 CarbonylContact O-C 3.52Å; S390-T393 WeakPolarHBondContact O-CA 3.4Å; S390-T393 VanDerWaalsContact O-CB 3.32Å; S390-T393 WeakPolarHBondContact O-CB 3.42Å; S390-T393 PolarHBondContact O-N 2.84Å; S390-T393 WeakPolarHBondContact OG-CB 3.4Å; S390-Y394 WeakPolarHBondContact O-CB 3.34Å; S390-Y394 PolarHBondContact O-N 3.43Å
391	E	50	Low	53.9	Low	91 Å²	91	83.4 Å²	83.4	43%	0.425	47%	0.469	S	S	.	.	H	α-helix	trans	-59.9	-42.2	-162.5	-161.1	-176.5	169.5	0	0	114.4	L389 Y394 Q395	L389-E391 PolarHBondContact O-N 2.78Å; E391-Y394 PolarHBondContact O-N 2.86Å; E391-Q395 VanDerWaalsContact O-CB 3.31Å; E391-Q395 WeakPolarHBondContact O-CB 3.22Å; E391-Q395 WeakPolarHBondContact O-CG 3.47Å; E391-Q395 PolarHBondContact O-N 3.5Å
392	Q	50	Low	54.5	Low	154 Å²	154	81.6 Å²	81.6	72%	0.72	46%	0.457	S	S	*	.	H	α-helix	trans	-66.5	-38.7	174	-76.3	-176.2	-4.3	0	0	112.3	S390 Q395 N396	S390-Q392 PolarHBondContact O-N 3.1Å; Q392-Q395 PolarHBondContact O-N 3.25Å; Q392-N396 WeakPolarHBondContact O-CB 3.38Å; Q392-N396 PolarHBondContact O-N 3.41Å; Q392-N396 PolarHBondContact O-ND2 3.3Å
393	T	47.2	Very low	55.8	Low	94 Å²	94	83.9 Å²	83.9	58%	0.577	46%	0.463	S	S	*	.	H	α-helix	trans	-65.6	-43	175.9	-50.2	0	0	0	0	110.3	S390 N396 A397	S390-T393 CarbonylContact O-C 3.52Å; S390-T393 WeakPolarHBondContact O-CA 3.4Å; S390-T393 VanDerWaalsContact O-CB 3.32Å; S390-T393 WeakPolarHBondContact O-CB 3.42Å; S390-T393 PolarHBondContact O-N 2.84Å; S390-T393 WeakPolarHBondContact OG-CB 3.4Å; T393-N396 PolarHBondContact O-N 3.44Å; T393-A397 WeakPolarHBondContact O-CB 3.3Å; T393-A397 PolarHBondContact O-N 3.23Å
394	Y	55.1	Low	56.9	Low	40 Å²	40	78.8 Å²	78.8	16%	0.157	44%	0.438	C	S	.	.	H	α-helix	trans	-62.2	-45.5	173.8	172.1	-99.4	0	0	0	111	L380 E384 P386 S390 E391 N396 A397 L398	L380-Y394 WeakPolarHBondContact CD1-OH 3.49Å; E384-Y394 WeakPolarHBondContact O-CE2 3.32Å; E384-Y394 VanDerWaalsContact O-CZ 3.24Å; E384-Y394 PolarHBondContact O-OH 2.95Å; P386-Y394 HydrophobicContact CB-CD1 3.97Å; P386-Y394 HydrophobicContact CB-CD2 3.88Å; P386-Y394 HydrophobicContact CB-CE1 4.03Å; P386-Y394 HydrophobicContact CB-CE2 3.95Å; P386-Y394 HydrophobicContact CB-CG 3.9Å; P386-Y394 HydrophobicContact CG-CD1 4.07Å; P386-Y394 HydrophobicContact CG-CD2 4.5Å; P386-Y394 HydrophobicContact CG-CE1 3.69Å; P386-Y394 HydrophobicContact CG-CE2 4.16Å; P386-Y394 HydrophobicContact CG-CG 4.47Å; S390-Y394 WeakPolarHBondContact O-CB 3.34Å; S390-Y394 PolarHBondContact O-N 3.43Å; E391-Y394 PolarHBondContact O-N 2.86Å; Y394-N396 PolarHBondContact O-N 3.07Å; Y394-A397 PolarHBondContact O-N 2.97Å; Y394-L398 HydrophobicContact CE1-CD2 3.83Å; Y394-L398 WeakPolarHBondContact O-CB 3.22Å; Y394-L398 PolarHBondContact O-N 3.49Å
395	Q	57.8	Low	57.9	Low	47 Å²	47	80.7 Å²	80.7	22%	0.22	45%	0.446	C	S	.	.	H	α-helix	trans	-61.2	-40.8	176.2	-75.7	167.8	5.2	0	0	112.4	E391 Q392 R399	E391-Q395 VanDerWaalsContact O-CB 3.31Å; E391-Q395 WeakPolarHBondContact O-CB 3.22Å; E391-Q395 WeakPolarHBondContact O-CG 3.47Å; E391-Q395 PolarHBondContact O-N 3.5Å; Q392-Q395 PolarHBondContact O-N 3.25Å; Q395-R399 WeakPolarHBondContact O-CB 3.4Å; Q395-R399 PolarHBondContact O-N 3.36Å
396	N	59	Low	59.2	Low	97 Å²	97	81.7 Å²	81.7	52%	0.519	45%	0.448	S	S	.	.	H	α-helix	trans	-68.1	-43.6	175.1	-74.9	-23.8	0	0	0	111.6	Q392 T393 Y394 L398 R399 L400	Q392-N396 WeakPolarHBondContact O-CB 3.38Å; Q392-N396 PolarHBondContact O-N 3.41Å; Q392-N396 PolarHBondContact O-ND2 3.3Å; T393-N396 PolarHBondContact O-N 3.44Å; Y394-N396 PolarHBondContact O-N 3.07Å; N396-L398 VanDerWaalsContact C-N 3.32Å; N396-L398 PolarHBondContact O-N 2.93Å; N396-R399 PolarHBondContact O-N 2.96Å; N396-L400 WeakPolarHBondContact O-CB 3.28Å; N396-L400 PolarHBondContact O-N 3.33Å
397	A	56.3	Low	60.6	Low	51 Å²	51	84.7 Å²	84.7	42%	0.421	46%	0.457	S	S	.	.	H	α-helix	trans	-61.4	-43.6	175.4	0	0	0	0	0	111	T393 Y394 L400 V401	T393-A397 WeakPolarHBondContact O-CB 3.3Å; T393-A397 PolarHBondContact O-N 3.23Å; Y394-A397 PolarHBondContact O-N 2.97Å; A397-L400 WeakPolarHBondContact O-CB 3.18Å; A397-L400 PolarHBondContact O-N 3.01Å; A397-V401 VanDerWaalsContact O-CG2 3.25Å; A397-V401 WeakPolarHBondContact O-CG2 3.34Å; A397-V401 PolarHBondContact O-N 3.25Å
398	L	61.5	Low	62.2	Low	22 Å²	22	86.2 Å²	86.2	12%	0.115	45%	0.448	C	S	.	.	H	α-helix	trans	-65.6	-43.4	179	178.7	64.9	0	0	0	112.1	I371 L380 Y394 N396 L400 V401 L402	I371-L398 HydrophobicContact CD1-CD1 3.5Å; I371-L398 HydrophobicContact CD1-CD2 3.23Å; I371-L398 HydrophobicContact CD1-CG 3.62Å; I371-L398 HydrophobicContact CG1-CD2 4.18Å; L380-L398 HydrophobicContact CD2-CD1 3.61Å; Y394-L398 HydrophobicContact CE1-CD2 3.83Å; Y394-L398 WeakPolarHBondContact O-CB 3.22Å; Y394-L398 PolarHBondContact O-N 3.49Å; N396-L398 VanDerWaalsContact C-N 3.32Å; N396-L398 PolarHBondContact O-N 2.93Å; L398-L400 VanDerWaalsContact C-N 3.3Å; L398-L400 PolarHBondContact O-N 2.9Å; L398-V401 PolarHBondContact O-N 2.95Å; L398-L402 HydrophobicContact CD1-CG 4.35Å; L398-L402 HydrophobicContact CG-CD1 4.4Å; L398-L402 WeakPolarHBondContact O-CB 3.49Å; L398-L402 WeakPolarHBondContact O-CG 3.23Å; L398-L402 PolarHBondContact O-N 2.87Å
399	R	64.5	Low	63.9	Low	119 Å²	119	85 Å²	85	45%	0.449	43%	0.433	S	S	.	.	H	α-helix	trans	-57.4	-47.1	172	-173.7	-171	-55.7	177.5	5.7	110.6	Q395 N396 V401 L402 E403	Q395-R399 WeakPolarHBondContact O-CB 3.4Å; Q395-R399 PolarHBondContact O-N 3.36Å; N396-R399 PolarHBondContact O-N 2.96Å; R399-V401 VanDerWaalsContact C-N 3.32Å; R399-V401 PolarHBondContact O-N 3Å; R399-L402 PolarHBondContact O-N 3.3Å; R399-E403 WeakPolarHBondContact CD-OE1 3.3Å; R399-E403 HydrophobicContact CG-CG 4.33Å; R399-E403 VanDerWaalsContact CG-OE1 3.32Å; R399-E403 WeakPolarHBondContact CG-OE1 3.21Å; R399-E403 WeakPolarHBondContact O-CB 3.27Å; R399-E403 WeakPolarHBondContact O-CG 3.39Å; R399-E403 PolarHBondContact O-N 3.28Å
400	L	65.8	Low	65.8	Low	110 Å²	110	82.6 Å²	82.6	58%	0.576	42%	0.417	S	S	*	.	H	α-helix	trans	-61.5	-41.9	178.9	-170.3	72.2	0	0	0	111.4	N396 A397 L398 T404	N396-L400 WeakPolarHBondContact O-CB 3.28Å; N396-L400 PolarHBondContact O-N 3.33Å; A397-L400 WeakPolarHBondContact O-CB 3.18Å; A397-L400 PolarHBondContact O-N 3.01Å; L398-L400 VanDerWaalsContact C-N 3.3Å; L398-L400 PolarHBondContact O-N 2.9Å; L400-T404 VanDerWaalsContact O-CB 3.23Å; L400-T404 WeakPolarHBondContact O-CB 3.26Å; L400-T404 PolarHBondContact O-N 2.89Å; L400-T404 PolarHBondContact O-OG1 3.45Å
401	V	70.2	Confident	67.2	Low	59 Å²	59	82.5 Å²	82.5	36%	0.358	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-45.2	177.2	170	0	0	0	0	111.3	E384 A397 L398 R399 T404 K405	E384-V401 VanDerWaalsContact OE1-CG1 3.32Å; E384-V401 WeakPolarHBondContact OE1-CG1 3.46Å; A397-V401 VanDerWaalsContact O-CG2 3.25Å; A397-V401 WeakPolarHBondContact O-CG2 3.34Å; A397-V401 PolarHBondContact O-N 3.25Å; L398-V401 PolarHBondContact O-N 2.95Å; R399-V401 VanDerWaalsContact C-N 3.32Å; R399-V401 PolarHBondContact O-N 3Å; V401-T404 PolarHBondContact O-N 3.33Å; V401-K405 VanDerWaalsContact O-CB 3.29Å; V401-K405 WeakPolarHBondContact O-CB 3.2Å; V401-K405 PolarHBondContact O-N 3.41Å
402	L	68.9	Low	68.6	Low	21 Å²	21	82.9 Å²	82.9	11%	0.11	43%	0.425	C	S	.	.	H	α-helix	trans	-66.3	-44.5	178.4	-72	-178.3	0	0	0	112.2	I371 L378 L398 R399 T404 K405 N406	I371-L402 HydrophobicContact CD1-CD1 3.95Å; L378-L402 HydrophobicContact CB-CD2 4.29Å; L378-L402 HydrophobicContact CD1-CD1 4.33Å; L378-L402 HydrophobicContact CD1-CD2 3.8Å; L378-L402 HydrophobicContact CD2-CD2 3.89Å; L378-L402 HydrophobicContact CG-CD2 4.2Å; L398-L402 HydrophobicContact CD1-CG 4.35Å; L398-L402 HydrophobicContact CG-CD1 4.4Å; L398-L402 WeakPolarHBondContact O-CB 3.49Å; L398-L402 WeakPolarHBondContact O-CG 3.23Å; L398-L402 PolarHBondContact O-N 2.87Å; R399-L402 PolarHBondContact O-N 3.3Å; L402-T404 VanDerWaalsContact C-N 3.29Å; L402-T404 PolarHBondContact O-N 2.91Å; L402-K405 PolarHBondContact O-N 3.36Å; L402-N406 WeakPolarHBondContact O-CB 3.46Å; L402-N406 PolarHBondContact O-N 3.29Å
403	E	77.3	Confident	70	Confident	97 Å²	97	80.7 Å²	80.7	45%	0.453	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-44.7	173.3	-76.2	175.3	-171.5	0	0	110.4	R399 Q407	R399-E403 WeakPolarHBondContact CD-OE1 3.3Å; R399-E403 HydrophobicContact CG-CG 4.33Å; R399-E403 VanDerWaalsContact CG-OE1 3.32Å; R399-E403 WeakPolarHBondContact CG-OE1 3.21Å; R399-E403 WeakPolarHBondContact O-CB 3.27Å; R399-E403 WeakPolarHBondContact O-CG 3.39Å; R399-E403 PolarHBondContact O-N 3.28Å; E403-Q407 WeakPolarHBondContact O-CB 3.36Å; E403-Q407 WeakPolarHBondContact O-CG 3.5Å; E403-Q407 PolarHBondContact O-N 2.95Å
404	T	75.4	Confident	71.6	Confident	56 Å²	56	80.6 Å²	80.6	34%	0.344	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-43.4	176.8	-58.5	0	0	0	0	111.6	L400 V401 L402 Q407 Q408	L400-T404 VanDerWaalsContact O-CB 3.23Å; L400-T404 WeakPolarHBondContact O-CB 3.26Å; L400-T404 PolarHBondContact O-N 2.89Å; L400-T404 PolarHBondContact O-OG1 3.45Å; V401-T404 PolarHBondContact O-N 3.33Å; L402-T404 VanDerWaalsContact C-N 3.29Å; L402-T404 PolarHBondContact O-N 2.91Å; T404-Q407 PolarHBondContact O-N 3.37Å; T404-Q408 HydrophobicContact CG2-CG 4.42Å; T404-Q408 WeakPolarHBondContact O-CB 3.11Å; T404-Q408 VanDerWaalsContact O-CG 3.24Å; T404-Q408 WeakPolarHBondContact O-CG 3.37Å; T404-Q408 PolarHBondContact O-N 3.49Å
405	K	74.5	Confident	72.6	Confident	79 Å²	79	85.4 Å²	85.4	34%	0.343	43%	0.426	S	S	.	.	H	α-helix	trans	-67.8	-43.1	-179.1	-173.8	172.2	-176	163.7	0	111.8	V401 L402 Q408 Q409	V401-K405 VanDerWaalsContact O-CB 3.29Å; V401-K405 WeakPolarHBondContact O-CB 3.2Å; V401-K405 PolarHBondContact O-N 3.41Å; L402-K405 PolarHBondContact O-N 3.36Å; K405-Q408 PolarHBondContact O-N 2.89Å; K405-Q409 WeakPolarHBondContact O-CB 3.48Å; K405-Q409 PolarHBondContact O-N 3.26Å
406	N	76.8	Confident	73.5	Confident	58 Å²	58	88.4 Å²	88.4	31%	0.31	44%	0.44	S	S	.	.	H	α-helix	trans	-62.7	-44.4	174.1	-79.5	-7.4	0	0	0	110.7	L402 Q408 Q409 E410	L402-N406 WeakPolarHBondContact O-CB 3.46Å; L402-N406 PolarHBondContact O-N 3.29Å; N406-Q408 VanDerWaalsContact C-N 3.35Å; N406-Q408 PolarHBondContact O-N 3.07Å; N406-Q409 PolarHBondContact O-N 3.14Å; N406-E410 WeakPolarHBondContact O-CB 3.37Å; N406-E410 WeakPolarHBondContact O-CG 3.33Å; N406-E410 PolarHBondContact O-N 3.09Å
407	Q	82	Confident	74.6	Confident	122 Å²	122	89.3 Å²	89.3	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-60.9	-41.3	174.3	-74.7	172.6	7.4	0	0	112.5	E403 T404 A411	E403-Q407 WeakPolarHBondContact O-CB 3.36Å; E403-Q407 WeakPolarHBondContact O-CG 3.5Å; E403-Q407 PolarHBondContact O-N 2.95Å; T404-Q407 PolarHBondContact O-N 3.37Å; Q407-A411 WeakPolarHBondContact O-CB 3.43Å; Q407-A411 PolarHBondContact O-N 2.85Å
408	Q	78.2	Confident	75.5	Confident	128 Å²	128	90 Å²	90	60%	0.598	44%	0.435	S	S	*	.	H	α-helix	trans	-64.9	-41.1	175.6	-76.6	174.8	0	0	0	112	T404 K405 N406 A411 L412	T404-Q408 HydrophobicContact CG2-CG 4.42Å; T404-Q408 WeakPolarHBondContact O-CB 3.11Å; T404-Q408 VanDerWaalsContact O-CG 3.24Å; T404-Q408 WeakPolarHBondContact O-CG 3.37Å; T404-Q408 PolarHBondContact O-N 3.49Å; K405-Q408 PolarHBondContact O-N 2.89Å; N406-Q408 VanDerWaalsContact C-N 3.35Å; N406-Q408 PolarHBondContact O-N 3.07Å; Q408-A411 PolarHBondContact O-N 3.4Å; Q408-L412 WeakPolarHBondContact O-CB 3.33Å; Q408-L412 PolarHBondContact O-N 3.46Å
409	Q	79.2	Confident	76.1	Confident	99 Å²	99	90.9 Å²	90.9	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-68	-45.4	177.9	-178.3	175.2	-37.8	0	0	111.4	K405 N406 A411 L412 Q413	K405-Q409 WeakPolarHBondContact O-CB 3.48Å; K405-Q409 PolarHBondContact O-N 3.26Å; N406-Q409 PolarHBondContact O-N 3.14Å; Q409-A411 VanDerWaalsContact C-N 3.33Å; Q409-A411 PolarHBondContact O-N 3.27Å; Q409-L412 PolarHBondContact O-N 3.11Å; Q409-Q413 WeakPolarHBondContact O-CB 3.29Å; Q409-Q413 WeakPolarHBondContact O-CG 3.32Å; Q409-Q413 PolarHBondContact O-N 3.3Å
410	E	80.5	Confident	76.7	Confident	127 Å²	127	91 Å²	91	59%	0.593	45%	0.448	S	S	*	.	H	α-helix	trans	-60.4	-43.6	173.7	-74.7	177.9	-179.9	0	0	110.9	N406 L412 Q413 Q414	N406-E410 WeakPolarHBondContact O-CB 3.37Å; N406-E410 WeakPolarHBondContact O-CG 3.33Å; N406-E410 PolarHBondContact O-N 3.09Å; E410-L412 PolarHBondContact O-N 3.03Å; E410-Q413 PolarHBondContact O-N 3.41Å; E410-Q414 WeakPolarHBondContact O-CB 3.36Å; E410-Q414 PolarHBondContact O-N 2.86Å
411	A	81.3	Confident	77.2	Confident	61 Å²	61	90.2 Å²	90.2	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-40.1	175.6	0	0	0	0	0	112.2	Q407 Q408 Q409 R415	Q407-A411 WeakPolarHBondContact O-CB 3.43Å; Q407-A411 PolarHBondContact O-N 2.85Å; Q408-A411 PolarHBondContact O-N 3.4Å; Q409-A411 VanDerWaalsContact C-N 3.33Å; Q409-A411 PolarHBondContact O-N 3.27Å; A411-R415 WeakPolarHBondContact O-CB 3.4Å; A411-R415 PolarHBondContact O-N 3.26Å
412	L	79.2	Confident	77.4	Confident	99 Å²	99	87.5 Å²	87.5	52%	0.518	43%	0.428	S	S	.	.	H	α-helix	trans	-65.9	-46.6	175.9	-178.7	66.6	0	0	0	111.4	Q408 Q409 E410 R415 Q416	Q408-L412 WeakPolarHBondContact O-CB 3.33Å; Q408-L412 PolarHBondContact O-N 3.46Å; Q409-L412 PolarHBondContact O-N 3.11Å; E410-L412 PolarHBondContact O-N 3.03Å; L412-R415 PolarHBondContact O-N 3.29Å; L412-Q416 WeakPolarHBondContact O-CG 3.33Å; L412-Q416 PolarHBondContact O-N 2.93Å
413	Q	79.7	Confident	77.7	Confident	109 Å²	109	89.5 Å²	89.5	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-62.6	-43.4	177.1	-74.5	180	-10	0	0	111.3	Q409 E410 Q416 K417	Q409-Q413 WeakPolarHBondContact O-CB 3.29Å; Q409-Q413 WeakPolarHBondContact O-CG 3.32Å; Q409-Q413 PolarHBondContact O-N 3.3Å; E410-Q413 PolarHBondContact O-N 3.41Å; Q413-Q416 PolarHBondContact O-N 3.13Å; Q413-K417 WeakPolarHBondContact O-CB 3.21Å; Q413-K417 PolarHBondContact O-N 3.35Å
414	Q	80.7	Confident	77.7	Confident	92 Å²	92	86.9 Å²	86.9	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-42.7	175.9	-173.8	57.9	41.1	0	0	110.9	E410 Q416 K417 D418	E410-Q414 WeakPolarHBondContact O-CB 3.36Å; E410-Q414 PolarHBondContact O-N 2.86Å; Q414-Q416 PolarHBondContact O-N 2.94Å; Q414-K417 PolarHBondContact O-N 3.33Å; Q414-D418 PolarHBondContact NE2-OD1 2.97Å; Q414-D418 PolarHBondContact NE2-OD2 3.48Å; Q414-D418 WeakPolarHBondContact O-CB 3.38Å; Q414-D418 PolarHBondContact O-N 3.36Å
415	R	75	Confident	77.7	Confident	141 Å²	141	87 Å²	87	53%	0.532	43%	0.434	S	S	.	.	H	α-helix	trans	-62.2	-42.3	175.6	-173.1	175.8	-170.6	159.1	0.1	112.4	A411 L412 M419	A411-R415 WeakPolarHBondContact O-CB 3.4Å; A411-R415 PolarHBondContact O-N 3.26Å; L412-R415 PolarHBondContact O-N 3.29Å; R415-M419 VanDerWaalsContact O-CB 3.29Å; R415-M419 WeakPolarHBondContact O-CB 3.38Å; R415-M419 PolarHBondContact O-N 2.85Å
416	Q	77.9	Confident	77.8	Confident	110 Å²	110	83.3 Å²	83.3	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-42.4	175.3	-74.8	179.2	0.8	0	0	111.5	L412 Q413 Q414 M419 L420	L412-Q416 WeakPolarHBondContact O-CG 3.33Å; L412-Q416 PolarHBondContact O-N 2.93Å; Q413-Q416 PolarHBondContact O-N 3.13Å; Q414-Q416 PolarHBondContact O-N 2.94Å; Q416-M419 WeakPolarHBondContact O-CB 3.29Å; Q416-M419 PolarHBondContact O-N 2.8Å; Q416-L420 WeakPolarHBondContact O-CG 3.34Å; Q416-L420 PolarHBondContact O-N 3.35Å
417	K	81	Confident	77.9	Confident	115 Å²	115	86.6 Å²	86.6	50%	0.5	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-48.7	175.7	-178.2	-179.3	174.9	-176.2	0	111.6	Q413 Q414 M419 L420 D421	Q413-K417 WeakPolarHBondContact O-CB 3.21Å; Q413-K417 PolarHBondContact O-N 3.35Å; Q414-K417 PolarHBondContact O-N 3.33Å; K417-M419 PolarHBondContact O-N 2.88Å; K417-L420 PolarHBondContact O-N 3.47Å; K417-L420 VanDerWaalsContact O-N 3.13Å; K417-D421 PolarHBondContact O-N 2.89Å
418	D	76.4	Confident	77.8	Confident	66 Å²	66	86.4 Å²	86.4	35%	0.353	43%	0.434	S	S	.	.	H	α-helix	trans	-59.3	-39	177.5	-70.2	-24.2	0	0	0	111.2	Q414 D421 D422	Q414-D418 PolarHBondContact NE2-OD1 2.97Å; Q414-D418 PolarHBondContact NE2-OD2 3.48Å; Q414-D418 WeakPolarHBondContact O-CB 3.38Å; Q414-D418 PolarHBondContact O-N 3.36Å; D418-D421 PolarHBondContact O-N 2.8Å; D418-D422 WeakPolarHBondContact O-CB 3.44Å; D418-D422 PolarHBondContact O-N 2.85Å
419	M	74.3	Confident	77.8	Confident	41 Å²	41	82.3 Å²	82.3	20%	0.202	41%	0.414	C	S	.	.	H	α-helix	trans	-63.3	-45.9	174.6	-168.3	179.1	-173.1	0	0	112.3	R415 Q416 K417 D422 F423 Y468 M469 N472 L473	R415-M419 VanDerWaalsContact O-CB 3.29Å; R415-M419 WeakPolarHBondContact O-CB 3.38Å; R415-M419 PolarHBondContact O-N 2.85Å; Q416-M419 WeakPolarHBondContact O-CB 3.29Å; Q416-M419 PolarHBondContact O-N 2.8Å; K417-M419 PolarHBondContact O-N 2.88Å; M419-D422 WeakPolarHBondContact O-CB 3.25Å; M419-D422 PolarHBondContact O-N 3.26Å; M419-F423 HydrophobicContact CE-CE2 3.72Å; M419-F423 HydrophobicContact CE-CZ 4.29Å; M419-F423 HydrophobicContact CG-CD2 4.01Å; M419-F423 HydrophobicContact CG-CE2 3.8Å; M419-F423 WeakPolarHBondContact O-CD2 3.48Å; M419-F423 PolarHBondContact O-N 3.47Å; M419-F423 HydrophobicContact SD-CE2 4.38Å; M419-Y468 VanDerWaalsContact CA-OH 3.32Å; M419-Y468 WeakPolarHBondContact CA-OH 3.36Å; M419-Y468 HydrophobicContact CG-CE1 3.96Å; M419-M469 HydrophobicContact CE-SD 3.6Å; M419-N472 HydrophobicContact CE-CB 4.21Å; M419-L473 HydrophobicContact CE-CD2 4.06Å; M419-L473 HydrophobicContact CE-CG 4.27Å
420	L	76.2	Confident	78	Confident	121 Å²	121	79.2 Å²	79.2	63%	0.634	40%	0.401	S	S	*	.	H	α-helix	trans	-65.5	-41	176.6	-73.3	172.4	0	0	0	112.4	Q416 K417 D422 F423 G424	Q416-L420 WeakPolarHBondContact O-CG 3.34Å; Q416-L420 PolarHBondContact O-N 3.35Å; K417-L420 PolarHBondContact O-N 3.47Å; K417-L420 VanDerWaalsContact O-N 3.13Å; L420-D422 VanDerWaalsContact C-N 3.3Å; L420-D422 PolarHBondContact O-N 3.39Å; L420-F423 WeakPolarHBondContact O-CB 3.41Å; L420-F423 PolarHBondContact O-N 2.86Å; L420-G424 PolarHBondContact O-N 3.24Å
421	D	77.2	Confident	78.3	Confident	93 Å²	93	80.2 Å²	80.2	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.7	-74.1	-18.6	0	0	0	110.8	K417 D418 G424 L425	K417-D421 PolarHBondContact O-N 2.89Å; D418-D421 PolarHBondContact O-N 2.8Å; D421-G424 PolarHBondContact O-N 2.84Å; D421-L425 PolarHBondContact O-N 2.81Å
422	D	72.8	Confident	78.5	Confident	3 Å²	3	81 Å²	81	2%	0.016	40%	0.401	C	S	.	.	H	α-helix	trans	-58.4	-54.5	170.4	-86.9	-43.7	0	0	0	111.2	D418 M419 L420 G424 L425 W426 Y468 K551	D418-D422 WeakPolarHBondContact O-CB 3.44Å; D418-D422 PolarHBondContact O-N 2.85Å; M419-D422 WeakPolarHBondContact O-CB 3.25Å; M419-D422 PolarHBondContact O-N 3.26Å; L420-D422 VanDerWaalsContact C-N 3.3Å; L420-D422 PolarHBondContact O-N 3.39Å; D422-G424 VanDerWaalsContact C-N 3.28Å; D422-G424 PolarHBondContact O-N 3.47Å; D422-L425 WeakPolarHBondContact O-CB 3.1Å; D422-L425 PolarHBondContact O-N 3.39Å; D422-L425 VanDerWaalsContact O-N 3.11Å; D422-W426 PolarHBondContact O-N 2.92Å; D422-Y468 HydrophobicContact CB-CE1 3.9Å; D422-Y468 HydrophobicContact CB-CE2 4.15Å; D422-Y468 VanDerWaalsContact OD2-CE2 3.24Å; D422-Y468 WeakPolarHBondContact OD2-CE2 3.32Å; D422-Y468 PolarHBondContact OD2-OH 3.44Å; D422-K551 WeakPolarHBondContact OD1-CE 3.42Å; D422-K551 IonicContact OD1-NZ 2.65Å; D422-K551 PolarHBondContact OD1-NZ 3.3Å; D422-K551 IonicContact OD2-NZ 3.05Å; D422-K551 PolarHBondContact OD2-NZ 3.26Å
423	F	76.6	Confident	78.8	Confident	62 Å²	62	76.4 Å²	76.4	27%	0.272	38%	0.378	S	S	.	.	H	α-helix	trans	-54.8	-42.4	176.9	-86	-70.7	0	0	0	113.2	M419 L420 W426 L427 I465 M469	M419-F423 HydrophobicContact CE-CE2 3.72Å; M419-F423 HydrophobicContact CE-CZ 4.29Å; M419-F423 HydrophobicContact CG-CD2 4.01Å; M419-F423 HydrophobicContact CG-CE2 3.8Å; M419-F423 WeakPolarHBondContact O-CD2 3.48Å; M419-F423 PolarHBondContact O-N 3.47Å; M419-F423 HydrophobicContact SD-CE2 4.38Å; L420-F423 WeakPolarHBondContact O-CB 3.41Å; L420-F423 PolarHBondContact O-N 2.86Å; F423-W426 PolarHBondContact O-N 3.5Å; F423-L427 WeakPolarHBondContact O-CB 3.42Å; F423-L427 PolarHBondContact O-N 2.78Å; F423-I465 HydrophobicContact CD1-CD1 3.62Å; F423-I465 HydrophobicContact CD1-CG1 4.37Å; F423-I465 HydrophobicContact CE1-CD1 3.62Å; F423-I465 HydrophobicContact CE1-CG1 4.1Å; F423-M469 HydrophobicContact CE1-CE 4.41Å; F423-M469 HydrophobicContact CE1-CG 4.48Å; F423-M469 HydrophobicContact CE1-SD 4.13Å; F423-M469 HydrophobicContact CE2-SD 3.98Å; F423-M469 HydrophobicContact CZ-CE 3.68Å; F423-M469 HydrophobicContact CZ-CG 4.14Å; F423-M469 HydrophobicContact CZ-SD 3.26Å; F423-M469 WeakPolarHBondContact CZ-SD 3.45Å
424	G	77.9	Confident	79.3	Confident	43 Å²	43	74.7 Å²	74.7	44%	0.443	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-45.1	176.6	0	0	0	0	0	112	L420 D421 D422 H428	L420-G424 PolarHBondContact O-N 3.24Å; D421-G424 PolarHBondContact O-N 2.84Å; D422-G424 VanDerWaalsContact C-N 3.28Å; D422-G424 PolarHBondContact O-N 3.47Å; G424-H428 PolarHBondContact O-N 3.45Å; G424-H428 VanDerWaalsContact O-N 3.09Å
425	L	75.2	Confident	79.8	Confident	59 Å²	59	72.4 Å²	72.4	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-46.3	174.3	-176.4	61.9	0	0	0	111.2	D421 D422 L427 H428 Q429 L567	D421-L425 PolarHBondContact O-N 2.81Å; D422-L425 WeakPolarHBondContact O-CB 3.1Å; D422-L425 PolarHBondContact O-N 3.39Å; D422-L425 VanDerWaalsContact O-N 3.11Å; L425-L427 PolarHBondContact O-N 2.85Å; L425-H428 WeakPolarHBondContact O-CB 3.12Å; L425-H428 PolarHBondContact O-N 2.84Å; L425-Q429 HydrophobicContact CD1-CG 4.42Å; L425-Q429 HydrophobicContact CG-CG 4.44Å; L425-Q429 VanDerWaalsContact O-CG 3.24Å; L425-Q429 WeakPolarHBondContact O-CG 3.31Å; L425-Q429 PolarHBondContact O-N 3.33Å; L425-L567 HydrophobicContact CD2-CD1 4Å; L425-L567 HydrophobicContact CD2-CD2 4.34Å; L425-L567 HydrophobicContact CD2-CG 4.49Å; L425-L567 HydrophobicContact CG-CD1 4.43Å
426	W	76.6	Confident	80.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-46.2	177.5	-68.4	114.4	0	0	0	112.7	D422 F423 H428 Q429 I430 Y461 M464 I465 L567 L571	D422-W426 PolarHBondContact O-N 2.92Å; F423-W426 PolarHBondContact O-N 3.5Å; W426-H428 VanDerWaalsContact C-N 3.28Å; W426-H428 PolarHBondContact O-N 2.84Å; W426-Q429 PolarHBondContact O-N 3.27Å; W426-Q429 VanDerWaalsContact O-N 3.07Å; W426-I430 PolarHBondContact O-N 3.26Å; W426-Y461 HydrophobicContact CE3-CD1 4.04Å; W426-Y461 AromaticContact CZ3-CD1 3.93Å; W426-Y461 HydrophobicContact CZ3-CD1 3.93Å; W426-M464 HydrophobicContact CE3-CB 4.28Å; W426-M464 HydrophobicContact CH2-CB 3.16Å; W426-M464 HydrophobicContact CH2-CE 3.32Å; W426-M464 HydrophobicContact CH2-CG 4.04Å; W426-M464 HydrophobicContact CH2-SD 4.02Å; W426-M464 HydrophobicContact CZ2-CB 4.13Å; W426-M464 HydrophobicContact CZ3-CB 3.24Å; W426-M464 HydrophobicContact CZ3-CE 3.6Å; W426-M464 HydrophobicContact CZ3-CG 4.08Å; W426-M464 HydrophobicContact CZ3-SD 3.79Å; W426-I465 HydrophobicContact CB-CD1 3.89Å; W426-I465 HydrophobicContact CD2-CB 4.36Å; W426-I465 HydrophobicContact CG-CB 4.41Å; W426-I465 HydrophobicContact CG-CD1 4.07Å; W426-I465 HydrophobicContact CG-CG1 4.18Å; W426-L567 HydrophobicContact CD2-CD1 4.24Å; W426-L567 HydrophobicContact CE3-CD1 4.11Å; W426-L567 HydrophobicContact CH2-CB 3.72Å; W426-L567 HydrophobicContact CH2-CD1 3.45Å; W426-L567 VanDerWaalsContact CH2-CD1 3.45Å; W426-L567 HydrophobicContact CH2-CG 4.1Å; W426-L567 HydrophobicContact CZ2-CB 4.23Å; W426-L567 HydrophobicContact CZ2-CD1 3.65Å; W426-L567 HydrophobicContact CZ2-CD2 4.31Å; W426-L567 HydrophobicContact CZ2-CG 4.28Å; W426-L567 HydrophobicContact CZ3-CB 4.46Å; W426-L567 HydrophobicContact CZ3-CD1 3.72Å; W426-L571 HydrophobicContact CH2-CD1 3.86Å; W426-L571 HydrophobicContact CZ2-CD1 3.9Å
427	L	78.3	Confident	81	Confident	127 Å²	127	63.3 Å²	63.3	67%	0.665	34%	0.341	S	S	*	.	H	α-helix	trans	-60.2	-43.3	179.3	-172.8	70.1	0	0	0	110.4	F423 L425 K431	F423-L427 WeakPolarHBondContact O-CB 3.42Å; F423-L427 PolarHBondContact O-N 2.78Å; L425-L427 PolarHBondContact O-N 2.85Å; L427-K431 WeakPolarHBondContact O-CB 3.23Å; L427-K431 PolarHBondContact O-N 2.75Å
428	H	79	Confident	81.6	Confident	119 Å²	119	61.7 Å²	61.7	55%	0.551	34%	0.338	S	S	*	.	H	α-helix	trans	-60.7	-45.4	173.2	-175	-49.2	0	0	0	111.4	G424 L425 W426 I430 K431 T432	G424-H428 PolarHBondContact O-N 3.45Å; G424-H428 VanDerWaalsContact O-N 3.09Å; L425-H428 WeakPolarHBondContact O-CB 3.12Å; L425-H428 PolarHBondContact O-N 2.84Å; W426-H428 VanDerWaalsContact C-N 3.28Å; W426-H428 PolarHBondContact O-N 2.84Å; H428-I430 PolarHBondContact O-N 3.45Å; H428-K431 PolarHBondContact O-N 2.84Å; H428-T432 PolarHBondContact O-N 3.25Å; H428-T432 PolarHBondContact O-OG1 3.34Å
429	Q	78.2	Confident	82.2	Confident	41 Å²	41	63.6 Å²	63.6	19%	0.192	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-36.5	-177.5	-69.9	-64.9	-40	0	0	113	L425 W426 P433 Y461	L425-Q429 HydrophobicContact CD1-CG 4.42Å; L425-Q429 HydrophobicContact CG-CG 4.44Å; L425-Q429 VanDerWaalsContact O-CG 3.24Å; L425-Q429 WeakPolarHBondContact O-CG 3.31Å; L425-Q429 PolarHBondContact O-N 3.33Å; W426-Q429 PolarHBondContact O-N 3.27Å; W426-Q429 VanDerWaalsContact O-N 3.07Å; Q429-P433 WeakPolarHBondContact O-CD 3.28Å; Q429-Y461 HydrophobicContact CB-CD1 3.65Å; Q429-Y461 HydrophobicContact CB-CD2 4.34Å; Q429-Y461 HydrophobicContact CB-CE1 3.39Å; Q429-Y461 HydrophobicContact CB-CE2 4.16Å; Q429-Y461 HydrophobicContact CB-CG 4.15Å; Q429-Y461 HydrophobicContact CG-CD1 4.4Å; Q429-Y461 HydrophobicContact CG-CE1 3.83Å; Q429-Y461 WeakPolarHBondContact O-CE2 3.24Å; Q429-Y461 PolarHBondContact OE1-OH 2.7Å
430	I	84.8	Confident	83	Confident	35 Å²	35	63 Å²	63	18%	0.179	35%	0.345	C	S	.	.	H	α-helix	trans	-73	-36.7	173.7	-68.6	172.8	0	0	0	111.3	W426 H428 T432 P433 V434 Y461 L462	W426-I430 PolarHBondContact O-N 3.26Å; H428-I430 PolarHBondContact O-N 3.45Å; I430-T432 VanDerWaalsContact C-N 3.31Å; I430-T432 PolarHBondContact O-N 3.5Å; I430-P433 WeakPolarHBondContact O-CD 3.42Å; I430-P433 VanDerWaalsContact O-CG 3.3Å; I430-P433 WeakPolarHBondContact O-CG 3.32Å; I430-V434 HydrophobicContact CG2-CG2 4.23Å; I430-V434 VanDerWaalsContact O-CG2 3.27Å; I430-V434 WeakPolarHBondContact O-CG2 3.46Å; I430-V434 PolarHBondContact O-N 2.66Å; I430-Y461 HydrophobicContact CG1-CD2 4.39Å; I430-Y461 HydrophobicContact CG1-CG 4.11Å; I430-L462 HydrophobicContact CD1-CD2 4.08Å; I430-L462 HydrophobicContact CD1-CG 4.43Å
431	K	86.5	Confident	83.6	Confident	147 Å²	147	62.1 Å²	62.1	64%	0.639	34%	0.34	S	S	*	.	H	α-helix	trans	-61.2	-38.8	-179.3	-178.1	178.5	178.7	-179.3	0	112.5	L427 H428 V434 A435	L427-K431 WeakPolarHBondContact O-CB 3.23Å; L427-K431 PolarHBondContact O-N 2.75Å; H428-K431 PolarHBondContact O-N 2.84Å; K431-V434 PolarHBondContact O-N 2.91Å; K431-A435 WeakPolarHBondContact O-CB 3.24Å; K431-A435 PolarHBondContact O-N 3.43Å
432	T	84.6	Confident	84.3	Confident	77 Å²	77	63.9 Å²	63.9	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-58.7	-56.2	-178.2	-52.4	0	0	0	0	113.8	H428 I430 V434 A435 A436	H428-T432 PolarHBondContact O-N 3.25Å; H428-T432 PolarHBondContact O-OG1 3.34Å; I430-T432 VanDerWaalsContact C-N 3.31Å; I430-T432 PolarHBondContact O-N 3.5Å; T432-V434 VanDerWaalsContact C-N 3.32Å; T432-V434 PolarHBondContact O-N 3.45Å; T432-A435 PolarHBondContact O-N 2.77Å; T432-A436 PolarHBondContact O-N 3.4Å
433	P	85	Confident	85.1	Confident	4 Å²	4	67 Å²	67	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-66.8	-31.2	177.8	26.6	-35.2	0	0	0	112.7	Q429 I430 A436 L437 E454 K457 I458	Q429-P433 WeakPolarHBondContact O-CD 3.28Å; I430-P433 WeakPolarHBondContact O-CD 3.42Å; I430-P433 VanDerWaalsContact O-CG 3.3Å; I430-P433 WeakPolarHBondContact O-CG 3.32Å; P433-A436 PolarHBondContact O-N 3.4Å; P433-L437 WeakPolarHBondContact O-CG 3.27Å; P433-L437 PolarHBondContact O-N 2.74Å; P433-E454 WeakPolarHBondContact CA-OE2 3.43Å; P433-E454 HydrophobicContact CB-CB 4.19Å; P433-E454 VanDerWaalsContact CB-OE2 3.28Å; P433-E454 WeakPolarHBondContact CB-OE2 3.28Å; P433-K457 HydrophobicContact CB-CB 4.23Å; P433-K457 HydrophobicContact CB-CD 4.39Å; P433-K457 HydrophobicContact CG-CB 4.37Å; P433-I458 HydrophobicContact CB-CD1 4.37Å; P433-I458 HydrophobicContact CB-CG1 3.92Å; P433-I458 HydrophobicContact CG-CD1 4.42Å; P433-I458 HydrophobicContact CG-CG1 3.6Å
434	V	91.3	Very high	85.7	Confident	72 Å²	72	66.6 Å²	66.6	44%	0.436	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-45.4	173	171.9	0	0	0	0	110.8	I430 K431 T432 A436 L437 D438 I458	I430-V434 HydrophobicContact CG2-CG2 4.23Å; I430-V434 VanDerWaalsContact O-CG2 3.27Å; I430-V434 WeakPolarHBondContact O-CG2 3.46Å; I430-V434 PolarHBondContact O-N 2.66Å; K431-V434 PolarHBondContact O-N 2.91Å; T432-V434 VanDerWaalsContact C-N 3.32Å; T432-V434 PolarHBondContact O-N 3.45Å; V434-A436 VanDerWaalsContact C-N 3.34Å; V434-L437 PolarHBondContact O-N 3.29Å; V434-D438 PolarHBondContact O-N 3.43Å; V434-I458 HydrophobicContact CG2-CD1 3.52Å; V434-I458 HydrophobicContact CG2-CG1 4.1Å
435	A	90.4	Very high	85.9	Confident	44 Å²	44	71.1 Å²	71.1	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-65.8	-36.6	175	0	0	0	0	0	112	K431 T432 D438 L439	K431-A435 WeakPolarHBondContact O-CB 3.24Å; K431-A435 PolarHBondContact O-N 3.43Å; T432-A435 PolarHBondContact O-N 2.77Å; A435-D438 PolarHBondContact O-N 2.86Å; A435-L439 WeakPolarHBondContact O-CG 3.36Å; A435-L439 PolarHBondContact O-N 3.12Å
436	A	88.5	Confident	86.4	Confident	30 Å²	30	72.9 Å²	72.9	25%	0.248	40%	0.399	C	S	.	.	H	α-helix	trans	-63.4	-42.3	174.3	0	0	0	0	0	111.8	T432 P433 V434 L439 L440 E454	T432-A436 PolarHBondContact O-N 3.4Å; P433-A436 PolarHBondContact O-N 3.4Å; V434-A436 VanDerWaalsContact C-N 3.34Å; A436-L439 PolarHBondContact O-N 3.09Å; A436-L440 VanDerWaalsContact O-CG 3.32Å; A436-L440 WeakPolarHBondContact O-CG 3.41Å; A436-L440 PolarHBondContact O-N 2.98Å; A436-E454 HydrophobicContact CB-CG 4.21Å
437	L	90.4	Very high	86.9	Confident	31 Å²	31	78.9 Å²	78.9	16%	0.162	43%	0.427	C	S	.	.	H	α-helix	trans	-60.9	-44.2	173.2	-77.3	170.2	0	0	0	111.8	P433 V434 L439 L440 I441 M451 E454 I458	P433-L437 WeakPolarHBondContact O-CG 3.27Å; P433-L437 PolarHBondContact O-N 2.74Å; V434-L437 PolarHBondContact O-N 3.29Å; L437-L439 PolarHBondContact O-N 3.37Å; L437-L440 PolarHBondContact O-N 2.98Å; L437-I441 VanDerWaalsContact O-CG1 3.27Å; L437-I441 WeakPolarHBondContact O-CG1 3.32Å; L437-I441 PolarHBondContact O-N 3.48Å; L437-M451 HydrophobicContact CD2-CB 3.9Å; L437-M451 HydrophobicContact CD2-CG 4.03Å; L437-E454 HydrophobicContact CD1-CB 4.11Å; L437-E454 HydrophobicContact CD2-CB 3.81Å; L437-E454 HydrophobicContact CD2-CG 4.47Å; L437-E454 HydrophobicContact CG-CB 3.63Å; L437-E454 HydrophobicContact CG-CG 4.4Å; L437-I458 HydrophobicContact CD1-CD1 3.73Å
438	D	92.4	Very high	87.3	Confident	80 Å²	80	77 Å²	77	43%	0.428	42%	0.422	S	S	.	.	H	α-helix	trans	-59.3	-45.6	176.2	-178.3	44.8	0	0	0	111.6	V434 A435 L440 I441 Q442	V434-D438 PolarHBondContact O-N 3.43Å; A435-D438 PolarHBondContact O-N 2.86Å; D438-L440 PolarHBondContact O-N 3.11Å; D438-I441 PolarHBondContact O-N 2.85Å; D438-Q442 WeakPolarHBondContact O-CB 3.45Å; D438-Q442 VanDerWaalsContact O-CG 3.3Å; D438-Q442 WeakPolarHBondContact O-CG 3.47Å; D438-Q442 PolarHBondContact O-N 3.07Å; D438-Q442 PolarHBondContact OD1-NE2 3.19Å; D438-Q442 PolarHBondContact OD2-NE2 2.94Å
439	L	90.8	Very high	87.5	Confident	107 Å²	107	80.9 Å²	80.9	56%	0.56	43%	0.432	S	S	*	.	H	α-helix	trans	-63.9	-37.8	175.4	-69.5	171	0	0	0	113.1	A435 A436 L437 I441 Q442 S443	A435-L439 WeakPolarHBondContact O-CG 3.36Å; A435-L439 PolarHBondContact O-N 3.12Å; A436-L439 PolarHBondContact O-N 3.09Å; L437-L439 PolarHBondContact O-N 3.37Å; L439-I441 VanDerWaalsContact C-N 3.33Å; L439-Q442 PolarHBondContact O-N 3.31Å; L439-S443 VanDerWaalsContact O-CB 3.28Å; L439-S443 WeakPolarHBondContact O-CB 3.42Å; L439-S443 PolarHBondContact O-N 3.24Å; L439-S443 PolarHBondContact O-OG 3.14Å
440	L	89.8	Confident	87.8	Confident	28 Å²	28	81 Å²	81	15%	0.147	44%	0.436	C	S	.	.	H	α-helix	trans	-63.5	-41.3	174.8	-73.6	169.6	0	0	0	111.3	A436 L437 D438 S443 G444 Q445 T450 M451	A436-L440 VanDerWaalsContact O-CG 3.32Å; A436-L440 WeakPolarHBondContact O-CG 3.41Å; A436-L440 PolarHBondContact O-N 2.98Å; L437-L440 PolarHBondContact O-N 2.98Å; D438-L440 PolarHBondContact O-N 3.11Å; L440-S443 PolarHBondContact O-OG 3.4Å; L440-G444 PolarHBondContact O-N 3.36Å; L440-Q445 PolarHBondContact O-N 3.19Å; L440-T450 HydrophobicContact CD1-CG2 3.82Å; L440-T450 HydrophobicContact CD2-CG2 4.29Å; L440-M451 HydrophobicContact CD1-CG 4.23Å
441	I	89.9	Confident	87.9	Confident	102 Å²	102	81.7 Å²	81.7	52%	0.523	44%	0.439	S	S	.	.	H	α-helix	trans	-65.6	-47.2	176.6	-67	164.3	0	0	0	110.5	L437 D438 L439 S443 G444 L446	L437-I441 VanDerWaalsContact O-CG1 3.27Å; L437-I441 WeakPolarHBondContact O-CG1 3.32Å; L437-I441 PolarHBondContact O-N 3.48Å; D438-I441 PolarHBondContact O-N 2.85Å; L439-I441 VanDerWaalsContact C-N 3.33Å; I441-S443 VanDerWaalsContact C-N 3.35Å; I441-S443 PolarHBondContact O-N 3.37Å; I441-G444 PolarHBondContact O-N 3.39Å; I441-L446 HydrophobicContact CB-CD2 4.42Å; I441-L446 HydrophobicContact CG1-CD2 3.96Å
442	Q	91	Very high	87.7	Confident	131 Å²	131	82 Å²	82	61%	0.612	44%	0.44	S	S	*	.	H	α-helix	trans	-65.2	-35.7	-180	-71.4	175.7	25	0	0	113.2	D438 L439 G444	D438-Q442 WeakPolarHBondContact O-CB 3.45Å; D438-Q442 VanDerWaalsContact O-CG 3.3Å; D438-Q442 WeakPolarHBondContact O-CG 3.47Å; D438-Q442 PolarHBondContact O-N 3.07Å; D438-Q442 PolarHBondContact OD1-NE2 3.19Å; D438-Q442 PolarHBondContact OD2-NE2 2.94Å; L439-Q442 PolarHBondContact O-N 3.31Å; Q442-G444 VanDerWaalsContact C-N 3.26Å; Q442-G444 PolarHBondContact O-N 2.93Å
443	S	90.4	Very high	87.6	Confident	68 Å²	68	82.2 Å²	82.2	48%	0.476	44%	0.438	S	S	.	.	H	α-helix	trans	-76	-12.3	178	63.4	0	0	0	0	113.7	L439 L440 I441 Q445	L439-S443 VanDerWaalsContact O-CB 3.28Å; L439-S443 WeakPolarHBondContact O-CB 3.42Å; L439-S443 PolarHBondContact O-N 3.24Å; L439-S443 PolarHBondContact O-OG 3.14Å; L440-S443 PolarHBondContact O-OG 3.4Å; I441-S443 VanDerWaalsContact C-N 3.35Å; I441-S443 PolarHBondContact O-N 3.37Å; S443-Q445 PolarHBondContact O-N 3.22Å; S443-Q445 PolarHBondContact OG-N 3.08Å
444	G	88.2	Confident	87.6	Confident	54 Å²	54	83.2 Å²	83.2	56%	0.557	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	1.4	-175	0	0	0	0	0	114.4	L440 I441 Q442 L446	L440-G444 PolarHBondContact O-N 3.36Å; I441-G444 PolarHBondContact O-N 3.39Å; Q442-G444 VanDerWaalsContact C-N 3.26Å; Q442-G444 PolarHBondContact O-N 2.93Å; G444-L446 PolarHBondContact O-N 3.43Å
445	Q	82.4	Confident	87.2	Confident	138 Å²	138	84.1 Å²	84.1	65%	0.645	45%	0.445	S	S	*	.			trans	-81.2	62.9	176.5	-63.9	-174.5	-18.4	0	0	110.7	L440 S443 E447	L440-Q445 PolarHBondContact O-N 3.19Å; S443-Q445 PolarHBondContact O-N 3.22Å; S443-Q445 PolarHBondContact OG-N 3.08Å; Q445-E447 PolarHBondContact O-N 3.21Å
446	L	86.3	Confident	86.8	Confident	96 Å²	96	86.5 Å²	86.5	50%	0.503	45%	0.447	S	S	.	.			trans	-77.4	59.7	-175.8	-64.7	172.5	0	0	0	112.3	I441 G444 P448 M451	I441-L446 HydrophobicContact CB-CD2 4.42Å; I441-L446 HydrophobicContact CG1-CD2 3.96Å; G444-L446 PolarHBondContact O-N 3.43Å; L446-P448 VanDerWaalsContact O-CD 3.23Å; L446-P448 WeakPolarHBondContact O-CD 2.96Å; L446-M451 HydrophobicContact CB-CE 4.09Å; L446-M451 HydrophobicContact CB-SD 4.48Å; L446-M451 HydrophobicContact CD2-CE 4.38Å; L446-M451 HydrophobicContact CD2-SD 3.77Å
447	E	87.6	Confident	86.4	Confident	125 Å²	125	87.6 Å²	87.6	58%	0.584	45%	0.446	S	S	*	.			trans	-73.4	115.4	174.7	-69.9	-170	162.8	0	0	110.7	Q445 R449 T450 M451	Q445-E447 PolarHBondContact O-N 3.21Å; E447-R449 PolarHBondContact O-N 2.97Å; E447-R449 VanDerWaalsContact O-N 3.11Å; E447-T450 PolarHBondContact O-N 3.45Å; E447-T450 VanDerWaalsContact O-N 3.12Å; E447-T450 PolarHBondContact OE2-OG1 2.9Å; E447-M451 PolarHBondContact O-N 3.15Å; E447-M451 VanDerWaalsContact O-N 3.09Å
448	P	85.4	Confident	86.2	Confident	87 Å²	87	87.1 Å²	87.1	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-59.8	-31	-174.4	-26.5	36.2	0	0	0	113.7	L446 K452	L446-P448 VanDerWaalsContact O-CD 3.23Å; L446-P448 WeakPolarHBondContact O-CD 2.96Å; P448-K452 VanDerWaalsContact O-CB 3.28Å; P448-K452 WeakPolarHBondContact O-CB 3.4Å; P448-K452 VanDerWaalsContact O-CG 3.24Å; P448-K452 WeakPolarHBondContact O-CG 3.45Å; P448-K452 PolarHBondContact O-N 2.91Å
449	R	83.7	Confident	85.5	Confident	201 Å²	201	87.4 Å²	87.4	76%	0.758	45%	0.445	S	S	*	.	H	α-helix	trans	-67.4	-46.1	178.4	-171.9	178.5	-178.4	-176.8	-0.2	111.4	E447 K452 N453	E447-R449 PolarHBondContact O-N 2.97Å; E447-R449 VanDerWaalsContact O-N 3.11Å; R449-K452 PolarHBondContact O-N 3.19Å; R449-N453 PolarHBondContact O-N 3.25Å; R449-N453 PolarHBondContact O-ND2 3.36Å; R449-N453 PolarHBondContact O-OD1 3.04Å
450	T	83.7	Confident	84.8	Confident	44 Å²	44	84 Å²	84	27%	0.27	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-44.3	-179	-51.3	0	0	0	0	110.5	L440 E447 K452 N453 E454	L440-T450 HydrophobicContact CD1-CG2 3.82Å; L440-T450 HydrophobicContact CD2-CG2 4.29Å; E447-T450 PolarHBondContact O-N 3.45Å; E447-T450 VanDerWaalsContact O-N 3.12Å; E447-T450 PolarHBondContact OE2-OG1 2.9Å; T450-K452 PolarHBondContact O-N 3.01Å; T450-N453 WeakPolarHBondContact O-CB 3.39Å; T450-N453 PolarHBondContact O-N 3.5Å; T450-E454 PolarHBondContact O-N 3.39Å; T450-E454 VanDerWaalsContact O-N 3.14Å
451	M	87.7	Confident	84.2	Confident	49 Å²	49	83.7 Å²	83.7	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-62.6	-42.9	174.8	-66.5	-172.9	-68.6	0	0	112.7	L437 L440 L446 E447 N453 E454 L455	L437-M451 HydrophobicContact CD2-CB 3.9Å; L437-M451 HydrophobicContact CD2-CG 4.03Å; L440-M451 HydrophobicContact CD1-CG 4.23Å; L446-M451 HydrophobicContact CB-CE 4.09Å; L446-M451 HydrophobicContact CB-SD 4.48Å; L446-M451 HydrophobicContact CD2-CE 4.38Å; L446-M451 HydrophobicContact CD2-SD 3.77Å; E447-M451 PolarHBondContact O-N 3.15Å; E447-M451 VanDerWaalsContact O-N 3.09Å; M451-N453 VanDerWaalsContact C-N 3.26Å; M451-N453 PolarHBondContact O-N 3.41Å; M451-E454 PolarHBondContact O-N 3.37Å; M451-L455 WeakPolarHBondContact O-CB 2.93Å; M451-L455 PolarHBondContact O-N 2.93Å
452	K	82.7	Confident	83.7	Confident	154 Å²	154	82.3 Å²	82.3	67%	0.67	42%	0.417	S	S	*	.	H	α-helix	trans	-60.3	-37.4	175.3	-82.1	-179.6	178.9	-175.9	0	111.9	P448 R449 T450 F456	P448-K452 VanDerWaalsContact O-CB 3.28Å; P448-K452 WeakPolarHBondContact O-CB 3.4Å; P448-K452 VanDerWaalsContact O-CG 3.24Å; P448-K452 WeakPolarHBondContact O-CG 3.45Å; P448-K452 PolarHBondContact O-N 2.91Å; R449-K452 PolarHBondContact O-N 3.19Å; T450-K452 PolarHBondContact O-N 3.01Å; K452-F456 WeakPolarHBondContact O-CB 3.4Å; K452-F456 PolarHBondContact O-N 3.31Å
453	N	81.2	Confident	82.9	Confident	81 Å²	81	80.4 Å²	80.4	43%	0.433	41%	0.408	S	S	.	.	H	α-helix	trans	-65.5	-42.3	176.8	-68.6	-17.3	0	0	0	112	R449 T450 M451 F456 K457	R449-N453 PolarHBondContact O-N 3.25Å; R449-N453 PolarHBondContact O-ND2 3.36Å; R449-N453 PolarHBondContact O-OD1 3.04Å; T450-N453 WeakPolarHBondContact O-CB 3.39Å; T450-N453 PolarHBondContact O-N 3.5Å; M451-N453 VanDerWaalsContact C-N 3.26Å; M451-N453 PolarHBondContact O-N 3.41Å; N453-F456 WeakPolarHBondContact O-CB 3.29Å; N453-F456 PolarHBondContact O-N 3.5Å; N453-K457 WeakPolarHBondContact O-CG 3.34Å; N453-K457 PolarHBondContact O-N 2.95Å
454	E	85.1	Confident	82.1	Confident	25 Å²	25	77.2 Å²	77.2	12%	0.117	39%	0.386	C	S	.	.	H	α-helix	trans	-69.2	-40.9	177	-61.9	-49.3	127.4	0	0	112.2	P433 A436 L437 T450 M451 F456 K457 I458	P433-E454 WeakPolarHBondContact CA-OE2 3.43Å; P433-E454 HydrophobicContact CB-CB 4.19Å; P433-E454 VanDerWaalsContact CB-OE2 3.28Å; P433-E454 WeakPolarHBondContact CB-OE2 3.28Å; A436-E454 HydrophobicContact CB-CG 4.21Å; L437-E454 HydrophobicContact CD1-CB 4.11Å; L437-E454 HydrophobicContact CD2-CB 3.81Å; L437-E454 HydrophobicContact CD2-CG 4.47Å; L437-E454 HydrophobicContact CG-CB 3.63Å; L437-E454 HydrophobicContact CG-CG 4.4Å; T450-E454 PolarHBondContact O-N 3.39Å; T450-E454 VanDerWaalsContact O-N 3.14Å; M451-E454 PolarHBondContact O-N 3.37Å; E454-F456 VanDerWaalsContact C-N 3.26Å; E454-F456 PolarHBondContact O-N 2.84Å; E454-K457 VanDerWaalsContact CD-NZ 3.27Å; E454-K457 WeakPolarHBondContact O-CB 3.4Å; E454-K457 PolarHBondContact O-N 2.95Å; E454-K457 IonicContact OE1-NZ 3.05Å; E454-K457 PolarHBondContact OE1-NZ 3.34Å; E454-K457 WeakPolarHBondContact OE2-CD 3.46Å; E454-K457 IonicContact OE2-NZ 2.74Å; E454-K457 PolarHBondContact OE2-NZ 2.99Å; E454-I458 WeakPolarHBondContact O-CG1 3.24Å; E454-I458 PolarHBondContact O-N 3.35Å; E454-I458 VanDerWaalsContact O-N 3.08Å
455	L	83.9	Confident	81.6	Confident	92 Å²	92	76 Å²	76	48%	0.482	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-38	173.2	-173.4	68	0	0	0	111.6	M451 I458 N459	M451-L455 WeakPolarHBondContact O-CB 2.93Å; M451-L455 PolarHBondContact O-N 2.93Å; L455-I458 PolarHBondContact O-N 3.38Å; L455-N459 PolarHBondContact O-N 2.8Å; L455-N459 VanDerWaalsContact O-N 3.07Å
456	F	81.9	Confident	81.2	Confident	93 Å²	93	73.4 Å²	73.4	41%	0.408	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-46.9	175.3	-172.7	-81.5	0	0	0	111.1	K452 N453 E454 I458 N459 E460 F511	K452-F456 WeakPolarHBondContact O-CB 3.4Å; K452-F456 PolarHBondContact O-N 3.31Å; N453-F456 WeakPolarHBondContact O-CB 3.29Å; N453-F456 PolarHBondContact O-N 3.5Å; E454-F456 VanDerWaalsContact C-N 3.26Å; E454-F456 PolarHBondContact O-N 2.84Å; F456-I458 VanDerWaalsContact C-N 3.31Å; F456-I458 PolarHBondContact O-N 2.96Å; F456-N459 PolarHBondContact O-N 3.22Å; F456-N459 VanDerWaalsContact O-N 3.15Å; F456-E460 HydrophobicContact CD1-CG 3.95Å; F456-E460 WeakPolarHBondContact CD1-OE2 3.47Å; F456-E460 HydrophobicContact CE1-CG 3.5Å; F456-E460 VanDerWaalsContact CE1-OE2 3.29Å; F456-E460 WeakPolarHBondContact CE1-OE2 3.39Å; F456-E460 HydrophobicContact CZ-CG 4.3Å; F456-E460 PolarHBondContact O-N 2.88Å; F456-F511 HydrophobicContact CD1-CE2 4.46Å; F456-F511 HydrophobicContact CD1-CZ 4.08Å; F456-F511 HydrophobicContact CE1-CD2 4.24Å; F456-F511 AromaticContact CE1-CE1 3.91Å; F456-F511 HydrophobicContact CE1-CE1 3.91Å; F456-F511 AromaticContact CE1-CE2 3.26Å; F456-F511 HydrophobicContact CE1-CE2 3.26Å; F456-F511 AromaticContact CE1-CZ 3.07Å; F456-F511 HydrophobicContact CE1-CZ 3.07Å; F456-F511 HydrophobicContact CE2-CE2 4.31Å; F456-F511 AromaticContact CZ-CD2 3.89Å; F456-F511 HydrophobicContact CZ-CD2 3.89Å; F456-F511 AromaticContact CZ-CE2 3.15Å; F456-F511 HydrophobicContact CZ-CE2 3.15Å; F456-F511 AromaticContact CZ-CZ 3.55Å; F456-F511 HydrophobicContact CZ-CZ 3.55Å
457	K	79.9	Confident	80.4	Confident	54 Å²	54	69.6 Å²	69.6	24%	0.235	34%	0.336	C	S	.	.	H	α-helix	trans	-56.8	-43.4	174.7	-68.2	172	-171.9	169.6	0	112	P433 N453 E454 N459 E460 Y461	P433-K457 HydrophobicContact CB-CB 4.23Å; P433-K457 HydrophobicContact CB-CD 4.39Å; P433-K457 HydrophobicContact CG-CB 4.37Å; N453-K457 WeakPolarHBondContact O-CG 3.34Å; N453-K457 PolarHBondContact O-N 2.95Å; E454-K457 VanDerWaalsContact CD-NZ 3.27Å; E454-K457 WeakPolarHBondContact O-CB 3.4Å; E454-K457 PolarHBondContact O-N 2.95Å; E454-K457 IonicContact OE1-NZ 3.05Å; E454-K457 PolarHBondContact OE1-NZ 3.34Å; E454-K457 WeakPolarHBondContact OE2-CD 3.46Å; E454-K457 IonicContact OE2-NZ 2.74Å; E454-K457 PolarHBondContact OE2-NZ 2.99Å; K457-N459 VanDerWaalsContact C-N 3.34Å; K457-N459 PolarHBondContact O-N 3.48Å; K457-E460 WeakPolarHBondContact O-CB 3.17Å; K457-E460 PolarHBondContact O-N 3.25Å; K457-Y461 HydrophobicContact CB-CE2 4.18Å; K457-Y461 WeakPolarHBondContact O-CD2 3.29Å; K457-Y461 PolarHBondContact O-N 3.41Å
458	I	85.5	Confident	79.7	Confident	20 Å²	20	64.3 Å²	64.3	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-47.3	177.1	-66.8	165.8	0	0	0	110.7	P433 V434 L437 E454 L455 F456 E460 Y461 L462	P433-I458 HydrophobicContact CB-CD1 4.37Å; P433-I458 HydrophobicContact CB-CG1 3.92Å; P433-I458 HydrophobicContact CG-CD1 4.42Å; P433-I458 HydrophobicContact CG-CG1 3.6Å; V434-I458 HydrophobicContact CG2-CD1 3.52Å; V434-I458 HydrophobicContact CG2-CG1 4.1Å; L437-I458 HydrophobicContact CD1-CD1 3.73Å; E454-I458 WeakPolarHBondContact O-CG1 3.24Å; E454-I458 PolarHBondContact O-N 3.35Å; E454-I458 VanDerWaalsContact O-N 3.08Å; L455-I458 PolarHBondContact O-N 3.38Å; F456-I458 VanDerWaalsContact C-N 3.31Å; F456-I458 PolarHBondContact O-N 2.96Å; I458-E460 VanDerWaalsContact C-N 3.31Å; I458-E460 PolarHBondContact O-N 2.91Å; I458-Y461 PolarHBondContact O-N 3.06Å; I458-L462 HydrophobicContact CG2-CD1 3.94Å; I458-L462 HydrophobicContact CG2-CG 4.33Å; I458-L462 WeakPolarHBondContact O-CG 3.22Å; I458-L462 PolarHBondContact O-N 2.77Å
459	N	79.3	Confident	79	Confident	87 Å²	87	62.6 Å²	62.6	47%	0.465	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-37.5	177.8	-78.7	-29	0	0	0	112.4	L455 F456 K457 L462 Q463	L455-N459 PolarHBondContact O-N 2.8Å; L455-N459 VanDerWaalsContact O-N 3.07Å; F456-N459 PolarHBondContact O-N 3.22Å; F456-N459 VanDerWaalsContact O-N 3.15Å; K457-N459 VanDerWaalsContact C-N 3.34Å; K457-N459 PolarHBondContact O-N 3.48Å; N459-L462 PolarHBondContact O-N 2.94Å; N459-Q463 WeakPolarHBondContact O-CG 3.24Å; N459-Q463 PolarHBondContact O-N 2.91Å
460	E	74.5	Confident	78.3	Confident	35 Å²	35	58.4 Å²	58.4	16%	0.164	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-51.9	172.9	-70.6	-172.9	76.2	0	0	111.1	F456 K457 I458 L462 Q463 M464 F511	F456-E460 HydrophobicContact CD1-CG 3.95Å; F456-E460 WeakPolarHBondContact CD1-OE2 3.47Å; F456-E460 HydrophobicContact CE1-CG 3.5Å; F456-E460 VanDerWaalsContact CE1-OE2 3.29Å; F456-E460 WeakPolarHBondContact CE1-OE2 3.39Å; F456-E460 HydrophobicContact CZ-CG 4.3Å; F456-E460 PolarHBondContact O-N 2.88Å; K457-E460 WeakPolarHBondContact O-CB 3.17Å; K457-E460 PolarHBondContact O-N 3.25Å; I458-E460 VanDerWaalsContact C-N 3.31Å; I458-E460 PolarHBondContact O-N 2.91Å; E460-L462 VanDerWaalsContact C-N 3.3Å; E460-L462 PolarHBondContact O-N 3.1Å; E460-Q463 PolarHBondContact O-N 2.87Å; E460-M464 WeakPolarHBondContact O-CG 3.33Å; E460-M464 PolarHBondContact O-N 3.48Å; E460-F511 HydrophobicContact CG-CE1 4.44Å; E460-F511 WeakPolarHBondContact OE1-CD1 3.47Å; E460-F511 WeakPolarHBondContact OE1-CE1 2.82Å
461	Y	78.9	Confident	77.4	Confident	22 Å²	22	56.9 Å²	56.9	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-36.3	179.8	-67.4	-61.4	0	0	0	112.7	W426 Q429 I430 K457 I458 M464 I465	W426-Y461 HydrophobicContact CE3-CD1 4.04Å; W426-Y461 AromaticContact CZ3-CD1 3.93Å; W426-Y461 HydrophobicContact CZ3-CD1 3.93Å; Q429-Y461 HydrophobicContact CB-CD1 3.65Å; Q429-Y461 HydrophobicContact CB-CD2 4.34Å; Q429-Y461 HydrophobicContact CB-CE1 3.39Å; Q429-Y461 HydrophobicContact CB-CE2 4.16Å; Q429-Y461 HydrophobicContact CB-CG 4.15Å; Q429-Y461 HydrophobicContact CG-CD1 4.4Å; Q429-Y461 HydrophobicContact CG-CE1 3.83Å; Q429-Y461 WeakPolarHBondContact O-CE2 3.24Å; Q429-Y461 PolarHBondContact OE1-OH 2.7Å; I430-Y461 HydrophobicContact CG1-CD2 4.39Å; I430-Y461 HydrophobicContact CG1-CG 4.11Å; K457-Y461 HydrophobicContact CB-CE2 4.18Å; K457-Y461 WeakPolarHBondContact O-CD2 3.29Å; K457-Y461 PolarHBondContact O-N 3.41Å; I458-Y461 PolarHBondContact O-N 3.06Å; Y461-M464 HydrophobicContact CD1-SD 4.48Å; Y461-M464 PolarHBondContact O-N 2.91Å; Y461-I465 PolarHBondContact O-N 3.05Å
462	L	79.1	Confident	76.3	Confident	72 Å²	72	56.6 Å²	56.6	38%	0.377	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-42.6	173.9	-75	174.5	0	0	0	112.2	I430 I458 N459 E460 M464 I465 L466	I430-L462 HydrophobicContact CD1-CD2 4.08Å; I430-L462 HydrophobicContact CD1-CG 4.43Å; I458-L462 HydrophobicContact CG2-CD1 3.94Å; I458-L462 HydrophobicContact CG2-CG 4.33Å; I458-L462 WeakPolarHBondContact O-CG 3.22Å; I458-L462 PolarHBondContact O-N 2.77Å; N459-L462 PolarHBondContact O-N 2.94Å; E460-L462 VanDerWaalsContact C-N 3.3Å; E460-L462 PolarHBondContact O-N 3.1Å; L462-M464 VanDerWaalsContact C-N 3.32Å; L462-M464 PolarHBondContact O-N 2.66Å; L462-I465 VanDerWaalsContact O-CG2 3.3Å; L462-I465 WeakPolarHBondContact O-CG2 3.23Å; L462-L466 WeakPolarHBondContact O-CB 3.4Å; L462-L466 VanDerWaalsContact O-CG 3.22Å; L462-L466 WeakPolarHBondContact O-CG 3.44Å; L462-L466 PolarHBondContact O-N 2.75Å
463	Q	73.4	Confident	75.1	Confident	91 Å²	91	54.3 Å²	54.3	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-42.6	175.4	-73.7	-62.6	-18.6	0	0	111.1	N459 E460 I465 L466 N467	N459-Q463 WeakPolarHBondContact O-CG 3.24Å; N459-Q463 PolarHBondContact O-N 2.91Å; E460-Q463 PolarHBondContact O-N 2.87Å; Q463-I465 PolarHBondContact O-N 2.81Å; Q463-L466 PolarHBondContact O-N 3.43Å; Q463-N467 WeakPolarHBondContact O-CB 3.15Å; Q463-N467 VanDerWaalsContact O-CG 3.27Å; Q463-N467 PolarHBondContact O-N 3.29Å; Q463-N467 PolarHBondContact O-ND2 2.67Å
464	M	74.5	Confident	73.7	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.7	-40.7	-179.7	-64.6	165.2	74.4	0	0	112.3	W426 E460 Y461 L462 N467 Y468 S565 L567 L571	W426-M464 HydrophobicContact CE3-CB 4.28Å; W426-M464 HydrophobicContact CH2-CB 3.16Å; W426-M464 HydrophobicContact CH2-CE 3.32Å; W426-M464 HydrophobicContact CH2-CG 4.04Å; W426-M464 HydrophobicContact CH2-SD 4.02Å; W426-M464 HydrophobicContact CZ2-CB 4.13Å; W426-M464 HydrophobicContact CZ3-CB 3.24Å; W426-M464 HydrophobicContact CZ3-CE 3.6Å; W426-M464 HydrophobicContact CZ3-CG 4.08Å; W426-M464 HydrophobicContact CZ3-SD 3.79Å; E460-M464 WeakPolarHBondContact O-CG 3.33Å; E460-M464 PolarHBondContact O-N 3.48Å; Y461-M464 HydrophobicContact CD1-SD 4.48Å; Y461-M464 PolarHBondContact O-N 2.91Å; L462-M464 VanDerWaalsContact C-N 3.32Å; L462-M464 PolarHBondContact O-N 2.66Å; M464-N467 PolarHBondContact O-N 2.83Å; M464-Y468 WeakPolarHBondContact O-CB 3.17Å; M464-Y468 PolarHBondContact O-N 2.85Å; M464-S565 WeakPolarHBondContact CE-OG 3.32Å; M464-L567 HydrophobicContact CE-CB 3.22Å; M464-L571 HydrophobicContact CB-CD1 4Å; M464-L571 HydrophobicContact CE-CD1 4.32Å; M464-L571 HydrophobicContact CG-CD1 4.44Å
465	I	77.4	Confident	72.2	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-68.7	-39.3	176.1	-159	171.3	0	0	0	112	F423 W426 Y461 L462 Q463 N467 Y468 M469	F423-I465 HydrophobicContact CD1-CD1 3.62Å; F423-I465 HydrophobicContact CD1-CG1 4.37Å; F423-I465 HydrophobicContact CE1-CD1 3.62Å; F423-I465 HydrophobicContact CE1-CG1 4.1Å; W426-I465 HydrophobicContact CB-CD1 3.89Å; W426-I465 HydrophobicContact CD2-CB 4.36Å; W426-I465 HydrophobicContact CG-CB 4.41Å; W426-I465 HydrophobicContact CG-CD1 4.07Å; W426-I465 HydrophobicContact CG-CG1 4.18Å; Y461-I465 PolarHBondContact O-N 3.05Å; L462-I465 VanDerWaalsContact O-CG2 3.3Å; L462-I465 WeakPolarHBondContact O-CG2 3.23Å; Q463-I465 PolarHBondContact O-N 2.81Å; I465-N467 PolarHBondContact O-N 2.85Å; I465-Y468 PolarHBondContact O-N 3.44Å; I465-M469 HydrophobicContact CG1-CG 4.42Å; I465-M469 WeakPolarHBondContact O-CB 3.39Å; I465-M469 WeakPolarHBondContact O-CG 3.46Å; I465-M469 PolarHBondContact O-N 2.87Å
466	L	73.2	Confident	70.8	Confident	83 Å²	83	61 Å²	61	44%	0.435	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-38.5	174.9	-74.3	172.2	0	0	0	111.2	L462 Q463 R470	L462-L466 WeakPolarHBondContact O-CB 3.4Å; L462-L466 VanDerWaalsContact O-CG 3.22Å; L462-L466 WeakPolarHBondContact O-CG 3.44Å; L462-L466 PolarHBondContact O-N 2.75Å; Q463-L466 PolarHBondContact O-N 3.43Å; L466-R470 VanDerWaalsContact O-CG 3.27Å; L466-R470 WeakPolarHBondContact O-CG 3.14Å; L466-R470 PolarHBondContact O-N 2.92Å
467	N	70	Confident	69.7	Low	16 Å²	16	63.4 Å²	63.4	9%	0.086	31%	0.314	C	S	.	.	H	α-helix	trans	-76.6	-36.8	178.1	-67.6	-38	0	0	0	112.7	Q463 M464 I465 M469 R470 Q471 F504	Q463-N467 WeakPolarHBondContact O-CB 3.15Å; Q463-N467 VanDerWaalsContact O-CG 3.27Å; Q463-N467 PolarHBondContact O-N 3.29Å; Q463-N467 PolarHBondContact O-ND2 2.67Å; M464-N467 PolarHBondContact O-N 2.83Å; I465-N467 PolarHBondContact O-N 2.85Å; N467-M469 VanDerWaalsContact C-N 3.28Å; N467-M469 PolarHBondContact O-N 3.26Å; N467-R470 PolarHBondContact O-N 3.41Å; N467-R470 PolarHBondContact OD1-NH1 3.43Å; N467-Q471 WeakPolarHBondContact O-CB 3.33Å; N467-Q471 WeakPolarHBondContact O-CG 3.33Å; N467-Q471 PolarHBondContact O-N 2.92Å; N467-F504 HydrophobicContact CB-CD2 4.12Å; N467-F504 HydrophobicContact CB-CE2 4.01Å; N467-F504 HydrophobicContact CB-CZ 4.33Å; N467-F504 WeakPolarHBondContact ND2-CD2 3.31Å; N467-F504 WeakPolarHBondContact ND2-CE2 3.31Å
468	Y	72.9	Confident	69.2	Low	13 Å²	13	63.4 Å²	63.4	5%	0.051	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-38.6	170.3	179.8	-94.6	0	0	0	111.8	M419 D422 M464 I465 Q471 N472 L571	M419-Y468 VanDerWaalsContact CA-OH 3.32Å; M419-Y468 WeakPolarHBondContact CA-OH 3.36Å; M419-Y468 HydrophobicContact CG-CE1 3.96Å; D422-Y468 HydrophobicContact CB-CE1 3.9Å; D422-Y468 HydrophobicContact CB-CE2 4.15Å; D422-Y468 VanDerWaalsContact OD2-CE2 3.24Å; D422-Y468 WeakPolarHBondContact OD2-CE2 3.32Å; D422-Y468 PolarHBondContact OD2-OH 3.44Å; M464-Y468 WeakPolarHBondContact O-CB 3.17Å; M464-Y468 PolarHBondContact O-N 2.85Å; I465-Y468 PolarHBondContact O-N 3.44Å; Y468-Q471 VanDerWaalsContact O-CB 3.29Å; Y468-Q471 WeakPolarHBondContact O-CB 3.33Å; Y468-Q471 PolarHBondContact O-N 3.44Å; Y468-N472 WeakPolarHBondContact CD2-ND2 3.43Å; Y468-N472 VanDerWaalsContact CE1-ND2 3.29Å; Y468-N472 WeakPolarHBondContact CE1-ND2 3.4Å; Y468-N472 WeakPolarHBondContact CE2-ND2 3.42Å; Y468-N472 PolarHBondContact O-N 2.65Å; Y468-N472 VanDerWaalsContact O-N 3.1Å; Y468-N472 PolarHBondContact O-ND2 2.91Å; Y468-L571 HydrophobicContact CD2-CD2 3.89Å
469	M	70.7	Confident	68.7	Low	51 Å²	51	66.7 Å²	66.7	25%	0.251	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-49.8	175.2	-79.5	-66.9	-96.7	0	0	111.2	M419 F423 I465 N467 Q471 N472 L473	M419-M469 HydrophobicContact CE-SD 3.6Å; F423-M469 HydrophobicContact CE1-CE 4.41Å; F423-M469 HydrophobicContact CE1-CG 4.48Å; F423-M469 HydrophobicContact CE1-SD 4.13Å; F423-M469 HydrophobicContact CE2-SD 3.98Å; F423-M469 HydrophobicContact CZ-CE 3.68Å; F423-M469 HydrophobicContact CZ-CG 4.14Å; F423-M469 HydrophobicContact CZ-SD 3.26Å; F423-M469 WeakPolarHBondContact CZ-SD 3.45Å; I465-M469 HydrophobicContact CG1-CG 4.42Å; I465-M469 WeakPolarHBondContact O-CB 3.39Å; I465-M469 WeakPolarHBondContact O-CG 3.46Å; I465-M469 PolarHBondContact O-N 2.87Å; N467-M469 VanDerWaalsContact C-N 3.28Å; N467-M469 PolarHBondContact O-N 3.26Å; M469-Q471 PolarHBondContact O-N 2.87Å; M469-N472 PolarHBondContact O-N 3.02Å; M469-L473 HydrophobicContact CB-CD1 4.06Å; M469-L473 HydrophobicContact CE-CD1 3.25Å; M469-L473 HydrophobicContact CE-CD2 4.41Å; M469-L473 HydrophobicContact CE-CG 4.04Å; M469-L473 HydrophobicContact CG-CD1 4.44Å; M469-L473 VanDerWaalsContact O-CB 3.23Å; M469-L473 WeakPolarHBondContact O-CB 3.29Å; M469-L473 WeakPolarHBondContact O-CG 2.95Å; M469-L473 PolarHBondContact O-N 3.39Å; M469-L473 HydrophobicContact SD-CD1 3.64Å; M469-L473 HydrophobicContact SD-CG 3.9Å
470	R	68.3	Low	68.7	Low	114 Å²	114	64.7 Å²	64.7	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-57	-33.8	171.9	-71.5	169.7	-169.1	168.6	2	112.4	L466 N467	L466-R470 VanDerWaalsContact O-CG 3.27Å; L466-R470 WeakPolarHBondContact O-CG 3.14Å; L466-R470 PolarHBondContact O-N 2.92Å; N467-R470 PolarHBondContact O-N 3.41Å; N467-R470 PolarHBondContact OD1-NH1 3.43Å
471	Q	64.9	Low	69.1	Low	11 Å²	11	66.9 Å²	66.9	5%	0.051	34%	0.335	C	S	.	.	H	α-helix	trans	-65.2	-35.7	175.9	-86.2	174.3	42.9	0	0	114.1	N467 Y468 M469 W501 K578	N467-Q471 WeakPolarHBondContact O-CB 3.33Å; N467-Q471 WeakPolarHBondContact O-CG 3.33Å; N467-Q471 PolarHBondContact O-N 2.92Å; Y468-Q471 VanDerWaalsContact O-CB 3.29Å; Y468-Q471 WeakPolarHBondContact O-CB 3.33Å; Y468-Q471 PolarHBondContact O-N 3.44Å; M469-Q471 PolarHBondContact O-N 2.87Å; Q471-W501 HydrophobicContact CB-CH2 3.93Å; Q471-W501 HydrophobicContact CB-CZ3 4.41Å; Q471-W501 HydrophobicContact CG-CE3 4.35Å; Q471-W501 HydrophobicContact CG-CH2 2.99Å; Q471-W501 HydrophobicContact CG-CZ2 4.16Å; Q471-W501 HydrophobicContact CG-CZ3 3.08Å; Q471-K578 PolarHBondContact O-NZ 3.04Å
472	N	66	Low	69.2	Low	44 Å²	44	71.8 Å²	71.8	24%	0.235	36%	0.359	C	S	.	.	H	α-helix	trans	-108.8	-32.8	-168.5	-74.7	-63	0	0	0	114.3	M419 Y468 M469	M419-N472 HydrophobicContact CE-CB 4.21Å; Y468-N472 WeakPolarHBondContact CD2-ND2 3.43Å; Y468-N472 VanDerWaalsContact CE1-ND2 3.29Å; Y468-N472 WeakPolarHBondContact CE1-ND2 3.4Å; Y468-N472 WeakPolarHBondContact CE2-ND2 3.42Å; Y468-N472 PolarHBondContact O-N 2.65Å; Y468-N472 VanDerWaalsContact O-N 3.1Å; Y468-N472 PolarHBondContact O-ND2 2.91Å; M469-N472 PolarHBondContact O-N 3.02Å
473	L	57.3	Low	69.4	Low	105 Å²	105	69.5 Å²	69.5	55%	0.55	35%	0.346	S	S	.	.	H	α-helix	trans	-79.9	-38.5	-178.9	-72.2	176	0	0	0	112.2	M419 M469	M419-L473 HydrophobicContact CE-CD2 4.06Å; M419-L473 HydrophobicContact CE-CG 4.27Å; M469-L473 HydrophobicContact CB-CD1 4.06Å; M469-L473 HydrophobicContact CE-CD1 3.25Å; M469-L473 HydrophobicContact CE-CD2 4.41Å; M469-L473 HydrophobicContact CE-CG 4.04Å; M469-L473 HydrophobicContact CG-CD1 4.44Å; M469-L473 VanDerWaalsContact O-CB 3.23Å; M469-L473 WeakPolarHBondContact O-CB 3.29Å; M469-L473 WeakPolarHBondContact O-CG 2.95Å; M469-L473 PolarHBondContact O-N 3.39Å; M469-L473 HydrophobicContact SD-CD1 3.64Å; M469-L473 HydrophobicContact SD-CG 3.9Å
474	D	51.7	Low	69.8	Low	81 Å²	81	67.6 Å²	67.6	43%	0.433	34%	0.343	S	S	.	.			trans	-97.9	125.1	-171.7	-64.1	-32.1	0	0	0	110.6	T476	D474-T476 HydrophobicContact CB-CG2 3.18Å; D474-T476 PolarHBondContact O-N 3.37Å; D474-T476 WeakPolarHBondContact OD2-CG2 3.35Å
475	Q	52.5	Low	70	Confident	197 Å²	197	67.8 Å²	67.8	92%	0.921	34%	0.344	S	S	*	.			trans	-65.8	45.2	144.4	-63.7	-176	-19.5	0	0	109.2	D477	Q475-D477 PolarHBondContact O-N 3.12Å
476	T	54.3	Low	69.9	Low	60 Å²	60	70 Å²	70	37%	0.368	36%	0.356	S	S	.	.			trans	-61.8	115.4	-177.4	41.1	0	0	0	0	106.9	D474 L478	D474-T476 HydrophobicContact CB-CG2 3.18Å; D474-T476 PolarHBondContact O-N 3.37Å; D474-T476 WeakPolarHBondContact OD2-CG2 3.35Å; T476-L478 PolarHBondContact O-N 2.88Å
477	D	60.2	Low	69.8	Low	145 Å²	145	75.5 Å²	75.5	78%	0.775	38%	0.377	S	S	*	.			trans	-44.9	104.9	159.9	-66	-30.7	0	0	0	107.1	Q475 V479	Q475-D477 PolarHBondContact O-N 3.12Å; D477-V479 PolarHBondContact O-N 3.18Å; D477-V479 VanDerWaalsContact O-N 3.12Å
478	L	69.7	Low	69.9	Low	53 Å²	53	76.8 Å²	76.8	28%	0.277	38%	0.383	S	S	.	.			trans	-59.9	119.2	175	-72.3	167.2	0	0	0	106.5	T476 F480 D498 L579	T476-L478 PolarHBondContact O-N 2.88Å; L478-F480 VanDerWaalsContact C-N 3.32Å; L478-F480 HydrophobicContact CB-CD2 3.78Å; L478-F480 HydrophobicContact CB-CE2 3.37Å; L478-F480 HydrophobicContact CB-CZ 4.07Å; L478-F480 HydrophobicContact CD1-CE2 3.75Å; L478-F480 HydrophobicContact CD1-CZ 3.9Å; L478-F480 HydrophobicContact CG-CE2 4.18Å; L478-F480 PolarHBondContact O-N 3.04Å; L478-D498 HydrophobicContact CD2-CB 4.39Å; L478-L579 HydrophobicContact CD2-CD2 4.43Å
479	V	74.7	Confident	69.6	Low	90 Å²	90	83.4 Å²	83.4	55%	0.545	42%	0.415	S	S	.	.			trans	-89.1	82.8	-178.3	-175.7	0	0	0	0	107.4	D477 Q481 D498	D477-V479 PolarHBondContact O-N 3.18Å; D477-V479 VanDerWaalsContact O-N 3.12Å; V479-Q481 PolarHBondContact O-N 3.33Å; V479-D498 PolarHBondContact N-OD2 3.25Å; V479-D498 WeakPolarHBondContact O-CA 3.19Å
480	F	79.5	Confident	69.3	Low	45 Å²	45	88.9 Å²	88.9	20%	0.197	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121	174.6	-72.6	-79.2	0	0	0	110.2	L478 Y496 L579 I603	L478-F480 VanDerWaalsContact C-N 3.32Å; L478-F480 HydrophobicContact CB-CD2 3.78Å; L478-F480 HydrophobicContact CB-CE2 3.37Å; L478-F480 HydrophobicContact CB-CZ 4.07Å; L478-F480 HydrophobicContact CD1-CE2 3.75Å; L478-F480 HydrophobicContact CD1-CZ 3.9Å; L478-F480 HydrophobicContact CG-CE2 4.18Å; L478-F480 PolarHBondContact O-N 3.04Å; F480-Y496 HydrophobicContact CB-CD1 4.13Å; F480-Y496 HydrophobicContact CB-CE1 3.57Å; F480-Y496 PolarHBondContact O-OH 2.68Å; F480-L579 HydrophobicContact CE1-CD2 4.08Å; F480-L579 HydrophobicContact CZ-CD2 4.31Å; F480-I603 HydrophobicContact CB-CD1 4.27Å; F480-I603 HydrophobicContact CD1-CD1 3.07Å; F480-I603 HydrophobicContact CE1-CD1 3.36Å; F480-I603 HydrophobicContact CG-CD1 3.74Å; F480-I603 HydrophobicContact CZ-CD1 4.2Å
481	Q	81.8	Confident	69.7	Low	80 Å²	80	84.4 Å²	84.4	37%	0.374	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	160.7	176.8	58.6	177.2	0.4	0	0	110.1	V479 I483 Y496 S497	V479-Q481 PolarHBondContact O-N 3.33Å; Q481-I483 HydrophobicContact CG-CG1 4.06Å; Q481-I483 PolarHBondContact O-N 3.36Å; Q481-Y496 VanDerWaalsContact C-CD2 3.42Å; Q481-S497 PolarHBondContact N-O 3.37Å; Q481-S497 PolarHBondContact O-N 2.84Å; Q481-S497 VanDerWaalsContact O-N 3.11Å; Q481-S497 VanDerWaalsContact O-O 3.09Å
482	Q	82.2	Confident	70.2	Confident	126 Å²	126	89.9 Å²	89.9	59%	0.589	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	109.6	175.6	-165	179.7	34.3	0	0	109.8	K494 V495 Y496	Q482-K494 VanDerWaalsContact CD-CD 3.49Å; Q482-K494 HydrophobicContact CG-CB 3.87Å; Q482-K494 HydrophobicContact CG-CD 3.98Å; Q482-K494 HydrophobicContact CG-CG 4.42Å; Q482-V495 CarbonylContact C-O 3.58Å; Q482-V495 WeakPolarHBondContact CA-O 3.37Å; Q482-Y496 HydrophobicContact CB-CD2 3.95Å; Q482-Y496 HydrophobicContact CB-CE2 4.36Å
483	I	82.3	Confident	70.9	Confident	24 Å²	24	88.5 Å²	88.5	12%	0.123	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126.2	-177.5	-58.1	156.2	0	0	0	108.9	Q481 K494 V495 S497 Q499 L502	Q481-I483 HydrophobicContact CG-CG1 4.06Å; Q481-I483 PolarHBondContact O-N 3.36Å; I483-K494 VanDerWaalsContact O-CA 3.31Å; I483-K494 WeakPolarHBondContact O-CA 3.17Å; I483-V495 HydrophobicContact CB-CG2 4.36Å; I483-V495 PolarHBondContact N-O 3.19Å; I483-V495 PolarHBondContact O-N 3.24Å; I483-S497 WeakPolarHBondContact CD1-O 3.38Å; I483-Q499 VanDerWaalsContact CD1-CA 3.47Å; I483-Q499 HydrophobicContact CD1-CB 3.8Å; I483-Q499 HydrophobicContact CD1-CG 4.48Å; I483-Q499 HydrophobicContact CG1-CB 4.17Å; I483-L502 HydrophobicContact CD1-CD2 4.15Å
484	S	81.7	Confident	72.1	Confident	50 Å²	50	89.5 Å²	89.5	35%	0.35	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.6	169.3	156.5	0	0	0	0	109.7	D486	S484-D486 WeakPolarHBondContact OG-CB 3.27Å; S484-D486 PolarHBondContact OG-N 3.37Å; S484-D486 PolarHBondContact OG-OD2 3Å
485	I	78	Confident	73.8	Confident	7 Å²	7	86 Å²	86	4%	0.036	44%	0.442	C	S	.	.			trans	-83.8	-4.8	177	-66.3	-178.9	0	0	0	110.7	K487 L488 L491 G493 V495 F526 L531 F599	I485-K487 PolarHBondContact O-N 2.99Å; I485-L488 HydrophobicContact CG2-CB 4.33Å; I485-L488 HydrophobicContact CG2-CD1 3.91Å; I485-L488 WeakPolarHBondContact O-CB 3.01Å; I485-L488 PolarHBondContact O-N 3.32Å; I485-L491 HydrophobicContact CG2-CB 4.12Å; I485-L491 HydrophobicContact CG2-CD1 3.92Å; I485-G493 PolarHBondContact N-O 3.36Å; I485-V495 HydrophobicContact CD1-CB 4.24Å; I485-V495 HydrophobicContact CD1-CG1 3.49Å; I485-V495 VanDerWaalsContact CD1-CG1 3.49Å; I485-V495 HydrophobicContact CD1-CG2 3.75Å; I485-V495 HydrophobicContact CG1-CG1 4.46Å; I485-V495 HydrophobicContact CG1-CG2 4.01Å; I485-F526 HydrophobicContact CD1-CD1 4.5Å; I485-F526 HydrophobicContact CD1-CD2 3.75Å; I485-F526 HydrophobicContact CD1-CE1 4.37Å; I485-F526 HydrophobicContact CD1-CE2 3.59Å; I485-F526 HydrophobicContact CD1-CG 4.21Å; I485-F526 HydrophobicContact CD1-CZ 3.93Å; I485-L531 HydrophobicContact CG2-CD1 4.24Å; I485-F599 HydrophobicContact CD1-CE2 4.48Å
486	D	75.7	Confident	75.3	Confident	76 Å²	76	82.4 Å²	82.4	41%	0.406	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.6	-170.1	-43.2	-26	0	0	0	114.5	S484 L488 L491 T492 G493	S484-D486 WeakPolarHBondContact OG-CB 3.27Å; S484-D486 PolarHBondContact OG-N 3.37Å; S484-D486 PolarHBondContact OG-OD2 3Å; D486-L488 VanDerWaalsContact C-N 3.33Å; D486-L491 VanDerWaalsContact CA-O 3.24Å; D486-L491 WeakPolarHBondContact CA-O 3.46Å; D486-T492 VanDerWaalsContact OD1-CA 3.27Å; D486-T492 WeakPolarHBondContact OD1-CA 3.43Å; D486-G493 PolarHBondContact OD1-N 2.82Å
487	K	72.5	Confident	76.9	Confident	198 Å²	198	79.5 Å²	79.5	86%	0.861	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-17.2	173	-65.7	-173.7	179.8	178.9	0	113.9	I485	I485-K487 PolarHBondContact O-N 2.99Å
488	L	70.4	Confident	78.1	Confident	43 Å²	43	73.2 Å²	73.2	23%	0.225	37%	0.369	C	S	.	.	S	Bend	trans	-90.6	104.8	173.8	-68.5	156.1	0	0	0	107	I485 D486 N490 L491 L506 I510 I524	I485-L488 HydrophobicContact CG2-CB 4.33Å; I485-L488 HydrophobicContact CG2-CD1 3.91Å; I485-L488 WeakPolarHBondContact O-CB 3.01Å; I485-L488 PolarHBondContact O-N 3.32Å; D486-L488 VanDerWaalsContact C-N 3.33Å; L488-N490 PolarHBondContact O-N 3.15Å; L488-L491 HydrophobicContact CB-CD1 4Å; L488-L491 VanDerWaalsContact O-CB 3.32Å; L488-L491 WeakPolarHBondContact O-CB 3.07Å; L488-L491 WeakPolarHBondContact O-CD1 3.43Å; L488-L491 WeakPolarHBondContact O-CG 3.4Å; L488-L491 PolarHBondContact O-N 3.05Å; L488-L506 HydrophobicContact CD1-CD1 3.99Å; L488-I510 HydrophobicContact CD2-CD1 4.36Å; L488-I524 HydrophobicContact CD2-CD1 4.31Å
489	E	66.4	Low	78.9	Confident	151 Å²	151	74.9 Å²	74.9	71%	0.706	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	10.8	97.3	178.5	-75.7	-166.7	146.5	0	0	118	L491	E489-L491 PolarHBondContact O-N 2.84Å
490	N	65.4	Low	79.1	Confident	167 Å²	167	78.1 Å²	78.1	89%	0.893	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	19.2	169.5	-66.1	-23.8	0	0	0	115.8	L488	L488-N490 PolarHBondContact O-N 3.15Å
491	L	77.1	Confident	79.3	Confident	20 Å²	20	77.1 Å²	77.1	11%	0.105	38%	0.377	C	S	.	.			trans	-81	148.4	171.4	-60	174.7	0	0	0	109.4	I485 D486 L488 E489 I524 F526 L531	I485-L491 HydrophobicContact CG2-CB 4.12Å; I485-L491 HydrophobicContact CG2-CD1 3.92Å; D486-L491 VanDerWaalsContact CA-O 3.24Å; D486-L491 WeakPolarHBondContact CA-O 3.46Å; L488-L491 HydrophobicContact CB-CD1 4Å; L488-L491 VanDerWaalsContact O-CB 3.32Å; L488-L491 WeakPolarHBondContact O-CB 3.07Å; L488-L491 WeakPolarHBondContact O-CD1 3.43Å; L488-L491 WeakPolarHBondContact O-CG 3.4Å; L488-L491 PolarHBondContact O-N 3.05Å; E489-L491 PolarHBondContact O-N 2.84Å; L491-I524 HydrophobicContact CD1-CB 4.34Å; L491-I524 HydrophobicContact CD1-CG2 3.69Å; L491-F526 HydrophobicContact CB-CB 4.41Å; L491-F526 HydrophobicContact CD1-CB 4.1Å; L491-F526 HydrophobicContact CD2-CB 4.07Å; L491-F526 HydrophobicContact CG-CB 4.42Å; L491-L531 HydrophobicContact CD1-CD1 3.98Å
492	T	74.5	Confident	79.5	Confident	125 Å²	125	73.6 Å²	73.6	77%	0.767	36%	0.361	S	S	*	.			trans	-124.7	114.5	169.7	54.2	0	0	0	0	108.2	D486	D486-T492 VanDerWaalsContact OD1-CA 3.27Å; D486-T492 WeakPolarHBondContact OD1-CA 3.43Å
493	G	81	Confident	79.7	Confident	15 Å²	15	71.1 Å²	71.1	16%	0.155	35%	0.351	C	S	.	.			trans	179.3	154	-175.3	0	0	0	0	0	113.9	I485 D486	I485-G493 PolarHBondContact N-O 3.36Å; D486-G493 PolarHBondContact OD1-N 2.82Å
494	K	83.5	Confident	79.8	Confident	126 Å²	126	70.3 Å²	70.3	55%	0.548	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136	173.7	-64.8	-173.8	-178	-177.4	0	109.5	Q482 I483	Q482-K494 VanDerWaalsContact CD-CD 3.49Å; Q482-K494 HydrophobicContact CG-CB 3.87Å; Q482-K494 HydrophobicContact CG-CD 3.98Å; Q482-K494 HydrophobicContact CG-CG 4.42Å; I483-K494 VanDerWaalsContact O-CA 3.31Å; I483-K494 WeakPolarHBondContact O-CA 3.17Å
495	V	86.8	Confident	80.2	Confident	9 Å²	9	67.9 Å²	67.9	6%	0.055	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.8	174.3	-65.7	0	0	0	0	109.5	Q482 I483 I485 L502 F526 F599	Q482-V495 CarbonylContact C-O 3.58Å; Q482-V495 WeakPolarHBondContact CA-O 3.37Å; I483-V495 HydrophobicContact CB-CG2 4.36Å; I483-V495 PolarHBondContact N-O 3.19Å; I483-V495 PolarHBondContact O-N 3.24Å; I485-V495 HydrophobicContact CD1-CB 4.24Å; I485-V495 HydrophobicContact CD1-CG1 3.49Å; I485-V495 VanDerWaalsContact CD1-CG1 3.49Å; I485-V495 HydrophobicContact CD1-CG2 3.75Å; I485-V495 HydrophobicContact CG1-CG1 4.46Å; I485-V495 HydrophobicContact CG1-CG2 4.01Å; V495-L502 HydrophobicContact CG2-CD2 3.96Å; V495-F526 HydrophobicContact CG1-CE2 3.68Å; V495-F526 HydrophobicContact CG1-CZ 3.5Å; V495-F599 HydrophobicContact CB-CD1 3.97Å; V495-F599 HydrophobicContact CB-CD2 4.39Å; V495-F599 HydrophobicContact CB-CE1 4.18Å; V495-F599 HydrophobicContact CB-CG 4.08Å; V495-F599 HydrophobicContact CB-CZ 4.49Å; V495-F599 HydrophobicContact CG1-CB 4.35Å; V495-F599 HydrophobicContact CG1-CD1 4.1Å; V495-F599 HydrophobicContact CG1-CD2 3.61Å; V495-F599 HydrophobicContact CG1-CE1 4.3Å; V495-F599 HydrophobicContact CG1-CE2 3.85Å; V495-F599 HydrophobicContact CG1-CG 3.75Å; V495-F599 HydrophobicContact CG1-CZ 4.19Å; V495-F599 HydrophobicContact CG2-CD1 4.27Å; V495-F599 HydrophobicContact CG2-CE1 3.99Å; V495-F599 HydrophobicContact CG2-CZ 4.23Å
496	Y	84.6	Confident	80.7	Confident	120 Å²	120	68.5 Å²	68.5	47%	0.471	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.1	174.2	-153.8	-112.6	0	0	0	108	F480 Q481 Q482 I603	F480-Y496 HydrophobicContact CB-CD1 4.13Å; F480-Y496 HydrophobicContact CB-CE1 3.57Å; F480-Y496 PolarHBondContact O-OH 2.68Å; Q481-Y496 VanDerWaalsContact C-CD2 3.42Å; Q482-Y496 HydrophobicContact CB-CD2 3.95Å; Q482-Y496 HydrophobicContact CB-CE2 4.36Å; Y496-I603 HydrophobicContact CD1-CB 4.33Å; Y496-I603 HydrophobicContact CD1-CD1 3.35Å; Y496-I603 HydrophobicContact CD1-CG1 3.76Å; Y496-I603 HydrophobicContact CE1-CD1 4.05Å; Y496-I603 HydrophobicContact CG-CD1 4.27Å
497	S	87.5	Confident	81.2	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	175.2	-175.1	-156.7	0	0	0	0	110.7	Q481 I483	Q481-S497 PolarHBondContact N-O 3.37Å; Q481-S497 PolarHBondContact O-N 2.84Å; Q481-S497 VanDerWaalsContact O-N 3.11Å; Q481-S497 VanDerWaalsContact O-O 3.09Å; I483-S497 WeakPolarHBondContact CD1-O 3.38Å
498	D	85.7	Confident	81.9	Confident	12 Å²	12	61.3 Å²	61.3	6%	0.064	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.6	164.9	-175	-61	0	0	0	109.7	L478 V479 K500 W501 L502 L579	L478-D498 HydrophobicContact CD2-CB 4.39Å; V479-D498 PolarHBondContact N-OD2 3.25Å; V479-D498 WeakPolarHBondContact O-CA 3.19Å; D498-K500 VanDerWaalsContact C-N 3.34Å; D498-K500 PolarHBondContact O-N 3.37Å; D498-K500 WeakPolarHBondContact OD1-CB 3.33Å; D498-K500 PolarHBondContact OD1-N 3.29Å; D498-W501 HydrophobicContact CB-CB 4.35Å; D498-W501 HydrophobicContact CB-CG 4.48Å; D498-W501 VanDerWaalsContact CG-CD1 3.46Å; D498-W501 PolarHBondContact O-N 3.13Å; D498-W501 PolarHBondContact OD1-N 3.46Å; D498-L502 VanDerWaalsContact O-CB 3.31Å; D498-L502 WeakPolarHBondContact O-CB 3.5Å; D498-L502 PolarHBondContact O-N 3.29Å; D498-L579 HydrophobicContact CB-CD2 3.77Å
499	Q	84.6	Confident	82.9	Confident	88 Å²	88	59.5 Å²	59.5	41%	0.411	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-39.6	-173.9	-177.8	-178.5	2	0	0	112.9	I483 I503	I483-Q499 VanDerWaalsContact CD1-CA 3.47Å; I483-Q499 HydrophobicContact CD1-CB 3.8Å; I483-Q499 HydrophobicContact CD1-CG 4.48Å; I483-Q499 HydrophobicContact CG1-CB 4.17Å; Q499-I503 HydrophobicContact CG-CD1 3.82Å; Q499-I503 HydrophobicContact CG-CG1 4.48Å; Q499-I503 WeakPolarHBondContact O-CB 3.41Å; Q499-I503 WeakPolarHBondContact O-CD1 3.24Å; Q499-I503 WeakPolarHBondContact O-CG1 3.48Å; Q499-I503 PolarHBondContact O-N 3.09Å
500	K	79.9	Confident	84	Confident	159 Å²	159	54.2 Å²	54.2	69%	0.691	27%	0.267	S	S	*	.	H	α-helix	trans	-68.9	-43.7	-175.6	-65.9	175.7	-177.8	168.8	0	110.4	D498 I503 F504	D498-K500 VanDerWaalsContact C-N 3.34Å; D498-K500 PolarHBondContact O-N 3.37Å; D498-K500 WeakPolarHBondContact OD1-CB 3.33Å; D498-K500 PolarHBondContact OD1-N 3.29Å; K500-I503 PolarHBondContact O-N 3Å; K500-F504 PolarHBondContact O-N 3.45Å; K500-F504 VanDerWaalsContact O-N 3.13Å
501	W	82.8	Confident	84.9	Confident	23 Å²	23	48.6 Å²	48.6	9%	0.087	23%	0.234	C	C	.	.	H	α-helix	trans	-71.5	-39.1	-179.6	-70.1	87.9	0	0	0	112.6	Q471 D498 F504 I505 A575 K578 L579	Q471-W501 HydrophobicContact CB-CH2 3.93Å; Q471-W501 HydrophobicContact CB-CZ3 4.41Å; Q471-W501 HydrophobicContact CG-CE3 4.35Å; Q471-W501 HydrophobicContact CG-CH2 2.99Å; Q471-W501 HydrophobicContact CG-CZ2 4.16Å; Q471-W501 HydrophobicContact CG-CZ3 3.08Å; D498-W501 HydrophobicContact CB-CB 4.35Å; D498-W501 HydrophobicContact CB-CG 4.48Å; D498-W501 VanDerWaalsContact CG-CD1 3.46Å; D498-W501 PolarHBondContact O-N 3.13Å; D498-W501 PolarHBondContact OD1-N 3.46Å; W501-F504 WeakPolarHBondContact O-CB 3.42Å; W501-F504 PolarHBondContact O-N 3.01Å; W501-I505 WeakPolarHBondContact O-CG1 2.99Å; W501-I505 PolarHBondContact O-N 3.03Å; W501-I505 VanDerWaalsContact O-N 3.09Å; W501-A575 HydrophobicContact CE3-CB 3.64Å; W501-A575 HydrophobicContact CZ3-CB 3.99Å; W501-K578 HydrophobicContact CH2-CD 3.84Å; W501-K578 HydrophobicContact CZ3-CD 4.16Å; W501-L579 HydrophobicContact CB-CD1 3.81Å; W501-L579 HydrophobicContact CB-CD2 4Å; W501-L579 HydrophobicContact CB-CG 4.2Å
502	L	87.8	Confident	85.5	Confident	7 Å²	7	49 Å²	49	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-44.5	173.5	179.9	55.6	0	0	0	111.3	I483 V495 D498 F504 I505 L506 F599	I483-L502 HydrophobicContact CD1-CD2 4.15Å; V495-L502 HydrophobicContact CG2-CD2 3.96Å; D498-L502 VanDerWaalsContact O-CB 3.31Å; D498-L502 WeakPolarHBondContact O-CB 3.5Å; D498-L502 PolarHBondContact O-N 3.29Å; L502-F504 VanDerWaalsContact C-N 3.29Å; L502-F504 PolarHBondContact O-N 3.38Å; L502-I505 PolarHBondContact O-N 3.13Å; L502-L506 HydrophobicContact CD1-CD1 4.09Å; L502-L506 HydrophobicContact CD1-CG 4.05Å; L502-L506 HydrophobicContact CG-CD1 3.93Å; L502-L506 HydrophobicContact CG-CG 4.37Å; L502-L506 VanDerWaalsContact O-CG 3.24Å; L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 3.47Å; L502-F599 HydrophobicContact CD1-CE1 3.72Å; L502-F599 HydrophobicContact CD1-CZ 3.82Å; L502-F599 HydrophobicContact CD2-CE1 4.02Å; L502-F599 HydrophobicContact CD2-CZ 4.28Å
503	I	85.3	Confident	86.2	Confident	74 Å²	74	43.2 Å²	43.2	38%	0.379	20%	0.201	S	C	.	.	H	α-helix	trans	-56.3	-45.5	175.3	-74.4	168	0	0	0	110.6	Q499 K500 I505 L506 E507	Q499-I503 HydrophobicContact CG-CD1 3.82Å; Q499-I503 HydrophobicContact CG-CG1 4.48Å; Q499-I503 WeakPolarHBondContact O-CB 3.41Å; Q499-I503 WeakPolarHBondContact O-CD1 3.24Å; Q499-I503 WeakPolarHBondContact O-CG1 3.48Å; Q499-I503 PolarHBondContact O-N 3.09Å; K500-I503 PolarHBondContact O-N 3Å; I503-I505 PolarHBondContact O-N 3.09Å; I503-L506 PolarHBondContact O-N 2.97Å; I503-E507 HydrophobicContact CG2-CG 4.14Å; I503-E507 WeakPolarHBondContact O-CB 3.36Å; I503-E507 WeakPolarHBondContact O-CG 3.5Å; I503-E507 PolarHBondContact O-N 2.84Å
504	F	84.4	Confident	86.5	Confident	6 Å²	6	47 Å²	47	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-58.1	-48.8	177.6	168.3	-107.5	0	0	0	112.8	N467 K500 W501 L502 L506 E507 Q508 L571 A575	N467-F504 HydrophobicContact CB-CD2 4.12Å; N467-F504 HydrophobicContact CB-CE2 4.01Å; N467-F504 HydrophobicContact CB-CZ 4.33Å; N467-F504 WeakPolarHBondContact ND2-CD2 3.31Å; N467-F504 WeakPolarHBondContact ND2-CE2 3.31Å; K500-F504 PolarHBondContact O-N 3.45Å; K500-F504 VanDerWaalsContact O-N 3.13Å; W501-F504 WeakPolarHBondContact O-CB 3.42Å; W501-F504 PolarHBondContact O-N 3.01Å; L502-F504 VanDerWaalsContact C-N 3.29Å; L502-F504 PolarHBondContact O-N 3.38Å; F504-L506 VanDerWaalsContact C-N 3.31Å; F504-L506 PolarHBondContact O-N 3.05Å; F504-E507 PolarHBondContact O-N 3.45Å; F504-Q508 HydrophobicContact CD2-CG 4.08Å; F504-Q508 HydrophobicContact CE1-CG 4.4Å; F504-Q508 HydrophobicContact CE2-CG 3.61Å; F504-Q508 HydrophobicContact CZ-CG 3.79Å; F504-Q508 WeakPolarHBondContact O-CG 3.32Å; F504-Q508 PolarHBondContact O-N 3.49Å; F504-L571 HydrophobicContact CE1-CB 3.89Å; F504-L571 HydrophobicContact CZ-CB 3.67Å; F504-L571 HydrophobicContact CZ-CD1 4.18Å; F504-A575 HydrophobicContact CD1-CB 4.15Å; F504-A575 HydrophobicContact CE1-CB 4.34Å
505	I	89.7	Confident	86.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-46.1	179.1	-65.5	166	0	0	0	110.2	W501 L502 I503 Q508 I509 A575 A576 L579 L583 I597	W501-I505 WeakPolarHBondContact O-CG1 2.99Å; W501-I505 PolarHBondContact O-N 3.03Å; W501-I505 VanDerWaalsContact O-N 3.09Å; L502-I505 PolarHBondContact O-N 3.13Å; I503-I505 PolarHBondContact O-N 3.09Å; I505-Q508 PolarHBondContact O-N 2.81Å; I505-I509 HydrophobicContact CG2-CD1 3.66Å; I505-I509 WeakPolarHBondContact O-CG1 3.28Å; I505-I509 PolarHBondContact O-N 3.27Å; I505-A575 HydrophobicContact CD1-CB 3.8Å; I505-A575 HydrophobicContact CG1-CB 3.73Å; I505-A576 HydrophobicContact CD1-CB 4.08Å; I505-L579 HydrophobicContact CD1-CD1 3.77Å; I505-L583 HydrophobicContact CG2-CD1 4.49Å; I505-L583 HydrophobicContact CG2-CD2 4.26Å; I505-I597 HydrophobicContact CG2-CD1 3.79Å
506	L	90.1	Very high	86.4	Confident	19 Å²	19	44.4 Å²	44.4	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-46	180	-67.3	173	0	0	0	112.1	L488 L502 I503 F504 Q508 I509 I510 L531 I533 I597	L488-L506 HydrophobicContact CD1-CD1 3.99Å; L502-L506 HydrophobicContact CD1-CD1 4.09Å; L502-L506 HydrophobicContact CD1-CG 4.05Å; L502-L506 HydrophobicContact CG-CD1 3.93Å; L502-L506 HydrophobicContact CG-CG 4.37Å; L502-L506 VanDerWaalsContact O-CG 3.24Å; L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 3.47Å; I503-L506 PolarHBondContact O-N 2.97Å; F504-L506 VanDerWaalsContact C-N 3.31Å; F504-L506 PolarHBondContact O-N 3.05Å; L506-Q508 VanDerWaalsContact C-N 3.31Å; L506-Q508 PolarHBondContact O-N 3.4Å; L506-I509 PolarHBondContact O-N 3.32Å; L506-I510 HydrophobicContact CB-CD1 4.48Å; L506-I510 VanDerWaalsContact O-CB 3.3Å; L506-I510 WeakPolarHBondContact O-CB 3.49Å; L506-I510 VanDerWaalsContact O-CG1 3.26Å; L506-I510 WeakPolarHBondContact O-CG1 3.48Å; L506-I510 PolarHBondContact O-N 2.91Å; L506-L531 HydrophobicContact CD2-CD2 3.33Å; L506-I533 HydrophobicContact CD2-CD1 3.96Å; L506-I597 HydrophobicContact CD2-CD1 3.74Å
507	E	86.2	Confident	86.5	Confident	108 Å²	108	39.6 Å²	39.6	51%	0.505	19%	0.187	S	C	.	.	H	α-helix	trans	-57.7	-45.2	176.7	-77.4	178.7	168.8	0	0	110.9	I503 F504 F511	I503-E507 HydrophobicContact CG2-CG 4.14Å; I503-E507 WeakPolarHBondContact O-CB 3.36Å; I503-E507 WeakPolarHBondContact O-CG 3.5Å; I503-E507 PolarHBondContact O-N 2.84Å; F504-E507 PolarHBondContact O-N 3.45Å; E507-F511 WeakPolarHBondContact O-CA 3.33Å; E507-F511 WeakPolarHBondContact O-CB 3.36Å; E507-F511 PolarHBondContact O-N 3.23Å
508	Q	86.2	Confident	86.2	Confident	16 Å²	16	46.7 Å²	46.7	8%	0.075	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-43	178.2	-70.3	-61.7	-49.8	0	0	112.7	F504 I505 L506 N512 G568 S572	F504-Q508 HydrophobicContact CD2-CG 4.08Å; F504-Q508 HydrophobicContact CE1-CG 4.4Å; F504-Q508 HydrophobicContact CE2-CG 3.61Å; F504-Q508 HydrophobicContact CZ-CG 3.79Å; F504-Q508 WeakPolarHBondContact O-CG 3.32Å; F504-Q508 PolarHBondContact O-N 3.49Å; I505-Q508 PolarHBondContact O-N 2.81Å; L506-Q508 VanDerWaalsContact C-N 3.31Å; L506-Q508 PolarHBondContact O-N 3.4Å; Q508-N512 WeakPolarHBondContact O-CB 3.5Å; Q508-N512 VanDerWaalsContact O-CG 3.31Å; Q508-N512 PolarHBondContact O-N 2.88Å; Q508-N512 PolarHBondContact O-ND2 2.67Å; Q508-N512 VanDerWaalsContact O-ND2 3.15Å; Q508-G568 VanDerWaalsContact OE1-CA 3.23Å; Q508-S572 VanDerWaalsContact CB-OG 3.31Å; Q508-S572 WeakPolarHBondContact CB-OG 3.47Å
509	I	91.5	Very high	86.2	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-70.1	-49.3	-179.4	-65.4	165.3	0	0	0	110.8	I505 L506 F511 N512 A513 I533 L583 V595 I597	I505-I509 HydrophobicContact CG2-CD1 3.66Å; I505-I509 WeakPolarHBondContact O-CG1 3.28Å; I505-I509 PolarHBondContact O-N 3.27Å; L506-I509 PolarHBondContact O-N 3.32Å; I509-F511 VanDerWaalsContact C-N 3.27Å; I509-F511 PolarHBondContact O-N 2.91Å; I509-N512 PolarHBondContact O-N 3.43Å; I509-A513 PolarHBondContact O-N 3.48Å; I509-I533 HydrophobicContact CB-CD1 4.03Å; I509-I533 HydrophobicContact CG2-CB 3.89Å; I509-I533 HydrophobicContact CG2-CD1 3.55Å; I509-I533 HydrophobicContact CG2-CG1 4.32Å; I509-I533 HydrophobicContact CG2-CG2 3.93Å; I509-L583 HydrophobicContact CD1-CD2 4.31Å; I509-V595 HydrophobicContact CD1-CG1 3.66Å; I509-V595 HydrophobicContact CG1-CG1 4.05Å; I509-V595 HydrophobicContact CG2-CB 3.78Å; I509-V595 HydrophobicContact CG2-CG1 4.08Å; I509-V595 HydrophobicContact CG2-CG2 3.96Å; I509-I597 HydrophobicContact CD1-CD1 3.85Å; I509-I597 HydrophobicContact CD1-CG1 4.08Å
510	I	89.7	Confident	86.5	Confident	41 Å²	41	51.8 Å²	51.8	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-40.3	178.8	-67.8	170.6	0	0	0	110	L488 L506 A513 I514 I524 I533	L488-I510 HydrophobicContact CD2-CD1 4.36Å; L506-I510 HydrophobicContact CB-CD1 4.48Å; L506-I510 VanDerWaalsContact O-CB 3.3Å; L506-I510 WeakPolarHBondContact O-CB 3.49Å; L506-I510 VanDerWaalsContact O-CG1 3.26Å; L506-I510 WeakPolarHBondContact O-CG1 3.48Å; L506-I510 PolarHBondContact O-N 2.91Å; I510-A513 WeakPolarHBondContact O-CB 3.45Å; I510-A513 PolarHBondContact O-N 3.45Å; I510-I514 HydrophobicContact CG2-CD1 3.84Å; I510-I514 HydrophobicContact CG2-CG1 4.38Å; I510-I514 VanDerWaalsContact O-CG1 3.32Å; I510-I514 WeakPolarHBondContact O-CG1 3.42Å; I510-I514 PolarHBondContact O-N 3.27Å; I510-I524 HydrophobicContact CD1-CD1 4.09Å; I510-I524 HydrophobicContact CG1-CD1 4.47Å; I510-I533 HydrophobicContact CG1-CD1 4.16Å
511	F	85	Confident	87	Confident	48 Å²	48	48.7 Å²	48.7	21%	0.211	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-41.8	178.2	-173.1	-102.9	0	0	0	112.1	F456 E460 E507 I509 A513 I514 K515	F456-F511 HydrophobicContact CD1-CE2 4.46Å; F456-F511 HydrophobicContact CD1-CZ 4.08Å; F456-F511 HydrophobicContact CE1-CD2 4.24Å; F456-F511 AromaticContact CE1-CE1 3.91Å; F456-F511 HydrophobicContact CE1-CE1 3.91Å; F456-F511 AromaticContact CE1-CE2 3.26Å; F456-F511 HydrophobicContact CE1-CE2 3.26Å; F456-F511 AromaticContact CE1-CZ 3.07Å; F456-F511 HydrophobicContact CE1-CZ 3.07Å; F456-F511 HydrophobicContact CE2-CE2 4.31Å; F456-F511 AromaticContact CZ-CD2 3.89Å; F456-F511 HydrophobicContact CZ-CD2 3.89Å; F456-F511 AromaticContact CZ-CE2 3.15Å; F456-F511 HydrophobicContact CZ-CE2 3.15Å; F456-F511 AromaticContact CZ-CZ 3.55Å; F456-F511 HydrophobicContact CZ-CZ 3.55Å; E460-F511 HydrophobicContact CG-CE1 4.44Å; E460-F511 WeakPolarHBondContact OE1-CD1 3.47Å; E460-F511 WeakPolarHBondContact OE1-CE1 2.82Å; E507-F511 WeakPolarHBondContact O-CA 3.33Å; E507-F511 WeakPolarHBondContact O-CB 3.36Å; E507-F511 PolarHBondContact O-N 3.23Å; I509-F511 VanDerWaalsContact C-N 3.27Å; I509-F511 PolarHBondContact O-N 2.91Å; F511-A513 PolarHBondContact O-N 3.46Å; F511-I514 PolarHBondContact O-N 2.91Å; F511-K515 HydrophobicContact CE1-CB 4.44Å; F511-K515 HydrophobicContact CE1-CD 3.96Å; F511-K515 WeakPolarHBondContact O-CB 3.4Å; F511-K515 PolarHBondContact O-N 3.42Å
512	N	88	Confident	87.5	Confident	29 Å²	29	50.2 Å²	50.2	16%	0.155	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-44	172.2	-75.6	-33.4	0	0	0	111.7	Q508 I509 I514 K515 Y516	Q508-N512 WeakPolarHBondContact O-CB 3.5Å; Q508-N512 VanDerWaalsContact O-CG 3.31Å; Q508-N512 PolarHBondContact O-N 2.88Å; Q508-N512 PolarHBondContact O-ND2 2.67Å; Q508-N512 VanDerWaalsContact O-ND2 3.15Å; I509-N512 PolarHBondContact O-N 3.43Å; N512-I514 VanDerWaalsContact C-N 3.34Å; N512-I514 PolarHBondContact O-N 3.35Å; N512-K515 PolarHBondContact O-N 2.93Å; N512-Y516 HydrophobicContact CB-CD2 4.26Å; N512-Y516 HydrophobicContact CB-CE2 4.22Å; N512-Y516 WeakPolarHBondContact O-CD2 3.45Å; N512-Y516 PolarHBondContact O-N 3.37Å
513	A	90.4	Very high	87.7	Confident	3 Å²	3	52.8 Å²	52.8	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-45.1	176.6	0	0	0	0	0	112.1	I509 I510 F511 T517 I522 D535	I509-A513 PolarHBondContact O-N 3.48Å; I510-A513 WeakPolarHBondContact O-CB 3.45Å; I510-A513 PolarHBondContact O-N 3.45Å; F511-A513 PolarHBondContact O-N 3.46Å; A513-T517 WeakPolarHBondContact O-CB 3.09Å; A513-T517 PolarHBondContact O-N 3.15Å; A513-T517 PolarHBondContact O-OG1 3.44Å; A513-I522 HydrophobicContact CB-CD1 3.78Å; A513-I522 HydrophobicContact CB-CG1 4.07Å; A513-I522 HydrophobicContact CB-CG2 4.09Å; A513-D535 HydrophobicContact CB-CB 3.83Å
514	I	86.2	Confident	88.1	Confident	94 Å²	94	51 Å²	51	48%	0.482	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-47.2	175.4	-67.8	168.2	0	0	0	110.7	I510 F511 N512 Y516 T517 I522	I510-I514 HydrophobicContact CG2-CD1 3.84Å; I510-I514 HydrophobicContact CG2-CG1 4.38Å; I510-I514 VanDerWaalsContact O-CG1 3.32Å; I510-I514 WeakPolarHBondContact O-CG1 3.42Å; I510-I514 PolarHBondContact O-N 3.27Å; F511-I514 PolarHBondContact O-N 2.91Å; N512-I514 VanDerWaalsContact C-N 3.34Å; N512-I514 PolarHBondContact O-N 3.35Å; I514-Y516 VanDerWaalsContact C-N 3.33Å; I514-Y516 PolarHBondContact O-N 3.2Å; I514-T517 PolarHBondContact O-N 3.05Å; I514-I522 HydrophobicContact CB-CD1 4.29Å; I514-I522 HydrophobicContact CG1-CD1 3.51Å
515	K	82.2	Confident	88.4	Confident	35 Å²	35	53.1 Å²	53.1	15%	0.152	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-36.7	-175.2	-178.8	-178.8	-171.1	163.6	0	113.5	F511 N512 R563	F511-K515 HydrophobicContact CE1-CB 4.44Å; F511-K515 HydrophobicContact CE1-CD 3.96Å; F511-K515 WeakPolarHBondContact O-CB 3.4Å; F511-K515 PolarHBondContact O-N 3.42Å; N512-K515 PolarHBondContact O-N 2.93Å; K515-R563 VanDerWaalsContact CE-O 3.28Å; K515-R563 WeakPolarHBondContact CE-O 3.47Å; K515-R563 PolarHBondContact NZ-O 3.23Å
516	Y	86.2	Confident	88.4	Confident	47 Å²	47	54.7 Å²	54.7	18%	0.184	30%	0.303	C	S	.	.	H	α-helix	trans	-98.6	0.7	-177.1	-61.7	-63.7	0	0	0	114	N512 I514 G537 M538 A564	N512-Y516 HydrophobicContact CB-CD2 4.26Å; N512-Y516 HydrophobicContact CB-CE2 4.22Å; N512-Y516 WeakPolarHBondContact O-CD2 3.45Å; N512-Y516 PolarHBondContact O-N 3.37Å; I514-Y516 VanDerWaalsContact C-N 3.33Å; I514-Y516 PolarHBondContact O-N 3.2Å; Y516-G537 WeakPolarHBondContact O-CA 3.3Å; Y516-M538 HydrophobicContact CD1-SD 3.83Å; Y516-M538 PolarHBondContact O-N 3.42Å; Y516-M538 VanDerWaalsContact O-N 3.09Å; Y516-A564 WeakPolarHBondContact OH-CB 3.21Å
517	T	87.6	Confident	88.3	Confident	18 Å²	18	60.7 Å²	60.7	11%	0.11	33%	0.33	C	S	.	.			trans	-110.9	90	175.7	-53.3	0	0	0	0	110.3	A513 I514 D535 G537	A513-T517 WeakPolarHBondContact O-CB 3.09Å; A513-T517 PolarHBondContact O-N 3.15Å; A513-T517 PolarHBondContact O-OG1 3.44Å; I514-T517 PolarHBondContact O-N 3.05Å; T517-D535 WeakPolarHBondContact OG1-CB 3.34Å; T517-G537 WeakPolarHBondContact OG1-CA 3.32Å; T517-G537 PolarHBondContact OG1-N 3.02Å
518	E	80.9	Confident	88.3	Confident	149 Å²	149	64.2 Å²	64.2	70%	0.696	34%	0.344	S	S	*	.	S	Bend	trans	-70.7	-44	176.8	-68.1	-171.9	165.6	0	0	112.6
519	N	85.3	Confident	88.4	Confident	151 Å²	151	65 Å²	65	81%	0.807	35%	0.348	S	S	*	.	S	Bend	trans	-136.1	122.2	172.6	-65.4	-67.4	0	0	0	108
520	G	90.2	Very high	88.4	Confident	56 Å²	56	70.2 Å²	70.2	58%	0.577	37%	0.368	S	S	*	.	S	Bend	trans	157.8	-162.7	-178.1	0	0	0	0	0	112	T536	G520-T536 WeakPolarHBondContact CA-OG1 3.49Å
521	T	91.7	Very high	88.6	Confident	95 Å²	95	68.3 Å²	68.3	58%	0.583	36%	0.358	S	S	*	.			trans	-125.7	148.3	178.9	57	0	0	0	0	110.6	T536	T521-T536 PolarHBondContact N-OG1 3.35Å; T521-T536 PolarHBondContact O-N 3.06Å; T521-T536 PolarHBondContact O-OG1 3.26Å
522	I	93	Very high	89.1	Confident	55 Å²	55	67.5 Å²	67.5	28%	0.282	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.9	166.1	-57.1	167.9	0	0	0	105.9	A513 I514 I533 R534 D535	A513-I522 HydrophobicContact CB-CD1 3.78Å; A513-I522 HydrophobicContact CB-CG1 4.07Å; A513-I522 HydrophobicContact CB-CG2 4.09Å; I514-I522 HydrophobicContact CB-CD1 4.29Å; I514-I522 HydrophobicContact CG1-CD1 3.51Å; I522-I533 HydrophobicContact CG2-CG2 4.16Å; I522-R534 CarbonylContact C-O 3.55Å; I522-R534 WeakPolarHBondContact CA-O 3.48Å; I522-D535 HydrophobicContact CG1-CB 4.24Å
523	S	91.9	Very high	89.4	Confident	60 Å²	60	66.2 Å²	66.2	42%	0.42	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.8	178	56.5	0	0	0	0	109.6	R534	S523-R534 PolarHBondContact N-O 2.77Å; S523-R534 PolarHBondContact O-N 3.27Å; S523-R534 PolarHBondContact OG-O 3.25Å
524	I	93.1	Very high	89.7	Confident	36 Å²	36	72.3 Å²	72.3	19%	0.185	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.9	175.1	-50	178.7	0	0	0	107.6	L488 L491 I510 L531 T532 I533	L488-I524 HydrophobicContact CD2-CD1 4.31Å; L491-I524 HydrophobicContact CD1-CB 4.34Å; L491-I524 HydrophobicContact CD1-CG2 3.69Å; I510-I524 HydrophobicContact CD1-CD1 4.09Å; I510-I524 HydrophobicContact CG1-CD1 4.47Å; I524-L531 HydrophobicContact CG2-CD1 3.68Å; I524-L531 HydrophobicContact CG2-CG 4.3Å; I524-T532 CarbonylContact C-O 3.6Å; I524-T532 WeakPolarHBondContact CA-O 3.23Å; I524-I533 HydrophobicContact CG1-CG1 4.32Å; I524-I533 HydrophobicContact CG1-CG2 4.49Å; I524-I533 HydrophobicContact CG2-CG1 4.13Å
525	A	90.9	Very high	90.1	Very high	52 Å²	52	68.4 Å²	68.4	43%	0.43	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141	178.2	0	0	0	0	0	109.9	L531 T532	A525-L531 CarbonylContact O-C 3.53Å; A525-L531 WeakPolarHBondContact O-CA 3.46Å; A525-T532 PolarHBondContact N-O 2.94Å; A525-T532 PolarHBondContact O-N 3.2Å
526	F	90.8	Very high	90.7	Very high	33 Å²	33	69.6 Å²	69.6	15%	0.145	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.3	175.9	-175.8	-107.5	0	0	0	110.1	I485 L491 V495 K528 R530 L531 F599	I485-F526 HydrophobicContact CD1-CD1 4.5Å; I485-F526 HydrophobicContact CD1-CD2 3.75Å; I485-F526 HydrophobicContact CD1-CE1 4.37Å; I485-F526 HydrophobicContact CD1-CE2 3.59Å; I485-F526 HydrophobicContact CD1-CG 4.21Å; I485-F526 HydrophobicContact CD1-CZ 3.93Å; L491-F526 HydrophobicContact CB-CB 4.41Å; L491-F526 HydrophobicContact CD1-CB 4.1Å; L491-F526 HydrophobicContact CD2-CB 4.07Å; L491-F526 HydrophobicContact CG-CB 4.42Å; V495-F526 HydrophobicContact CG1-CE2 3.68Å; V495-F526 HydrophobicContact CG1-CZ 3.5Å; F526-K528 WeakPolarHBondContact CE1-O 3.26Å; F526-K528 WeakPolarHBondContact CZ-O 3.3Å; F526-R530 WeakPolarHBondContact CA-O 3.32Å; F526-R530 WeakPolarHBondContact CD2-O 3.43Å; F526-L531 HydrophobicContact CB-CD1 3.89Å; F526-L531 HydrophobicContact CD2-CB 3.93Å; F526-L531 HydrophobicContact CD2-CD1 3.98Å; F526-L531 HydrophobicContact CG-CD1 4.37Å; F526-F599 HydrophobicContact CE2-CD2 4.15Å; F526-F599 HydrophobicContact CE2-CE2 4.12Å
527	E	88.3	Confident	90.9	Very high	144 Å²	144	67.8 Å²	67.8	67%	0.673	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137	126.6	176.3	-171.1	-179.6	179.5	0	0	110.2	N529 R530	E527-N529 PolarHBondContact O-N 3.43Å; E527-R530 PolarHBondContact N-O 3.07Å; E527-R530 PolarHBondContact O-N 2.93Å
528	K	84.3	Confident	91	Very high	182 Å²	182	69.9 Å²	69.9	79%	0.791	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	-97	-175.9	-62.6	172.9	-178.8	177.1	0	112.1	F526	F526-K528 WeakPolarHBondContact CE1-O 3.26Å; F526-K528 WeakPolarHBondContact CZ-O 3.3Å
529	N	88.9	Confident	91.4	Very high	32 Å²	32	62.9 Å²	62.9	17%	0.171	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	20.3	179.8	67.5	-25.7	0	0	0	112	E527 V598 F599	E527-N529 PolarHBondContact O-N 3.43Å; N529-V598 WeakPolarHBondContact O-CA 3.16Å; N529-F599 HydrophobicContact CB-CB 4.38Å; N529-F599 PolarHBondContact ND2-O 3.28Å; N529-F599 WeakPolarHBondContact O-CD2 3.45Å; N529-F599 PolarHBondContact O-N 2.95Å
530	R	92.7	Very high	91.7	Very high	115 Å²	115	57 Å²	57	43%	0.434	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.6	-177.2	-62	-175.3	175.5	-103.7	-5.8	110.3	F526 E527 V596 I597 V598	F526-R530 WeakPolarHBondContact CA-O 3.32Å; F526-R530 WeakPolarHBondContact CD2-O 3.43Å; E527-R530 PolarHBondContact N-O 3.07Å; E527-R530 PolarHBondContact O-N 2.93Å; R530-V596 HydrophobicContact CB-CG1 4.26Å; R530-I597 CarbonylContact C-O 3.58Å; R530-I597 WeakPolarHBondContact CA-O 3.08Å; R530-V598 HydrophobicContact CG-CG1 4.29Å; R530-V598 HydrophobicContact CG-CG2 4.19Å; R530-V598 VanDerWaalsContact NH1-CG2 3.31Å
531	L	93.6	Very high	91.6	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.2	168.8	-174.5	74	0	0	0	109	I485 L491 L506 I524 A525 F526 V596 I597 F599	I485-L531 HydrophobicContact CG2-CD1 4.24Å; L491-L531 HydrophobicContact CD1-CD1 3.98Å; L506-L531 HydrophobicContact CD2-CD2 3.33Å; I524-L531 HydrophobicContact CG2-CD1 3.68Å; I524-L531 HydrophobicContact CG2-CG 4.3Å; A525-L531 CarbonylContact O-C 3.53Å; A525-L531 WeakPolarHBondContact O-CA 3.46Å; F526-L531 HydrophobicContact CB-CD1 3.89Å; F526-L531 HydrophobicContact CD2-CB 3.93Å; F526-L531 HydrophobicContact CD2-CD1 3.98Å; F526-L531 HydrophobicContact CG-CD1 4.37Å; L531-V596 CarbonylContact O-C 3.58Å; L531-V596 WeakPolarHBondContact O-CA 3.48Å; L531-I597 HydrophobicContact CB-CB 4.37Å; L531-I597 HydrophobicContact CD2-CD1 4.27Å; L531-I597 PolarHBondContact N-O 3.43Å; L531-I597 PolarHBondContact O-N 2.87Å; L531-F599 HydrophobicContact CB-CE2 3.81Å; L531-F599 HydrophobicContact CB-CZ 4.48Å
532	T	94.6	Very high	91.5	Very high	31 Å²	31	58.7 Å²	58.7	19%	0.19	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.5	-178.3	-55.9	0	0	0	0	109	I524 A525 E594 V596	I524-T532 CarbonylContact C-O 3.6Å; I524-T532 WeakPolarHBondContact CA-O 3.23Å; A525-T532 PolarHBondContact N-O 2.94Å; A525-T532 PolarHBondContact O-N 3.2Å; T532-E594 HydrophobicContact CG2-CG 3.61Å; T532-E594 WeakPolarHBondContact CG2-OE2 3.32Å; T532-V596 HydrophobicContact CG2-CG2 4.08Å
533	I	95	Very high	91.3	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	112.8	173.7	-59.2	163.7	0	0	0	106.8	L506 I509 I510 I522 I524 V595	L506-I533 HydrophobicContact CD2-CD1 3.96Å; I509-I533 HydrophobicContact CB-CD1 4.03Å; I509-I533 HydrophobicContact CG2-CB 3.89Å; I509-I533 HydrophobicContact CG2-CD1 3.55Å; I509-I533 HydrophobicContact CG2-CG1 4.32Å; I509-I533 HydrophobicContact CG2-CG2 3.93Å; I510-I533 HydrophobicContact CG1-CD1 4.16Å; I522-I533 HydrophobicContact CG2-CG2 4.16Å; I524-I533 HydrophobicContact CG1-CG1 4.32Å; I524-I533 HydrophobicContact CG1-CG2 4.49Å; I524-I533 HydrophobicContact CG2-CG1 4.13Å; I533-V595 PolarHBondContact N-O 2.98Å; I533-V595 PolarHBondContact O-N 2.97Å
534	R	95.8	Very high	91.1	Very high	131 Å²	131	59.5 Å²	59.5	49%	0.494	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.9	-178.8	-177.3	-172.9	-68.4	174.7	-5.2	110.2	I522 S523 T593 E594	I522-R534 CarbonylContact C-O 3.55Å; I522-R534 WeakPolarHBondContact CA-O 3.48Å; S523-R534 PolarHBondContact N-O 2.77Å; S523-R534 PolarHBondContact O-N 3.27Å; S523-R534 PolarHBondContact OG-O 3.25Å; R534-T593 CarbonylContact C-O 3.51Å; R534-T593 WeakPolarHBondContact CA-O 3.34Å; R534-E594 HydrophobicContact CB-CB 4.44Å; R534-E594 HydrophobicContact CG-CB 4.34Å; R534-E594 IonicContact CZ-OE2 2.74Å; R534-E594 IonicContact NE-OE2 3.95Å; R534-E594 PolarHBondContact NE-OE2 3.11Å; R534-E594 IonicContact NH2-OE1 2.8Å; R534-E594 IonicContact NH2-OE2 3.35Å; R534-E594 PolarHBondContact NH2-OE2 2.9Å
535	D	95.3	Very high	90.9	Very high	11 Å²	11	59.5 Å²	59.5	6%	0.059	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	163.9	169.5	76.8	-110.6	0	0	0	111.4	A513 T517 I522 G537 G592 T593	A513-D535 HydrophobicContact CB-CB 3.83Å; T517-D535 WeakPolarHBondContact OG1-CB 3.34Å; I522-D535 HydrophobicContact CG1-CB 4.24Å; D535-G537 WeakPolarHBondContact OD2-CA 3.48Å; D535-G537 PolarHBondContact OD2-N 2.84Å; D535-G592 WeakPolarHBondContact O-CA 3.28Å; D535-G592 WeakPolarHBondContact OD2-CA 3.45Å; D535-T593 PolarHBondContact N-O 3.23Å; D535-T593 PolarHBondContact O-N 3.4Å; D535-T593 VanDerWaalsContact OD1-CB 3.27Å; D535-T593 WeakPolarHBondContact OD1-CB 3.24Å; D535-T593 PolarHBondContact OD2-N 3.28Å; D535-T593 VanDerWaalsContact OD2-N 3.16Å
536	T	94.6	Very high	90.8	Very high	61 Å²	61	62 Å²	62	37%	0.374	31%	0.308	S	S	.	.			trans	-112.9	22.4	177.5	47.2	0	0	0	0	111.4	G520 T521	G520-T536 WeakPolarHBondContact CA-OG1 3.49Å; T521-T536 PolarHBondContact N-OG1 3.35Å; T521-T536 PolarHBondContact O-N 3.06Å; T521-T536 PolarHBondContact O-OG1 3.26Å
537	G	90	Very high	90.8	Very high	9 Å²	9	65.4 Å²	65.4	9%	0.093	32%	0.32	C	S	.	.	S	Bend	trans	-72.8	-159.6	-176.2	0	0	0	0	0	113.5	Y516 T517 D535 G539 G592	Y516-G537 WeakPolarHBondContact O-CA 3.3Å; T517-G537 WeakPolarHBondContact OG1-CA 3.32Å; T517-G537 PolarHBondContact OG1-N 3.02Å; D535-G537 WeakPolarHBondContact OD2-CA 3.48Å; D535-G537 PolarHBondContact OD2-N 2.84Å; G537-G539 PolarHBondContact O-N 2.99Å; G537-G539 VanDerWaalsContact O-N 3.11Å; G537-G592 VanDerWaalsContact O-CA 3.31Å; G537-G592 WeakPolarHBondContact O-CA 3.36Å; G537-G592 PolarHBondContact O-N 3.42Å
538	M	89.8	Confident	90.8	Very high	61 Å²	61	59.2 Å²	59.2	30%	0.3	29%	0.292	S	S	.	.	S	Bend	trans	-65.1	-19.6	-173.6	72.3	-169.3	-44.4	0	0	114.4	Y516 N557 V589 K590	Y516-M538 HydrophobicContact CD1-SD 3.83Å; Y516-M538 PolarHBondContact O-N 3.42Å; Y516-M538 VanDerWaalsContact O-N 3.09Å; M538-N557 HydrophobicContact CE-CB 4.18Å; M538-N557 HydrophobicContact SD-CB 3.9Å; M538-V589 WeakPolarHBondContact O-CA 3.5Å; M538-K590 PolarHBondContact O-N 2.87Å
539	G	90.4	Very high	91.1	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.021	26%	0.264	C	S	.	.			trans	68.6	174.5	-175.1	0	0	0	0	0	113.7	G537 N557 S587	G537-G539 PolarHBondContact O-N 2.99Å; G537-G539 VanDerWaalsContact O-N 3.11Å; G539-N557 PolarHBondContact O-ND2 2.89Å; G539-S587 WeakPolarHBondContact CA-OG 3.48Å
540	I	90.3	Very high	90.9	Very high	29 Å²	29	55.1 Å²	55.1	15%	0.149	27%	0.274	C	S	.	.			trans	-114.7	141.2	-175	-52.7	172.8	0	0	0	108	D544 L545 V548 I585 S587 T593	I540-D544 HydrophobicContact CG2-CB 3.79Å; I540-L545 HydrophobicContact CB-CD2 4.37Å; I540-L545 HydrophobicContact CB-CG 4.36Å; I540-L545 HydrophobicContact CG2-CD2 4.38Å; I540-L545 HydrophobicContact CG2-CG 4.14Å; I540-V548 HydrophobicContact CD1-CG1 4.22Å; I540-V548 HydrophobicContact CG2-CG1 4.01Å; I540-I585 HydrophobicContact CD1-CD1 3.76Å; I540-S587 PolarHBondContact N-OG 3.38Å; I540-T593 HydrophobicContact CD1-CG2 3.96Å
541	R	88.6	Confident	90.4	Very high	103 Å²	103	53.7 Å²	53.7	39%	0.389	27%	0.271	S	S	.	.			trans	-68	146.4	176.3	-67.1	175.6	74.8	139.5	-3.4	109.8	E543 D544 L545 V589	R541-E543 HydrophobicContact CB-CG 4.34Å; R541-E543 IonicContact CZ-OE1 3.28Å; R541-E543 IonicContact NE-OE1 3.91Å; R541-E543 PolarHBondContact NE-OE1 3.38Å; R541-E543 IonicContact NH2-OE1 2.73Å; R541-E543 PolarHBondContact NH2-OE1 3.22Å; R541-E543 PolarHBondContact O-N 3Å; R541-E543 VanDerWaalsContact O-N 3.08Å; R541-D544 PolarHBondContact O-N 2.87Å; R541-L545 PolarHBondContact O-N 3.41Å; R541-L545 VanDerWaalsContact O-N 3.12Å; R541-V589 HydrophobicContact CB-CG2 4.37Å; R541-V589 HydrophobicContact CG-CG2 3.81Å
542	A	89.8	Confident	89.4	Confident	83 Å²	83	55.2 Å²	55.2	69%	0.686	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28	177.9	0	0	0	0	0	113.4	P546	A542-P546 WeakPolarHBondContact O-CD 3.28Å
543	E	88.4	Confident	88.8	Confident	118 Å²	118	55 Å²	55	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-32.4	178.3	-21.7	171.9	-138.4	0	0	112.6	R541	R541-E543 HydrophobicContact CB-CG 4.34Å; R541-E543 IonicContact CZ-OE1 3.28Å; R541-E543 IonicContact NE-OE1 3.91Å; R541-E543 PolarHBondContact NE-OE1 3.38Å; R541-E543 IonicContact NH2-OE1 2.73Å; R541-E543 PolarHBondContact NH2-OE1 3.22Å; R541-E543 PolarHBondContact O-N 3Å; R541-E543 VanDerWaalsContact O-N 3.08Å
544	D	88.4	Confident	87.5	Confident	14 Å²	14	56.7 Å²	56.7	8%	0.075	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-30	-176.3	-66.8	-7.3	0	0	0	110.6	I540 R541 R547 V548 Y553 M556	I540-D544 HydrophobicContact CG2-CB 3.79Å; R541-D544 PolarHBondContact O-N 2.87Å; D544-R547 PolarHBondContact O-N 3.36Å; D544-V548 VanDerWaalsContact O-CG1 3.3Å; D544-V548 WeakPolarHBondContact O-CG1 3.35Å; D544-V548 PolarHBondContact O-N 3.05Å; D544-Y553 WeakPolarHBondContact CA-OH 3.31Å; D544-Y553 HydrophobicContact CB-CE1 4.08Å; D544-Y553 WeakPolarHBondContact CB-OH 3.38Å; D544-Y553 PolarHBondContact OD1-OH 3.13Å; D544-M556 PolarHBondContact OD2-N 3.38Å
545	L	89.5	Confident	86.2	Confident	35 Å²	35	50.9 Å²	50.9	18%	0.183	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-48.6	-46.9	-176.6	-92.2	172.8	0	0	0	114.7	I540 R541 R547 V548 I585	I540-L545 HydrophobicContact CB-CD2 4.37Å; I540-L545 HydrophobicContact CB-CG 4.36Å; I540-L545 HydrophobicContact CG2-CD2 4.38Å; I540-L545 HydrophobicContact CG2-CG 4.14Å; R541-L545 PolarHBondContact O-N 3.41Å; R541-L545 VanDerWaalsContact O-N 3.12Å; L545-R547 PolarHBondContact O-N 3.5Å; L545-R547 VanDerWaalsContact O-N 3.08Å; L545-V548 WeakPolarHBondContact O-CG2 3.32Å; L545-I585 HydrophobicContact CD2-CG1 4.23Å; L545-I585 HydrophobicContact CD2-CG2 4.02Å
546	P	88.9	Confident	84.7	Confident	104 Å²	104	54.3 Å²	54.3	68%	0.675	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-63.6	-16.9	179.9	-23.4	34.6	0	0	0	114.2	A542	A542-P546 WeakPolarHBondContact O-CD 3.28Å
547	R	89.1	Confident	82.9	Confident	106 Å²	106	53 Å²	53	40%	0.4	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-113.8	-3.8	-168.2	-54.5	-173.6	60.6	-161.5	-7.3	113.6	D544 L545 F549 E550 Y553	D544-R547 PolarHBondContact O-N 3.36Å; L545-R547 PolarHBondContact O-N 3.5Å; L545-R547 VanDerWaalsContact O-N 3.08Å; R547-F549 PolarHBondContact O-N 3.05Å; R547-F549 VanDerWaalsContact O-N 3.14Å; R547-E550 HydrophobicContact CB-CG 4.26Å; R547-E550 WeakPolarHBondContact CG-OE1 3.45Å; R547-E550 IonicContact CZ-OE2 2.62Å; R547-E550 IonicContact NE-OE1 2.6Å; R547-E550 PolarHBondContact NE-OE1 2.93Å; R547-E550 IonicContact NE-OE2 3.94Å; R547-E550 PolarHBondContact NE-OE2 2.84Å; R547-E550 IonicContact NH2-OE2 3.62Å; R547-E550 PolarHBondContact NH2-OE2 3.24Å; R547-E550 VanDerWaalsContact O-CB 3.23Å; R547-E550 WeakPolarHBondContact O-CB 3.2Å; R547-E550 PolarHBondContact O-N 3.15Å; R547-Y553 HydrophobicContact CB-CD1 3.87Å; R547-Y553 HydrophobicContact CB-CD2 4.21Å; R547-Y553 HydrophobicContact CB-CE1 3.76Å; R547-Y553 HydrophobicContact CB-CE2 4.14Å; R547-Y553 HydrophobicContact CB-CG 4.07Å; R547-Y553 VanDerWaalsContact CZ-CE2 3.42Å; R547-Y553 WeakPolarHBondContact O-CB 3.27Å; R547-Y553 VanDerWaalsContact O-CD1 3.28Å; R547-Y553 WeakPolarHBondContact O-CD1 3.24Å
548	V	89.2	Confident	81.2	Confident	14 Å²	14	52.7 Å²	52.7	9%	0.085	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21	-175.2	-59.3	0	0	0	0	114.2	I540 D544 L545 L569 I585	I540-V548 HydrophobicContact CD1-CG1 4.22Å; I540-V548 HydrophobicContact CG2-CG1 4.01Å; D544-V548 VanDerWaalsContact O-CG1 3.3Å; D544-V548 WeakPolarHBondContact O-CG1 3.35Å; D544-V548 PolarHBondContact O-N 3.05Å; L545-V548 WeakPolarHBondContact O-CG2 3.32Å; V548-L569 HydrophobicContact CB-CD1 4.03Å; V548-L569 HydrophobicContact CG2-CD1 4.27Å; V548-L569 WeakPolarHBondContact O-CB 3.41Å; V548-I585 HydrophobicContact CG2-CD1 4.15Å; V548-I585 HydrophobicContact CG2-CG2 3.76Å
549	F	89.5	Confident	79.5	Confident	43 Å²	43	57.8 Å²	57.8	19%	0.189	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-1.7	173.3	-62.1	-67.4	0	0	0	113	R547 L569 Y570 Q573 L583 I585	R547-F549 PolarHBondContact O-N 3.05Å; R547-F549 VanDerWaalsContact O-N 3.14Å; F549-L569 HydrophobicContact CD1-CB 3.94Å; F549-L569 WeakPolarHBondContact CD1-O 3.42Å; F549-L569 HydrophobicContact CE1-CB 4.16Å; F549-L569 HydrophobicContact CE1-CD2 4.36Å; F549-Y570 WeakPolarHBondContact O-CD2 3.44Å; F549-Q573 HydrophobicContact CB-CB 4.43Å; F549-Q573 HydrophobicContact CD1-CB 3.83Å; F549-Q573 HydrophobicContact CD1-CG 4.41Å; F549-Q573 HydrophobicContact CE1-CB 4.45Å; F549-Q573 HydrophobicContact CG-CB 4.36Å; F549-L583 HydrophobicContact CE1-CB 4.34Å; F549-L583 HydrophobicContact CE1-CD1 4.27Å; F549-L583 HydrophobicContact CZ-CB 4.12Å; F549-I585 HydrophobicContact CD2-CG2 4.47Å; F549-I585 HydrophobicContact CE2-CB 4.26Å; F549-I585 HydrophobicContact CE2-CG2 3.52Å; F549-I585 HydrophobicContact CZ-CB 4.18Å; F549-I585 HydrophobicContact CZ-CG2 3.92Å
550	E	86.1	Confident	77.6	Confident	84 Å²	84	64.6 Å²	64.6	39%	0.393	33%	0.325	S	S	.	.	S	Bend	trans	-71.8	140.6	173.8	-67.8	175.7	-166.2	0	0	110.7	R547 G552 Y553	R547-E550 HydrophobicContact CB-CG 4.26Å; R547-E550 WeakPolarHBondContact CG-OE1 3.45Å; R547-E550 IonicContact CZ-OE2 2.62Å; R547-E550 IonicContact NE-OE1 2.6Å; R547-E550 PolarHBondContact NE-OE1 2.93Å; R547-E550 IonicContact NE-OE2 3.94Å; R547-E550 PolarHBondContact NE-OE2 2.84Å; R547-E550 IonicContact NH2-OE2 3.62Å; R547-E550 PolarHBondContact NH2-OE2 3.24Å; R547-E550 VanDerWaalsContact O-CB 3.23Å; R547-E550 WeakPolarHBondContact O-CB 3.2Å; R547-E550 PolarHBondContact O-N 3.15Å; E550-G552 PolarHBondContact O-N 3.38Å; E550-Y553 WeakPolarHBondContact O-CB 3.37Å; E550-Y553 PolarHBondContact O-N 3.14Å
551	K	80.8	Confident	75.9	Confident	85 Å²	85	65.9 Å²	65.9	37%	0.37	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	122.5	178.7	-178.9	176.8	169.4	169	0	111.3	D422 Y553 L567 Y570	D422-K551 WeakPolarHBondContact OD1-CE 3.42Å; D422-K551 IonicContact OD1-NZ 2.65Å; D422-K551 PolarHBondContact OD1-NZ 3.3Å; D422-K551 IonicContact OD2-NZ 3.05Å; D422-K551 PolarHBondContact OD2-NZ 3.26Å; K551-Y553 PolarHBondContact O-N 3.28Å; K551-L567 HydrophobicContact CG-CD2 4.06Å; K551-Y570 HydrophobicContact CB-CD1 4.22Å; K551-Y570 HydrophobicContact CB-CD2 4.01Å; K551-Y570 HydrophobicContact CB-CE1 4.25Å; K551-Y570 HydrophobicContact CB-CE2 4.03Å; K551-Y570 HydrophobicContact CB-CG 4.1Å; K551-Y570 HydrophobicContact CD-CE1 4.23Å; K551-Y570 HydrophobicContact CG-CD1 4.26Å; K551-Y570 HydrophobicContact CG-CE1 4.14Å
552	G	73.8	Confident	74.1	Confident	33 Å²	33	69.2 Å²	69.2	34%	0.34	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	7	175.3	0	0	0	0	0	114.5	E550 G566	E550-G552 PolarHBondContact O-N 3.38Å; G552-G566 PolarHBondContact N-O 2.85Å
553	Y	80.5	Confident	72.6	Confident	28 Å²	28	70.7 Å²	70.7	11%	0.11	34%	0.339	C	S	.	.			trans	-83.1	121.3	179.9	-175	-95.8	0	0	0	111.6	D544 R547 E550 K551 G566	D544-Y553 WeakPolarHBondContact CA-OH 3.31Å; D544-Y553 HydrophobicContact CB-CE1 4.08Å; D544-Y553 WeakPolarHBondContact CB-OH 3.38Å; D544-Y553 PolarHBondContact OD1-OH 3.13Å; R547-Y553 HydrophobicContact CB-CD1 3.87Å; R547-Y553 HydrophobicContact CB-CD2 4.21Å; R547-Y553 HydrophobicContact CB-CE1 3.76Å; R547-Y553 HydrophobicContact CB-CE2 4.14Å; R547-Y553 HydrophobicContact CB-CG 4.07Å; R547-Y553 VanDerWaalsContact CZ-CE2 3.42Å; R547-Y553 WeakPolarHBondContact O-CB 3.27Å; R547-Y553 VanDerWaalsContact O-CD1 3.28Å; R547-Y553 WeakPolarHBondContact O-CD1 3.24Å; E550-Y553 WeakPolarHBondContact O-CB 3.37Å; E550-Y553 PolarHBondContact O-N 3.14Å; K551-Y553 PolarHBondContact O-N 3.28Å; Y553-G566 WeakPolarHBondContact O-CA 3.49Å
554	T	68.7	Low	71.4	Confident	37 Å²	37	66 Å²	66	23%	0.227	32%	0.321	C	S	.	.			trans	-109.6	-3.3	-173.1	50.8	0	0	0	0	114.6	G558 A564	T554-G558 WeakPolarHBondContact O-CA 3.48Å; T554-G558 PolarHBondContact O-N 3.28Å; T554-G558 VanDerWaalsContact O-N 3.11Å; T554-A564 HydrophobicContact CG2-CB 4Å; T554-A564 WeakPolarHBondContact CG2-O 3.27Å
555	G	69	Low	70.4	Confident	9 Å²	9	66.3 Å²	66.3	9%	0.093	32%	0.324	C	S	.	.	H	α-helix	trans	56.4	-177.4	-173.1	0	0	0	0	0	113.5	R559	G555-R559 VanDerWaalsContact O-CG 3.32Å; G555-R559 WeakPolarHBondContact O-CG 3.43Å; G555-R559 PolarHBondContact O-N 3.14Å
556	M	63.7	Low	69.6	Low	83 Å²	83	65.3 Å²	65.3	41%	0.409	32%	0.321	S	S	.	.	H	α-helix	trans	-67.2	-44.7	174.5	-85.4	-86	-72.4	0	0	111.7	D544 G558 R559 E560	D544-M556 PolarHBondContact OD2-N 3.38Å; M556-G558 VanDerWaalsContact C-N 3.28Å; M556-G558 PolarHBondContact O-N 3.11Å; M556-R559 PolarHBondContact O-N 3.21Å; M556-E560 PolarHBondContact O-N 2.79Å
557	N	57	Low	69	Low	32 Å²	32	60.4 Å²	60.4	17%	0.171	29%	0.29	C	S	.	.	H	α-helix	trans	-58.3	-39.7	-177.9	-65.1	-14.2	0	0	0	112.1	M538 G539 Q561	M538-N557 HydrophobicContact CE-CB 4.18Å; M538-N557 HydrophobicContact SD-CB 3.9Å; G539-N557 PolarHBondContact O-ND2 2.89Å; N557-Q561 PolarHBondContact O-N 2.86Å
558	G	53.1	Low	68.6	Low	3 Å²	3	55.6 Å²	55.6	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-71.2	-33.1	177.5	0	0	0	0	0	113.5	T554 M556 Q562 R563	T554-G558 WeakPolarHBondContact O-CA 3.48Å; T554-G558 PolarHBondContact O-N 3.28Å; T554-G558 VanDerWaalsContact O-N 3.11Å; M556-G558 VanDerWaalsContact C-N 3.28Å; M556-G558 PolarHBondContact O-N 3.11Å; G558-Q562 WeakPolarHBondContact O-CA 3.16Å; G558-Q562 PolarHBondContact O-N 2.94Å; G558-R563 PolarHBondContact O-N 2.67Å
559	R	54.4	Low	68.6	Low	169 Å²	169	56.2 Å²	56.2	64%	0.638	28%	0.276	S	S	*	.	H	α-helix	trans	-72	-46.7	176.5	-70	176.5	-167.5	-158.9	3.1	112.2	G555 M556 Q561 Q562	G555-R559 VanDerWaalsContact O-CG 3.32Å; G555-R559 WeakPolarHBondContact O-CG 3.43Å; G555-R559 PolarHBondContact O-N 3.14Å; M556-R559 PolarHBondContact O-N 3.21Å; R559-Q561 VanDerWaalsContact C-N 3.31Å; R559-Q561 PolarHBondContact O-N 3.29Å; R559-Q562 PolarHBondContact O-N 3.4Å
560	E	51.2	Low	68.4	Low	144 Å²	144	56.3 Å²	56.3	67%	0.673	28%	0.275	S	S	*	.	H	α-helix	trans	-62.8	-39.4	179.9	-78.2	-173.3	172.7	0	0	111.7	M556	M556-E560 PolarHBondContact O-N 2.79Å
561	Q	53.4	Low	68.3	Low	57 Å²	57	52.4 Å²	52.4	27%	0.266	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-7.1	179	-62.1	-163.6	1.2	0	0	114.1	N557 R559 R563	N557-Q561 PolarHBondContact O-N 2.86Å; R559-Q561 VanDerWaalsContact C-N 3.31Å; R559-Q561 PolarHBondContact O-N 3.29Å; Q561-R563 HydrophobicContact CB-CB 4.08Å; Q561-R563 HydrophobicContact CB-CG 4.17Å; Q561-R563 WeakPolarHBondContact O-CG 3.4Å; Q561-R563 PolarHBondContact O-N 3.08Å; Q561-R563 VanDerWaalsContact OE1-NH1 3.12Å
562	Q	51.9	Low	68.7	Low	172 Å²	172	48.3 Å²	48.3	80%	0.804	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	28	-170.8	-62	-176.5	6.8	0	0	114	G558 R559	G558-Q562 WeakPolarHBondContact O-CA 3.16Å; G558-Q562 PolarHBondContact O-N 2.94Å; R559-Q562 PolarHBondContact O-N 3.4Å
563	R	58.5	Low	69.5	Low	114 Å²	114	48.4 Å²	48.4	43%	0.43	23%	0.231	S	C	.	.			trans	-105.4	-16.6	-170.1	-85.6	175.3	-168.1	172.3	-2.5	113.3	K515 G558 Q561	K515-R563 VanDerWaalsContact CE-O 3.28Å; K515-R563 WeakPolarHBondContact CE-O 3.47Å; K515-R563 PolarHBondContact NZ-O 3.23Å; G558-R563 PolarHBondContact O-N 2.67Å; Q561-R563 HydrophobicContact CB-CB 4.08Å; Q561-R563 HydrophobicContact CB-CG 4.17Å; Q561-R563 WeakPolarHBondContact O-CG 3.4Å; Q561-R563 PolarHBondContact O-N 3.08Å; Q561-R563 VanDerWaalsContact OE1-NH1 3.12Å
564	A	62.3	Low	69.8	Low	21 Å²	21	50.6 Å²	50.6	17%	0.174	24%	0.242	C	C	.	.			trans	-105	136.7	-172.4	0	0	0	0	0	111.8	Y516 T554	Y516-A564 WeakPolarHBondContact OH-CB 3.21Å; T554-A564 HydrophobicContact CG2-CB 4Å; T554-A564 WeakPolarHBondContact CG2-O 3.27Å
565	S	66.8	Low	70.5	Confident	20 Å²	20	48.8 Å²	48.8	14%	0.14	23%	0.231	C	C	.	.			trans	-87.8	-21.8	173.2	63.9	0	0	0	0	113.6	M464 L567	M464-S565 WeakPolarHBondContact CE-OG 3.32Å; S565-L567 PolarHBondContact O-N 3.43Å; S565-L567 PolarHBondContact OG-N 2.86Å
566	G	72.9	Confident	71.5	Confident	13 Å²	13	48.4 Å²	48.4	13%	0.134	23%	0.227	C	C	.	.	S	Bend	trans	70.8	12.7	-173.7	0	0	0	0	0	114	G552 Y553	G552-G566 PolarHBondContact N-O 2.85Å; Y553-G566 WeakPolarHBondContact O-CA 3.49Å
567	L	77.3	Confident	72.7	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	23%	0.23	C	C	.	.			trans	-106.7	-24.2	-177.7	-74	165.8	0	0	0	112.5	L425 W426 M464 K551 S565 Y570 L571	L425-L567 HydrophobicContact CD2-CD1 4Å; L425-L567 HydrophobicContact CD2-CD2 4.34Å; L425-L567 HydrophobicContact CD2-CG 4.49Å; L425-L567 HydrophobicContact CG-CD1 4.43Å; W426-L567 HydrophobicContact CD2-CD1 4.24Å; W426-L567 HydrophobicContact CE3-CD1 4.11Å; W426-L567 HydrophobicContact CH2-CB 3.72Å; W426-L567 HydrophobicContact CH2-CD1 3.45Å; W426-L567 VanDerWaalsContact CH2-CD1 3.45Å; W426-L567 HydrophobicContact CH2-CG 4.1Å; W426-L567 HydrophobicContact CZ2-CB 4.23Å; W426-L567 HydrophobicContact CZ2-CD1 3.65Å; W426-L567 HydrophobicContact CZ2-CD2 4.31Å; W426-L567 HydrophobicContact CZ2-CG 4.28Å; W426-L567 HydrophobicContact CZ3-CB 4.46Å; W426-L567 HydrophobicContact CZ3-CD1 3.72Å; M464-L567 HydrophobicContact CE-CB 3.22Å; K551-L567 HydrophobicContact CG-CD2 4.06Å; S565-L567 PolarHBondContact O-N 3.43Å; S565-L567 PolarHBondContact OG-N 2.86Å; L567-Y570 HydrophobicContact CD2-CD1 4.31Å; L567-Y570 PolarHBondContact O-N 2.88Å; L567-L571 WeakPolarHBondContact O-CB 3.38Å; L567-L571 VanDerWaalsContact O-CG 3.27Å; L567-L571 WeakPolarHBondContact O-CG 3.36Å; L567-L571 PolarHBondContact O-N 2.97Å
568	G	81.5	Confident	73.8	Confident	6 Å²	6	51.3 Å²	51.3	6%	0.062	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-59	-175.2	0	0	0	0	0	112.8	Q508 Y570 L571 S572	Q508-G568 VanDerWaalsContact OE1-CA 3.23Å; G568-Y570 VanDerWaalsContact C-N 3.34Å; G568-Y570 PolarHBondContact O-N 3.28Å; G568-L571 PolarHBondContact O-N 3.4Å; G568-S572 PolarHBondContact O-N 2.71Å; G568-S572 PolarHBondContact O-OG 2.82Å; G568-S572 VanDerWaalsContact O-OG 3.13Å
569	L	88.7	Confident	75.4	Confident	26 Å²	26	51.3 Å²	51.3	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-37.9	178.8	-70.9	178	0	0	0	112.6	V548 F549 S572 Q573 I585	V548-L569 HydrophobicContact CB-CD1 4.03Å; V548-L569 HydrophobicContact CG2-CD1 4.27Å; V548-L569 WeakPolarHBondContact O-CB 3.41Å; F549-L569 HydrophobicContact CD1-CB 3.94Å; F549-L569 WeakPolarHBondContact CD1-O 3.42Å; F549-L569 HydrophobicContact CE1-CB 4.16Å; F549-L569 HydrophobicContact CE1-CD2 4.36Å; L569-S572 WeakPolarHBondContact O-CB 3.36Å; L569-S572 PolarHBondContact O-N 3.21Å; L569-Q573 PolarHBondContact O-N 2.91Å; L569-I585 HydrophobicContact CD1-CD1 4.3Å
570	Y	85.7	Confident	76.9	Confident	46 Å²	46	45.6 Å²	45.6	18%	0.18	23%	0.233	C	C	.	.	H	α-helix	trans	-56.5	-51	173.2	167	-106.6	0	0	0	111.7	F549 K551 L567 G568 S572 Q573 Q574	F549-Y570 WeakPolarHBondContact O-CD2 3.44Å; K551-Y570 HydrophobicContact CB-CD1 4.22Å; K551-Y570 HydrophobicContact CB-CD2 4.01Å; K551-Y570 HydrophobicContact CB-CE1 4.25Å; K551-Y570 HydrophobicContact CB-CE2 4.03Å; K551-Y570 HydrophobicContact CB-CG 4.1Å; K551-Y570 HydrophobicContact CD-CE1 4.23Å; K551-Y570 HydrophobicContact CG-CD1 4.26Å; K551-Y570 HydrophobicContact CG-CE1 4.14Å; L567-Y570 HydrophobicContact CD2-CD1 4.31Å; L567-Y570 PolarHBondContact O-N 2.88Å; G568-Y570 VanDerWaalsContact C-N 3.34Å; G568-Y570 PolarHBondContact O-N 3.28Å; Y570-S572 VanDerWaalsContact C-N 3.33Å; Y570-S572 PolarHBondContact O-N 3.16Å; Y570-Q573 WeakPolarHBondContact O-CB 3.15Å; Y570-Q573 PolarHBondContact O-N 2.85Å; Y570-Q574 HydrophobicContact CD2-CG 4.46Å; Y570-Q574 HydrophobicContact CE1-CG 4.38Å; Y570-Q574 HydrophobicContact CE2-CG 4.01Å; Y570-Q574 WeakPolarHBondContact O-CG 3.32Å; Y570-Q574 PolarHBondContact O-N 2.94Å; Y570-Q574 PolarHBondContact OH-NE2 2.83Å
571	L	83.7	Confident	78.8	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-35.6	177.8	-69.1	177.5	0	0	0	112.2	W426 M464 Y468 F504 L567 G568 Q573 Q574 A575	W426-L571 HydrophobicContact CH2-CD1 3.86Å; W426-L571 HydrophobicContact CZ2-CD1 3.9Å; M464-L571 HydrophobicContact CB-CD1 4Å; M464-L571 HydrophobicContact CE-CD1 4.32Å; M464-L571 HydrophobicContact CG-CD1 4.44Å; Y468-L571 HydrophobicContact CD2-CD2 3.89Å; F504-L571 HydrophobicContact CE1-CB 3.89Å; F504-L571 HydrophobicContact CZ-CB 3.67Å; F504-L571 HydrophobicContact CZ-CD1 4.18Å; L567-L571 WeakPolarHBondContact O-CB 3.38Å; L567-L571 VanDerWaalsContact O-CG 3.27Å; L567-L571 WeakPolarHBondContact O-CG 3.36Å; L567-L571 PolarHBondContact O-N 2.97Å; G568-L571 PolarHBondContact O-N 3.4Å; L571-Q573 VanDerWaalsContact C-N 3.32Å; L571-Q574 PolarHBondContact O-N 2.89Å; L571-A575 WeakPolarHBondContact O-CB 3.32Å; L571-A575 PolarHBondContact O-N 3.11Å
572	S	89	Confident	80.7	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-40.6	173.1	-65.2	0	0	0	0	111.7	Q508 G568 L569 Y570 A575 A576 L583	Q508-S572 VanDerWaalsContact CB-OG 3.31Å; Q508-S572 WeakPolarHBondContact CB-OG 3.47Å; G568-S572 PolarHBondContact O-N 2.71Å; G568-S572 PolarHBondContact O-OG 2.82Å; G568-S572 VanDerWaalsContact O-OG 3.13Å; L569-S572 WeakPolarHBondContact O-CB 3.36Å; L569-S572 PolarHBondContact O-N 3.21Å; Y570-S572 VanDerWaalsContact C-N 3.33Å; Y570-S572 PolarHBondContact O-N 3.16Å; S572-A575 PolarHBondContact O-N 2.85Å; S572-A576 VanDerWaalsContact O-CB 3.28Å; S572-A576 WeakPolarHBondContact O-CB 3.33Å; S572-A576 PolarHBondContact O-N 3.12Å; S572-L583 WeakPolarHBondContact O-CD1 3.14Å
573	Q	90.5	Very high	82.7	Confident	35 Å²	35	33.4 Å²	33.4	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-43.8	175.5	-175.5	64.2	64.1	0	0	111.8	F549 L569 Y570 L571 A576 N577	F549-Q573 HydrophobicContact CB-CB 4.43Å; F549-Q573 HydrophobicContact CD1-CB 3.83Å; F549-Q573 HydrophobicContact CD1-CG 4.41Å; F549-Q573 HydrophobicContact CE1-CB 4.45Å; F549-Q573 HydrophobicContact CG-CB 4.36Å; L569-Q573 PolarHBondContact O-N 2.91Å; Y570-Q573 WeakPolarHBondContact O-CB 3.15Å; Y570-Q573 PolarHBondContact O-N 2.85Å; L571-Q573 VanDerWaalsContact C-N 3.32Å; Q573-A576 PolarHBondContact O-N 2.97Å; Q573-N577 PolarHBondContact NE2-OD1 2.89Å; Q573-N577 WeakPolarHBondContact O-CB 3.34Å; Q573-N577 PolarHBondContact O-N 2.83Å; Q573-N577 PolarHBondContact O-ND2 2.83Å; Q573-N577 PolarHBondContact O-OD1 2.8Å
574	Q	85.6	Confident	84.4	Confident	73 Å²	73	33.2 Å²	33.2	34%	0.341	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-43.5	177.3	-64.9	-71.8	47.6	0	0	111.8	Y570 L571 N577 K578	Y570-Q574 HydrophobicContact CD2-CG 4.46Å; Y570-Q574 HydrophobicContact CE1-CG 4.38Å; Y570-Q574 HydrophobicContact CE2-CG 4.01Å; Y570-Q574 WeakPolarHBondContact O-CG 3.32Å; Y570-Q574 PolarHBondContact O-N 2.94Å; Y570-Q574 PolarHBondContact OH-NE2 2.83Å; L571-Q574 PolarHBondContact O-N 2.89Å; Q574-N577 PolarHBondContact O-N 3.09Å; Q574-K578 PolarHBondContact O-N 2.93Å; Q574-K578 VanDerWaalsContact O-N 3.15Å
575	A	84.9	Confident	86	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-46.2	174	0	0	0	0	0	111.7	W501 F504 I505 L571 S572 N577 K578 L579	W501-A575 HydrophobicContact CE3-CB 3.64Å; W501-A575 HydrophobicContact CZ3-CB 3.99Å; F504-A575 HydrophobicContact CD1-CB 4.15Å; F504-A575 HydrophobicContact CE1-CB 4.34Å; I505-A575 HydrophobicContact CD1-CB 3.8Å; I505-A575 HydrophobicContact CG1-CB 3.73Å; L571-A575 WeakPolarHBondContact O-CB 3.32Å; L571-A575 PolarHBondContact O-N 3.11Å; S572-A575 PolarHBondContact O-N 2.85Å; A575-N577 VanDerWaalsContact C-N 3.35Å; A575-N577 PolarHBondContact O-N 2.76Å; A575-K578 PolarHBondContact O-N 2.74Å; A575-L579 WeakPolarHBondContact O-CG 3.37Å; A575-L579 PolarHBondContact O-N 3.25Å; A575-L579 VanDerWaalsContact O-N 3.09Å
576	A	89.9	Confident	87.4	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-44.3	178.6	0	0	0	0	0	111.6	I505 S572 Q573 K578 L579 G580 C581 L583	I505-A576 HydrophobicContact CD1-CB 4.08Å; S572-A576 VanDerWaalsContact O-CB 3.28Å; S572-A576 WeakPolarHBondContact O-CB 3.33Å; S572-A576 PolarHBondContact O-N 3.12Å; Q573-A576 PolarHBondContact O-N 2.97Å; A576-K578 VanDerWaalsContact C-N 3.32Å; A576-K578 PolarHBondContact O-N 3.08Å; A576-L579 CarbonylContact O-C 3.6Å; A576-L579 WeakPolarHBondContact O-CA 3.45Å; A576-L579 PolarHBondContact O-N 2.93Å; A576-G580 PolarHBondContact O-N 2.65Å; A576-G580 VanDerWaalsContact O-N 3.14Å; A576-C581 CarbonylContact C-O 3.59Å; A576-C581 HydrophobicContact CB-CB 4.15Å; A576-C581 PolarHBondContact O-N 2.87Å; A576-L583 HydrophobicContact CB-CD1 3.8Å; A576-L583 HydrophobicContact CB-CD2 4.36Å; A576-L583 HydrophobicContact CB-CG 3.64Å
577	N	87.7	Confident	88.5	Confident	90 Å²	90	39.5 Å²	39.5	48%	0.481	20%	0.2	S	C	.	.	H	α-helix	trans	-58.4	-43	176.5	-69.2	-15	0	0	0	111.8	Q573 Q574 A575 L579 G580	Q573-N577 PolarHBondContact NE2-OD1 2.89Å; Q573-N577 WeakPolarHBondContact O-CB 3.34Å; Q573-N577 PolarHBondContact O-N 2.83Å; Q573-N577 PolarHBondContact O-ND2 2.83Å; Q573-N577 PolarHBondContact O-OD1 2.8Å; Q574-N577 PolarHBondContact O-N 3.09Å; A575-N577 VanDerWaalsContact C-N 3.35Å; A575-N577 PolarHBondContact O-N 2.76Å; N577-L579 VanDerWaalsContact C-N 3.28Å; N577-L579 PolarHBondContact O-N 3.47Å; N577-G580 PolarHBondContact O-N 2.81Å; N577-G580 VanDerWaalsContact O-N 3.13Å
578	K	82	Confident	89.2	Confident	87 Å²	87	44.6 Å²	44.6	38%	0.378	22%	0.224	S	C	.	.	H	α-helix	trans	-63.7	-32.4	175.4	-75.5	-166.9	177.9	-162.1	0	113.1	Q471 W501 Q574 A575 A576 G580	Q471-K578 PolarHBondContact O-NZ 3.04Å; W501-K578 HydrophobicContact CH2-CD 3.84Å; W501-K578 HydrophobicContact CZ3-CD 4.16Å; Q574-K578 PolarHBondContact O-N 2.93Å; Q574-K578 VanDerWaalsContact O-N 3.15Å; A575-K578 PolarHBondContact O-N 2.74Å; A576-K578 VanDerWaalsContact C-N 3.32Å; A576-K578 PolarHBondContact O-N 3.08Å; K578-G580 VanDerWaalsContact C-N 3.26Å; K578-G580 PolarHBondContact O-N 2.83Å
579	L	85.6	Confident	89.7	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.016	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	0.4	176.8	-63.2	175.8	0	0	0	113.4	L478 F480 D498 W501 I505 A575 A576 N577 C581	L478-L579 HydrophobicContact CD2-CD2 4.43Å; F480-L579 HydrophobicContact CE1-CD2 4.08Å; F480-L579 HydrophobicContact CZ-CD2 4.31Å; D498-L579 HydrophobicContact CB-CD2 3.77Å; W501-L579 HydrophobicContact CB-CD1 3.81Å; W501-L579 HydrophobicContact CB-CD2 4Å; W501-L579 HydrophobicContact CB-CG 4.2Å; I505-L579 HydrophobicContact CD1-CD1 3.77Å; A575-L579 WeakPolarHBondContact O-CG 3.37Å; A575-L579 PolarHBondContact O-N 3.25Å; A575-L579 VanDerWaalsContact O-N 3.09Å; A576-L579 CarbonylContact O-C 3.6Å; A576-L579 WeakPolarHBondContact O-CA 3.45Å; A576-L579 PolarHBondContact O-N 2.93Å; N577-L579 VanDerWaalsContact C-N 3.28Å; N577-L579 PolarHBondContact O-N 3.47Å; L579-C581 HydrophobicContact CB-CB 4.44Å; L579-C581 PolarHBondContact O-N 2.86Å
580	G	85.9	Confident	89.7	Confident	49 Å²	49	55.6 Å²	55.6	51%	0.505	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	16.8	-171.8	0	0	0	0	0	113.7	A576 N577 K578	A576-G580 PolarHBondContact O-N 2.65Å; A576-G580 VanDerWaalsContact O-N 3.14Å; N577-G580 PolarHBondContact O-N 2.81Å; N577-G580 VanDerWaalsContact O-N 3.13Å; K578-G580 VanDerWaalsContact C-N 3.26Å; K578-G580 PolarHBondContact O-N 2.83Å
581	C	90.8	Very high	90	Very high	3 Å²	3	60 Å²	60	2%	0.02	30%	0.295	C	S	.	.			trans	-92.1	149.8	178.9	-61.9	0	0	0	0	110.8	A576 L579 I597 V598	A576-C581 CarbonylContact C-O 3.59Å; A576-C581 HydrophobicContact CB-CB 4.15Å; A576-C581 PolarHBondContact O-N 2.87Å; L579-C581 HydrophobicContact CB-CB 4.44Å; L579-C581 PolarHBondContact O-N 2.86Å; C581-I597 HydrophobicContact CB-CG2 4.25Å; C581-V598 CarbonylContact C-O 3.56Å; C581-V598 VanDerWaalsContact CA-O 3.24Å; C581-V598 WeakPolarHBondContact CA-O 3.48Å
582	Q	92.8	Very high	90.4	Very high	102 Å²	102	60.2 Å²	60.2	48%	0.477	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.1	172.5	-61.8	173.7	-29.7	0	0	110	Y584 I597 V598	Q582-Y584 HydrophobicContact CB-CD2 4.46Å; Q582-Y584 HydrophobicContact CB-CE2 3.71Å; Q582-Y584 PolarHBondContact OE1-OH 2.77Å; Q582-I597 WeakPolarHBondContact O-CA 3.33Å; Q582-V598 HydrophobicContact CB-CB 4.22Å; Q582-V598 PolarHBondContact N-O 2.81Å; Q582-V598 PolarHBondContact O-N 2.97Å
583	L	94.8	Very high	90.8	Very high	12 Å²	12	60.8 Å²	60.8	6%	0.063	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129	171.5	-66.9	-179.6	0	0	0	109.6	I505 I509 F549 S572 A576 V596 I597	I505-L583 HydrophobicContact CG2-CD1 4.49Å; I505-L583 HydrophobicContact CG2-CD2 4.26Å; I509-L583 HydrophobicContact CD1-CD2 4.31Å; F549-L583 HydrophobicContact CE1-CB 4.34Å; F549-L583 HydrophobicContact CE1-CD1 4.27Å; F549-L583 HydrophobicContact CZ-CB 4.12Å; S572-L583 WeakPolarHBondContact O-CD1 3.14Å; A576-L583 HydrophobicContact CB-CD1 3.8Å; A576-L583 HydrophobicContact CB-CD2 4.36Å; A576-L583 HydrophobicContact CB-CG 3.64Å; L583-V596 WeakPolarHBondContact CA-O 3.31Å; L583-I597 HydrophobicContact CD2-CB 4.05Å; L583-I597 HydrophobicContact CD2-CD1 4.31Å; L583-I597 HydrophobicContact CD2-CG1 3.61Å; L583-I597 HydrophobicContact CD2-CG2 3.98Å
584	Y	94.8	Very high	91.1	Very high	109 Å²	109	60.9 Å²	60.9	43%	0.427	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.1	170.4	-61.3	-80.7	0	0	0	109.4	Q582 V595 V596 V598	Q582-Y584 HydrophobicContact CB-CD2 4.46Å; Q582-Y584 HydrophobicContact CB-CE2 3.71Å; Q582-Y584 PolarHBondContact OE1-OH 2.77Å; Y584-V595 CarbonylContact O-C 3.53Å; Y584-V595 VanDerWaalsContact O-CA 3.32Å; Y584-V595 WeakPolarHBondContact O-CA 3.35Å; Y584-V596 PolarHBondContact N-O 2.76Å; Y584-V596 PolarHBondContact O-N 3.23Å; Y584-V598 HydrophobicContact CD2-CG2 3.78Å; Y584-V598 HydrophobicContact CE2-CG2 3.66Å
585	I	95.6	Very high	91.7	Very high	27 Å²	27	57.9 Å²	57.9	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	125.3	176	-169.3	165	0	0	0	109.6	I540 L545 V548 F549 L569 T593 E594 V595	I540-I585 HydrophobicContact CD1-CD1 3.76Å; L545-I585 HydrophobicContact CD2-CG1 4.23Å; L545-I585 HydrophobicContact CD2-CG2 4.02Å; V548-I585 HydrophobicContact CG2-CD1 4.15Å; V548-I585 HydrophobicContact CG2-CG2 3.76Å; F549-I585 HydrophobicContact CD2-CG2 4.47Å; F549-I585 HydrophobicContact CE2-CB 4.26Å; F549-I585 HydrophobicContact CE2-CG2 3.52Å; F549-I585 HydrophobicContact CZ-CB 4.18Å; F549-I585 HydrophobicContact CZ-CG2 3.92Å; L569-I585 HydrophobicContact CD1-CD1 4.3Å; I585-T593 HydrophobicContact CD1-CG2 3.75Å; I585-T593 HydrophobicContact CG1-CG2 3.64Å; I585-E594 CarbonylContact C-O 3.41Å; I585-E594 WeakPolarHBondContact CA-O 3.34Å; I585-V595 HydrophobicContact CD1-CG2 3.98Å; I585-V595 HydrophobicContact CG1-CG2 4.02Å
586	E	95.3	Very high	92.2	Very high	137 Å²	137	58.7 Å²	58.7	64%	0.64	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.4	170.4	-67.7	-168.4	-179.6	0	0	108.3	E594	E586-E594 PolarHBondContact N-O 3.13Å; E586-E594 PolarHBondContact O-N 3.19Å
587	S	96.2	Very high	92.5	Very high	23 Å²	23	58.8 Å²	58.8	16%	0.161	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	147.1	-178.3	-162.3	0	0	0	0	110.8	G539 I540 G592 T593	G539-S587 WeakPolarHBondContact CA-OG 3.48Å; I540-S587 PolarHBondContact N-OG 3.38Å; S587-G592 PolarHBondContact OG-O 3.32Å; S587-T593 PolarHBondContact OG-OG1 2.84Å
588	Q	93.1	Very high	92.8	Very high	107 Å²	107	55 Å²	55	50%	0.5	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.3	171.1	-174.8	171.2	18.5	0	0	109.4	K590 K591 G592	Q588-K590 PolarHBondContact O-N 2.97Å; Q588-K591 HydrophobicContact CB-CB 4.14Å; Q588-K591 HydrophobicContact CB-CD 4.36Å; Q588-K591 HydrophobicContact CB-CG 4.38Å; Q588-K591 HydrophobicContact CG-CD 4.21Å; Q588-K591 HydrophobicContact CG-CG 4.27Å; Q588-K591 PolarHBondContact O-N 2.88Å; Q588-G592 PolarHBondContact N-O 2.81Å; Q588-G592 VanDerWaalsContact N-O 3.13Å; Q588-G592 PolarHBondContact O-N 2.91Å
589	V	91.3	Very high	93.2	Very high	73 Å²	73	51 Å²	51	44%	0.442	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	129	177.8	178.8	0	0	0	0	110.3	M538 R541 K591	M538-V589 WeakPolarHBondContact O-CA 3.5Å; R541-V589 HydrophobicContact CB-CG2 4.37Å; R541-V589 HydrophobicContact CG-CG2 3.81Å; V589-K591 PolarHBondContact O-N 2.84Å
590	K	88.2	Confident	93.3	Very high	190 Å²	190	52.8 Å²	52.8	83%	0.826	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	10.8	-175.7	-60.1	175.8	-179.3	-176.3	0	116.2	M538 Q588	M538-K590 PolarHBondContact O-N 2.87Å; Q588-K590 PolarHBondContact O-N 2.97Å
591	K	92	Very high	92.7	Very high	139 Å²	139	58.9 Å²	58.9	60%	0.604	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-18	170.5	-60.6	-163	-170.9	167.2	0	113.4	Q588 V589	Q588-K591 HydrophobicContact CB-CB 4.14Å; Q588-K591 HydrophobicContact CB-CD 4.36Å; Q588-K591 HydrophobicContact CB-CG 4.38Å; Q588-K591 HydrophobicContact CG-CD 4.21Å; Q588-K591 HydrophobicContact CG-CG 4.27Å; Q588-K591 PolarHBondContact O-N 2.88Å; V589-K591 PolarHBondContact O-N 2.84Å
592	G	93.5	Very high	91.5	Very high	6 Å²	6	67.1 Å²	67.1	6%	0.062	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106	-170.3	180	0	0	0	0	0	113.2	D535 G537 S587 Q588	D535-G592 WeakPolarHBondContact O-CA 3.28Å; D535-G592 WeakPolarHBondContact OD2-CA 3.45Å; G537-G592 VanDerWaalsContact O-CA 3.31Å; G537-G592 WeakPolarHBondContact O-CA 3.36Å; G537-G592 PolarHBondContact O-N 3.42Å; S587-G592 PolarHBondContact OG-O 3.32Å; Q588-G592 PolarHBondContact N-O 2.81Å; Q588-G592 VanDerWaalsContact N-O 3.13Å; Q588-G592 PolarHBondContact O-N 2.91Å
593	T	96.3	Very high	89.9	Confident	12 Å²	12	64.5 Å²	64.5	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.4	-176.6	-49.6	0	0	0	0	110.6	R534 D535 I540 I585 S587 V595	R534-T593 CarbonylContact C-O 3.51Å; R534-T593 WeakPolarHBondContact CA-O 3.34Å; D535-T593 PolarHBondContact N-O 3.23Å; D535-T593 PolarHBondContact O-N 3.4Å; D535-T593 VanDerWaalsContact OD1-CB 3.27Å; D535-T593 WeakPolarHBondContact OD1-CB 3.24Å; D535-T593 PolarHBondContact OD2-N 3.28Å; D535-T593 VanDerWaalsContact OD2-N 3.16Å; I540-T593 HydrophobicContact CD1-CG2 3.96Å; I585-T593 HydrophobicContact CD1-CG2 3.75Å; I585-T593 HydrophobicContact CG1-CG2 3.64Å; S587-T593 PolarHBondContact OG-OG1 2.84Å; T593-V595 HydrophobicContact CG2-CG2 4.25Å
594	E	97.4	Very high	87.9	Confident	36 Å²	36	67.6 Å²	67.6	17%	0.168	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.3	171.3	175.8	165.8	98.5	0	0	109.3	T532 R534 I585 E586 V596	T532-E594 HydrophobicContact CG2-CG 3.61Å; T532-E594 WeakPolarHBondContact CG2-OE2 3.32Å; R534-E594 HydrophobicContact CB-CB 4.44Å; R534-E594 HydrophobicContact CG-CB 4.34Å; R534-E594 IonicContact CZ-OE2 2.74Å; R534-E594 IonicContact NE-OE2 3.95Å; R534-E594 PolarHBondContact NE-OE2 3.11Å; R534-E594 IonicContact NH2-OE1 2.8Å; R534-E594 IonicContact NH2-OE2 3.35Å; R534-E594 PolarHBondContact NH2-OE2 2.9Å; I585-E594 CarbonylContact C-O 3.41Å; I585-E594 WeakPolarHBondContact CA-O 3.34Å; E586-E594 PolarHBondContact N-O 3.13Å; E586-E594 PolarHBondContact O-N 3.19Å; E594-V596 HydrophobicContact CG-CG2 4Å
595	V	97	Very high	85.6	Confident	11 Å²	11	66.4 Å²	66.4	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.8	172.4	-173.6	0	0	0	0	108.6	I509 I533 Y584 I585 T593	I509-V595 HydrophobicContact CD1-CG1 3.66Å; I509-V595 HydrophobicContact CG1-CG1 4.05Å; I509-V595 HydrophobicContact CG2-CB 3.78Å; I509-V595 HydrophobicContact CG2-CG1 4.08Å; I509-V595 HydrophobicContact CG2-CG2 3.96Å; I533-V595 PolarHBondContact N-O 2.98Å; I533-V595 PolarHBondContact O-N 2.97Å; Y584-V595 CarbonylContact O-C 3.53Å; Y584-V595 VanDerWaalsContact O-CA 3.32Å; Y584-V595 WeakPolarHBondContact O-CA 3.35Å; I585-V595 HydrophobicContact CD1-CG2 3.98Å; I585-V595 HydrophobicContact CG1-CG2 4.02Å; T593-V595 HydrophobicContact CG2-CG2 4.25Å
596	V	96.6	Very high	83.1	Confident	17 Å²	17	75.3 Å²	75.3	10%	0.103	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.3	-179.8	-174.4	0	0	0	0	109.5	R530 L531 T532 L583 Y584 E594 V598	R530-V596 HydrophobicContact CB-CG1 4.26Å; L531-V596 CarbonylContact O-C 3.58Å; L531-V596 WeakPolarHBondContact O-CA 3.48Å; T532-V596 HydrophobicContact CG2-CG2 4.08Å; L583-V596 WeakPolarHBondContact CA-O 3.31Å; Y584-V596 PolarHBondContact N-O 2.76Å; Y584-V596 PolarHBondContact O-N 3.23Å; E594-V596 HydrophobicContact CG-CG2 4Å; V596-V598 HydrophobicContact CG1-CG2 4.07Å
597	I	95.3	Very high	80.1	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	117.8	169.1	-41.6	-174.7	0	0	0	107.9	I505 L506 I509 R530 L531 C581 Q582 L583 F599	I505-I597 HydrophobicContact CG2-CD1 3.79Å; L506-I597 HydrophobicContact CD2-CD1 3.74Å; I509-I597 HydrophobicContact CD1-CD1 3.85Å; I509-I597 HydrophobicContact CD1-CG1 4.08Å; R530-I597 CarbonylContact C-O 3.58Å; R530-I597 WeakPolarHBondContact CA-O 3.08Å; L531-I597 HydrophobicContact CB-CB 4.37Å; L531-I597 HydrophobicContact CD2-CD1 4.27Å; L531-I597 PolarHBondContact N-O 3.43Å; L531-I597 PolarHBondContact O-N 2.87Å; C581-I597 HydrophobicContact CB-CG2 4.25Å; Q582-I597 WeakPolarHBondContact O-CA 3.33Å; L583-I597 HydrophobicContact CD2-CB 4.05Å; L583-I597 HydrophobicContact CD2-CD1 4.31Å; L583-I597 HydrophobicContact CD2-CG1 3.61Å; L583-I597 HydrophobicContact CD2-CG2 3.98Å; I597-F599 HydrophobicContact CB-CE2 4.34Å; I597-F599 HydrophobicContact CB-CZ 4.43Å; I597-F599 HydrophobicContact CG2-CE1 4.24Å; I597-F599 HydrophobicContact CG2-CE2 4.18Å; I597-F599 HydrophobicContact CG2-CZ 3.96Å
598	V	94.5	Very high	79.3	Confident	10 Å²	10	83.8 Å²	83.8	6%	0.061	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.8	174.2	-171.3	0	0	0	0	108.5	N529 R530 C581 Q582 Y584 V596	N529-V598 WeakPolarHBondContact O-CA 3.16Å; R530-V598 HydrophobicContact CG-CG1 4.29Å; R530-V598 HydrophobicContact CG-CG2 4.19Å; R530-V598 VanDerWaalsContact NH1-CG2 3.31Å; C581-V598 CarbonylContact C-O 3.56Å; C581-V598 VanDerWaalsContact CA-O 3.24Å; C581-V598 WeakPolarHBondContact CA-O 3.48Å; Q582-V598 HydrophobicContact CB-CB 4.22Å; Q582-V598 PolarHBondContact N-O 2.81Å; Q582-V598 PolarHBondContact O-N 2.97Å; Y584-V598 HydrophobicContact CD2-CG2 3.78Å; Y584-V598 HydrophobicContact CE2-CG2 3.66Å; V596-V598 HydrophobicContact CG1-CG2 4.07Å
599	F	91.4	Very high	78.6	Confident	5 Å²	5	82.5 Å²	82.5	2%	0.022	42%	0.418	C	S	.	.			trans	-83.4	146.2	177	-61.3	-86.2	0	0	0	110.5	I485 V495 L502 F526 N529 L531 I597	I485-F599 HydrophobicContact CD1-CE2 4.48Å; V495-F599 HydrophobicContact CB-CD1 3.97Å; V495-F599 HydrophobicContact CB-CD2 4.39Å; V495-F599 HydrophobicContact CB-CE1 4.18Å; V495-F599 HydrophobicContact CB-CG 4.08Å; V495-F599 HydrophobicContact CB-CZ 4.49Å; V495-F599 HydrophobicContact CG1-CB 4.35Å; V495-F599 HydrophobicContact CG1-CD1 4.1Å; V495-F599 HydrophobicContact CG1-CD2 3.61Å; V495-F599 HydrophobicContact CG1-CE1 4.3Å; V495-F599 HydrophobicContact CG1-CE2 3.85Å; V495-F599 HydrophobicContact CG1-CG 3.75Å; V495-F599 HydrophobicContact CG1-CZ 4.19Å; V495-F599 HydrophobicContact CG2-CD1 4.27Å; V495-F599 HydrophobicContact CG2-CE1 3.99Å; V495-F599 HydrophobicContact CG2-CZ 4.23Å; L502-F599 HydrophobicContact CD1-CE1 3.72Å; L502-F599 HydrophobicContact CD1-CZ 3.82Å; L502-F599 HydrophobicContact CD2-CE1 4.02Å; L502-F599 HydrophobicContact CD2-CZ 4.28Å; F526-F599 HydrophobicContact CE2-CD2 4.15Å; F526-F599 HydrophobicContact CE2-CE2 4.12Å; N529-F599 HydrophobicContact CB-CB 4.38Å; N529-F599 PolarHBondContact ND2-O 3.28Å; N529-F599 WeakPolarHBondContact O-CD2 3.45Å; N529-F599 PolarHBondContact O-N 2.95Å; L531-F599 HydrophobicContact CB-CE2 3.81Å; L531-F599 HydrophobicContact CB-CZ 4.48Å; I597-F599 HydrophobicContact CB-CE2 4.34Å; I597-F599 HydrophobicContact CB-CZ 4.43Å; I597-F599 HydrophobicContact CG2-CE1 4.24Å; I597-F599 HydrophobicContact CG2-CE2 4.18Å; I597-F599 HydrophobicContact CG2-CZ 3.96Å
600	P	86	Confident	77.9	Confident	40 Å²	40	83.1 Å²	83.1	26%	0.26	42%	0.417	S	S	.	.			trans	-62.3	142.4	173.6	26.9	-33.4	0	0	0	110.8	I603	P600-I603 HydrophobicContact CG-CG1 4.16Å
601	E	74.5	Confident	77.3	Confident	176 Å²	176	76.8 Å²	76.8	82%	0.822	39%	0.392	S	S	*	.	S	Bend	trans	-71.2	-36.9	176.4	-68.4	-171.8	166.3	0	0	111.5
602	E	65.6	Low	76.4	Confident	176 Å²	176	72.9 Å²	72.9	82%	0.822	38%	0.379	S	S	*	.	S	Bend	trans	-132.8	135.5	171.2	-71.7	-177.9	166.4	0	0	108.4	A604	E602-A604 PolarHBondContact O-N 2.73Å
603	I	59.8	Low	75.2	Confident	47 Å²	47	77.3 Å²	77.3	24%	0.241	40%	0.4	C	S	.	.			trans	-79.9	114.1	166.2	-59.4	-161	0	0	0	105.7	F480 Y496 P600 A605	F480-I603 HydrophobicContact CB-CD1 4.27Å; F480-I603 HydrophobicContact CD1-CD1 3.07Å; F480-I603 HydrophobicContact CE1-CD1 3.36Å; F480-I603 HydrophobicContact CG-CD1 3.74Å; F480-I603 HydrophobicContact CZ-CD1 4.2Å; Y496-I603 HydrophobicContact CD1-CB 4.33Å; Y496-I603 HydrophobicContact CD1-CD1 3.35Å; Y496-I603 HydrophobicContact CD1-CG1 3.76Å; Y496-I603 HydrophobicContact CE1-CD1 4.05Å; Y496-I603 HydrophobicContact CG-CD1 4.27Å; P600-I603 HydrophobicContact CG-CG1 4.16Å; I603-A605 PolarHBondContact O-N 2.62Å
604	A	51.9	Low	73.7	Confident	77 Å²	77	82 Å²	82	64%	0.636	42%	0.424	S	S	*	.			trans	-52.7	115.9	164.6	0	0	0	0	0	106.1	E602 Y606	E602-A604 PolarHBondContact O-N 2.73Å; A604-Y606 PolarHBondContact O-N 3.29Å
605	A	45.4	Very low	71.9	Confident	85 Å²	85	85.5 Å²	85.5	70%	0.702	44%	0.443	S	S	*	.			trans	-52.4	106.5	177.6	0	0	0	0	0	107.4	I603 E607	I603-A605 PolarHBondContact O-N 2.62Å; A605-E607 PolarHBondContact O-N 2.9Å
606	Y	44.3	Very low	69.8	Low	213 Å²	213	91.8 Å²	91.8	84%	0.835	48%	0.475	S	S	*	.			trans	-72.4	87.6	158.1	-80.5	-87.3	0	0	0	103.7	A604	A604-Y606 PolarHBondContact O-N 3.29Å
607	E	32.6	Very low	67.4	Low	254 Å²	254	98.5 Å²	98.5	100%	1.187	51%	0.509	S	S	*	.			trans	-65.3	0	161.6	-82.8	-174.1	159.8	0	0	110.6	A605	A605-E607 PolarHBondContact O-N 2.9Å

Retrieved 607 of 607 residues in 226.5 ms (Link to these results)

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