A0A5K4FDZ6_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDZ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 367 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	45.6	Very low	81.5	Confident	194 Å²	194	63 Å²	63	96%	0.956	33%	0.329	S	S	*	.				0	127	0	-125.5	170.4	98.3	0	0	107.5	I261	M1-I261 HydrophobicContact CE-CD1 4.22Å; M1-I261 HydrophobicContact CE-CG1 3.87Å; M1-I261 HydrophobicContact CE-CG2 4.46Å; M1-I261 HydrophobicContact CG-CG2 4.41Å; M1-I261 HydrophobicContact SD-CG2 4.17Å
2	I	59	Low	82.6	Confident	66 Å²	66	57.9 Å²	57.9	34%	0.338	30%	0.302	S	S	.	.			trans	-109.6	111.8	-176.5	-56.3	-178.2	0	0	0	107.4	L4 N231 M264 M267	I2-L4 HydrophobicContact CG2-CD2 3.79Å; I2-L4 HydrophobicContact CG2-CG 4.4Å; I2-L4 PolarHBondContact O-N 3.32Å; I2-L4 VanDerWaalsContact O-N 3.1Å; I2-N231 WeakPolarHBondContact CD1-OD1 3.41Å; I2-M264 HydrophobicContact CD1-SD 4.21Å; I2-M267 HydrophobicContact CD1-CE 4.2Å
3	N	76	Confident	83.6	Confident	103 Å²	103	58 Å²	58	55%	0.551	30%	0.3	S	S	*	.			trans	-79.5	91.3	170.3	-173.5	-23	0	0	0	108.4	E5 S6 S7	N3-E5 VanDerWaalsContact C-N 3.26Å; N3-E5 PolarHBondContact O-N 3.11Å; N3-E5 WeakPolarHBondContact OD1-CB 2.95Å; N3-E5 PolarHBondContact OD1-N 2.69Å; N3-S6 WeakPolarHBondContact O-CB 3.29Å; N3-S6 PolarHBondContact O-N 3.19Å; N3-S6 VanDerWaalsContact O-N 3.09Å; N3-S6 PolarHBondContact OD1-N 2.85Å; N3-S6 VanDerWaalsContact OD1-N 3.08Å; N3-S7 PolarHBondContact O-N 2.92Å; N3-S7 VanDerWaalsContact O-N 3.15Å; N3-S7 PolarHBondContact O-OG 3.4Å
4	L	82.8	Confident	84.3	Confident	12 Å²	12	58.1 Å²	58.1	6%	0.063	30%	0.297	C	S	.	.	H	α-helix	trans	-57.8	-39	-177.1	-65.8	175.2	0	0	0	112.4	I2 S6 S7 I8 N231 Y234 W235	I2-L4 HydrophobicContact CG2-CD2 3.79Å; I2-L4 HydrophobicContact CG2-CG 4.4Å; I2-L4 PolarHBondContact O-N 3.32Å; I2-L4 VanDerWaalsContact O-N 3.1Å; L4-S6 VanDerWaalsContact C-N 3.35Å; L4-S7 PolarHBondContact O-N 3.21Å; L4-I8 WeakPolarHBondContact O-CG1 3.37Å; L4-I8 PolarHBondContact O-N 3.47Å; L4-I8 VanDerWaalsContact O-N 3.12Å; L4-N231 HydrophobicContact CD2-CB 3.38Å; L4-N231 WeakPolarHBondContact CD2-O 2.93Å; L4-Y234 HydrophobicContact CD1-CD1 3.42Å; L4-Y234 VanDerWaalsContact CD1-CD1 3.42Å; L4-Y234 HydrophobicContact CD1-CE1 4.3Å; L4-Y234 HydrophobicContact CD1-CG 4.16Å; L4-W235 HydrophobicContact CB-CB 4.33Å; L4-W235 HydrophobicContact CD1-CB 4.4Å
5	E	87.9	Confident	85	Confident	67 Å²	67	54.3 Å²	54.3	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-60.2	-45.5	175.3	171.8	173.5	174.2	0	0	111.4	N3 S7 I8 K9 Y34	N3-E5 VanDerWaalsContact C-N 3.26Å; N3-E5 PolarHBondContact O-N 3.11Å; N3-E5 WeakPolarHBondContact OD1-CB 2.95Å; N3-E5 PolarHBondContact OD1-N 2.69Å; E5-S7 VanDerWaalsContact C-N 3.3Å; E5-S7 PolarHBondContact O-N 3.49Å; E5-I8 PolarHBondContact O-N 3.19Å; E5-K9 HydrophobicContact CG-CD 4.1Å; E5-K9 HydrophobicContact CG-CG 4.45Å; E5-K9 WeakPolarHBondContact O-CG 3.48Å; E5-K9 PolarHBondContact O-N 3.39Å; E5-K9 WeakPolarHBondContact OE1-CE 3.36Å; E5-K9 IonicContact OE1-NZ 2.62Å; E5-K9 PolarHBondContact OE1-NZ 3.4Å; E5-Y34 HydrophobicContact CB-CE2 4.42Å; E5-Y34 HydrophobicContact CG-CE1 3.87Å; E5-Y34 HydrophobicContact CG-CE2 4.02Å
6	S	87.7	Confident	85.6	Confident	63 Å²	63	51.2 Å²	51.2	44%	0.441	26%	0.262	S	S	.	.	H	α-helix	trans	-58.6	-41.7	176.1	-168.1	0	0	0	0	112	N3 L4 I8 K9 E10	N3-S6 WeakPolarHBondContact O-CB 3.29Å; N3-S6 PolarHBondContact O-N 3.19Å; N3-S6 VanDerWaalsContact O-N 3.09Å; N3-S6 PolarHBondContact OD1-N 2.85Å; N3-S6 VanDerWaalsContact OD1-N 3.08Å; L4-S6 VanDerWaalsContact C-N 3.35Å; S6-I8 PolarHBondContact O-N 3.17Å; S6-K9 PolarHBondContact O-N 3.11Å; S6-E10 WeakPolarHBondContact O-CB 3.39Å; S6-E10 PolarHBondContact O-N 2.78Å
7	S	87.7	Confident	86	Confident	37 Å²	37	50.8 Å²	50.8	26%	0.259	26%	0.26	S	S	.	.	H	α-helix	trans	-65	-39	178.7	-58.5	0	0	0	0	112.8	N3 L4 E5 M11	N3-S7 PolarHBondContact O-N 2.92Å; N3-S7 VanDerWaalsContact O-N 3.15Å; N3-S7 PolarHBondContact O-OG 3.4Å; L4-S7 PolarHBondContact O-N 3.21Å; E5-S7 VanDerWaalsContact C-N 3.3Å; E5-S7 PolarHBondContact O-N 3.49Å; S7-M11 PolarHBondContact O-N 2.96Å; S7-M11 VanDerWaalsContact O-N 3.11Å
8	I	91.4	Very high	86.4	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-69.4	-43.1	175.8	-58.6	-61.9	0	0	0	110.5	L4 E5 S6 E10 M11 I12 Y34 L37 L220 L223 F232 W235	L4-I8 WeakPolarHBondContact O-CG1 3.37Å; L4-I8 PolarHBondContact O-N 3.47Å; L4-I8 VanDerWaalsContact O-N 3.12Å; E5-I8 PolarHBondContact O-N 3.19Å; S6-I8 PolarHBondContact O-N 3.17Å; I8-E10 PolarHBondContact O-N 3.1Å; I8-M11 WeakPolarHBondContact O-CB 3.19Å; I8-M11 PolarHBondContact O-N 3.4Å; I8-M11 VanDerWaalsContact O-N 3.13Å; I8-I12 HydrophobicContact CG2-CD1 4.19Å; I8-I12 WeakPolarHBondContact O-CG1 3.44Å; I8-I12 PolarHBondContact O-N 3.03Å; I8-Y34 HydrophobicContact CB-CD2 4.07Å; I8-Y34 HydrophobicContact CB-CE2 3.85Å; I8-Y34 HydrophobicContact CG1-CE2 4.48Å; I8-Y34 HydrophobicContact CG2-CD2 3.7Å; I8-Y34 HydrophobicContact CG2-CE2 3.83Å; I8-L37 HydrophobicContact CG2-CD1 4.18Å; I8-L220 HydrophobicContact CD1-CD2 4.29Å; I8-L220 HydrophobicContact CG2-CD2 4.5Å; I8-L223 HydrophobicContact CD1-CD1 3.5Å; I8-L223 VanDerWaalsContact CD1-CD1 3.5Å; I8-F232 HydrophobicContact CD1-CD2 4.36Å; I8-W235 HydrophobicContact CD1-CD2 3.89Å; I8-W235 HydrophobicContact CD1-CE3 4.02Å; I8-W235 HydrophobicContact CD1-CG 4.24Å; I8-W235 HydrophobicContact CD1-CZ3 4.46Å; I8-W235 HydrophobicContact CG1-CD2 3.8Å; I8-W235 HydrophobicContact CG1-CE3 4.43Å; I8-W235 HydrophobicContact CG1-CG 3.89Å; I8-W235 HydrophobicContact CG1-CZ2 4.38Å; I8-W235 HydrophobicContact CG2-CZ2 4.22Å
9	K	93.3	Very high	86.7	Confident	45 Å²	45	46.2 Å²	46.2	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-42.5	177.1	-74.1	-176.6	-176.8	179.1	0	112.5	E5 S6 M11 I12 Q13 I30 N31 Y34	E5-K9 HydrophobicContact CG-CD 4.1Å; E5-K9 HydrophobicContact CG-CG 4.45Å; E5-K9 WeakPolarHBondContact O-CG 3.48Å; E5-K9 PolarHBondContact O-N 3.39Å; E5-K9 WeakPolarHBondContact OE1-CE 3.36Å; E5-K9 IonicContact OE1-NZ 2.62Å; E5-K9 PolarHBondContact OE1-NZ 3.4Å; S6-K9 PolarHBondContact O-N 3.11Å; K9-M11 VanDerWaalsContact C-N 3.29Å; K9-M11 PolarHBondContact O-N 3.24Å; K9-I12 WeakPolarHBondContact O-CB 3.42Å; K9-I12 PolarHBondContact O-N 3.31Å; K9-Q13 PolarHBondContact O-N 3.38Å; K9-I30 HydrophobicContact CB-CG2 3.74Å; K9-I30 HydrophobicContact CD-CG2 4.36Å; K9-I30 HydrophobicContact CG-CG2 3.92Å; K9-N31 WeakPolarHBondContact CE-OD1 3.48Å; K9-N31 PolarHBondContact NZ-OD1 3.07Å; K9-Y34 HydrophobicContact CG-CD2 3.94Å; K9-Y34 HydrophobicContact CG-CG 4.04Å
10	E	92.1	Very high	86.9	Confident	88 Å²	88	44.1 Å²	44.1	41%	0.411	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-41.3	173.3	-169.1	-164.6	147	0	0	111.1	S6 I8 Q13 K14	S6-E10 WeakPolarHBondContact O-CB 3.39Å; S6-E10 PolarHBondContact O-N 2.78Å; I8-E10 PolarHBondContact O-N 3.1Å; E10-Q13 WeakPolarHBondContact O-CB 3.4Å; E10-Q13 PolarHBondContact O-N 3.01Å; E10-K14 WeakPolarHBondContact O-CG 3.28Å; E10-K14 PolarHBondContact O-N 3.21Å; E10-K14 WeakPolarHBondContact OE1-CE 3.01Å; E10-K14 IonicContact OE1-NZ 3.96Å; E10-K14 PolarHBondContact OE1-NZ 3.17Å
11	M	93.1	Very high	87	Confident	14 Å²	14	42.3 Å²	42.3	7%	0.069	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-41	176.3	-169.9	57.3	71.9	0	0	112.3	S7 I8 K9 Q13 K14 V15 S219 L220 L223	S7-M11 PolarHBondContact O-N 2.96Å; S7-M11 VanDerWaalsContact O-N 3.11Å; I8-M11 WeakPolarHBondContact O-CB 3.19Å; I8-M11 PolarHBondContact O-N 3.4Å; I8-M11 VanDerWaalsContact O-N 3.13Å; K9-M11 VanDerWaalsContact C-N 3.29Å; K9-M11 PolarHBondContact O-N 3.24Å; M11-Q13 VanDerWaalsContact C-N 3.31Å; M11-Q13 PolarHBondContact O-N 2.77Å; M11-K14 PolarHBondContact O-N 3.19Å; M11-V15 WeakPolarHBondContact O-CG2 3.2Å; M11-V15 PolarHBondContact O-N 2.72Å; M11-S219 WeakPolarHBondContact CE-O 2.9Å; M11-S219 VanDerWaalsContact SD-C 3.53Å; M11-S219 PolarHBondContact SD-N 3.28Å; M11-S219 VanDerWaalsContact SD-O 3.38Å; M11-L220 HydrophobicContact CB-CD2 4.25Å; M11-L220 HydrophobicContact CG-CD2 3.84Å; M11-L220 HydrophobicContact CG-CG 4.35Å; M11-L223 HydrophobicContact CE-CD2 3.87Å; M11-L223 HydrophobicContact CE-CG 4.03Å
12	I	95	Very high	88.5	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-45.1	173.8	-66.4	166.9	0	0	0	110.4	I8 K9 K14 V15 L16 L33 Y34 L37 L319	I8-I12 HydrophobicContact CG2-CD1 4.19Å; I8-I12 WeakPolarHBondContact O-CG1 3.44Å; I8-I12 PolarHBondContact O-N 3.03Å; K9-I12 WeakPolarHBondContact O-CB 3.42Å; K9-I12 PolarHBondContact O-N 3.31Å; I12-K14 VanDerWaalsContact C-N 3.34Å; I12-K14 PolarHBondContact O-N 3.42Å; I12-V15 PolarHBondContact O-N 3.41Å; I12-L16 HydrophobicContact CG2-CD1 4.13Å; I12-L16 WeakPolarHBondContact O-CG 3.4Å; I12-L16 PolarHBondContact O-N 2.97Å; I12-L33 HydrophobicContact CD1-CB 4.43Å; I12-L33 HydrophobicContact CG2-CB 3.85Å; I12-L33 HydrophobicContact CG2-CD1 3.84Å; I12-Y34 HydrophobicContact CD1-CD2 4.27Å; I12-L37 HydrophobicContact CD1-CD1 3.67Å; I12-L37 HydrophobicContact CG1-CD1 3.77Å; I12-L319 HydrophobicContact CG1-CD1 4.22Å
13	Q	94.6	Very high	89	Confident	59 Å²	59	38.7 Å²	38.7	28%	0.276	20%	0.2	S	C	.	.	H	α-helix	trans	-59.7	-45.3	177.1	-170.4	-179.3	26.3	0	0	111.2	K9 E10 M11 V15 L16 I17 I30	K9-Q13 PolarHBondContact O-N 3.38Å; E10-Q13 WeakPolarHBondContact O-CB 3.4Å; E10-Q13 PolarHBondContact O-N 3.01Å; M11-Q13 VanDerWaalsContact C-N 3.31Å; M11-Q13 PolarHBondContact O-N 2.77Å; Q13-V15 VanDerWaalsContact C-N 3.34Å; Q13-V15 PolarHBondContact O-N 3.36Å; Q13-L16 PolarHBondContact O-N 3.43Å; Q13-I17 HydrophobicContact CG-CD1 3.95Å; Q13-I17 WeakPolarHBondContact O-CG1 3.24Å; Q13-I17 PolarHBondContact O-N 3.3Å; Q13-I30 HydrophobicContact CB-CD1 4.02Å; Q13-I30 HydrophobicContact CG-CD1 3.99Å
14	K	94	Very high	89	Confident	59 Å²	59	41.9 Å²	41.9	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-59.3	-43.4	174.3	-71.8	175.1	166.7	162.6	0	111.7	E10 M11 I12 L16 I17 S18 L214 A218	E10-K14 WeakPolarHBondContact O-CG 3.28Å; E10-K14 PolarHBondContact O-N 3.21Å; E10-K14 WeakPolarHBondContact OE1-CE 3.01Å; E10-K14 IonicContact OE1-NZ 3.96Å; E10-K14 PolarHBondContact OE1-NZ 3.17Å; M11-K14 PolarHBondContact O-N 3.19Å; I12-K14 VanDerWaalsContact C-N 3.34Å; I12-K14 PolarHBondContact O-N 3.42Å; K14-L16 VanDerWaalsContact C-N 3.34Å; K14-L16 PolarHBondContact O-N 3.31Å; K14-I17 PolarHBondContact O-N 2.91Å; K14-S18 WeakPolarHBondContact O-CB 3.46Å; K14-S18 PolarHBondContact O-N 2.93Å; K14-S18 PolarHBondContact O-OG 3.36Å; K14-L214 HydrophobicContact CB-CD1 3.94Å; K14-L214 HydrophobicContact CD-CD1 4.32Å; K14-L214 HydrophobicContact CG-CD1 3.74Å; K14-A218 HydrophobicContact CB-CB 3.84Å; K14-A218 WeakPolarHBondContact O-CB 3.14Å
15	V	94.9	Very high	89	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-41.8	176.7	170.3	0	0	0	0	111.4	M11 I12 Q13 S18 S19 A218 L319 L320 I323	M11-V15 WeakPolarHBondContact O-CG2 3.2Å; M11-V15 PolarHBondContact O-N 2.72Å; I12-V15 PolarHBondContact O-N 3.41Å; Q13-V15 VanDerWaalsContact C-N 3.34Å; Q13-V15 PolarHBondContact O-N 3.36Å; V15-S18 WeakPolarHBondContact CA-OG 3.08Å; V15-S18 PolarHBondContact O-OG 2.65Å; V15-S19 WeakPolarHBondContact O-CB 3.46Å; V15-S19 PolarHBondContact O-N 3.05Å; V15-S19 VanDerWaalsContact O-N 3.08Å; V15-S19 PolarHBondContact O-OG 3.46Å; V15-A218 HydrophobicContact CG2-CB 4.48Å; V15-A218 WeakPolarHBondContact CG2-O 3.24Å; V15-L319 HydrophobicContact CG1-CB 4.41Å; V15-L319 HydrophobicContact CG1-CD1 4.46Å; V15-L320 HydrophobicContact CG1-CD2 3.86Å; V15-I323 HydrophobicContact CG1-CD1 4.2Å
16	L	94.6	Very high	89.1	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-50.7	177.5	-72.8	166.4	0	0	0	112.4	I12 Q13 K14 S18 S19 E21 T25 I29 L33 I323	I12-L16 HydrophobicContact CG2-CD1 4.13Å; I12-L16 WeakPolarHBondContact O-CG 3.4Å; I12-L16 PolarHBondContact O-N 2.97Å; Q13-L16 PolarHBondContact O-N 3.43Å; K14-L16 VanDerWaalsContact C-N 3.34Å; K14-L16 PolarHBondContact O-N 3.31Å; L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 3.28Å; L16-S19 WeakPolarHBondContact O-CA 3.49Å; L16-S19 WeakPolarHBondContact O-CB 3.33Å; L16-S19 PolarHBondContact O-N 3.01Å; L16-E21 VanDerWaalsContact O-CB 3.29Å; L16-E21 WeakPolarHBondContact O-CB 3.37Å; L16-E21 PolarHBondContact O-N 3.41Å; L16-T25 HydrophobicContact CD1-CG2 3.56Å; L16-I29 HydrophobicContact CD1-CG2 4.19Å; L16-L33 HydrophobicContact CD1-CD1 3.9Å; L16-L33 HydrophobicContact CD2-CD1 4.02Å; L16-L33 HydrophobicContact CG-CD1 4.23Å; L16-I323 HydrophobicContact CD2-CD1 3.79Å; L16-I323 HydrophobicContact CD2-CG1 4.06Å
17	I	92.4	Very high	89.3	Confident	44 Å²	44	44 Å²	44	23%	0.226	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-44.7	179.5	-63.9	168.2	0	0	0	110.2	Q13 K14 S19 G20 F211 L214	Q13-I17 HydrophobicContact CG-CD1 3.95Å; Q13-I17 WeakPolarHBondContact O-CG1 3.24Å; Q13-I17 PolarHBondContact O-N 3.3Å; K14-I17 PolarHBondContact O-N 2.91Å; I17-S19 PolarHBondContact O-N 3.39Å; I17-G20 PolarHBondContact O-N 2.81Å; I17-F211 WeakPolarHBondContact O-CE2 3.35Å; I17-L214 HydrophobicContact CB-CD2 4.05Å; I17-L214 HydrophobicContact CG2-CD2 3.49Å; I17-L214 VanDerWaalsContact CG2-CD2 3.49Å
18	S	92.5	Very high	89.6	Confident	11 Å²	11	47.3 Å²	47.3	8%	0.077	24%	0.239	C	C	.	.	H	α-helix	trans	-69.1	-14.5	179.3	73.5	0	0	0	0	113.6	K14 V15 L16 G20 I196 A218	K14-S18 WeakPolarHBondContact O-CB 3.46Å; K14-S18 PolarHBondContact O-N 2.93Å; K14-S18 PolarHBondContact O-OG 3.36Å; V15-S18 WeakPolarHBondContact CA-OG 3.08Å; V15-S18 PolarHBondContact O-OG 2.65Å; L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 3.28Å; S18-G20 PolarHBondContact O-N 3.02Å; S18-I196 WeakPolarHBondContact O-CD1 3.47Å; S18-A218 VanDerWaalsContact OG-CB 3.22Å; S18-A218 WeakPolarHBondContact OG-CB 3.42Å
19	S	92.8	Very high	89.8	Confident	4 Å²	4	47.5 Å²	47.5	3%	0.028	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	9.5	170.4	-63	0	0	0	0	113.6	V15 L16 I17 I323	V15-S19 WeakPolarHBondContact O-CB 3.46Å; V15-S19 PolarHBondContact O-N 3.05Å; V15-S19 VanDerWaalsContact O-N 3.08Å; V15-S19 PolarHBondContact O-OG 3.46Å; L16-S19 WeakPolarHBondContact O-CA 3.49Å; L16-S19 WeakPolarHBondContact O-CB 3.33Å; L16-S19 PolarHBondContact O-N 3.01Å; I17-S19 PolarHBondContact O-N 3.39Å; S19-I323 WeakPolarHBondContact OG-CD1 3.39Å
20	G	90.8	Very high	89.9	Confident	4 Å²	4	45.8 Å²	45.8	4%	0.041	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	16.5	178.3	0	0	0	0	0	114.2	I17 S18 R195	I17-G20 PolarHBondContact O-N 2.81Å; S18-G20 PolarHBondContact O-N 3.02Å; G20-R195 PolarHBondContact O-NE 3.41Å
21	E	88.9	Confident	90	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.028	23%	0.228	C	C	.	.			trans	-63	127.6	176	-169.4	63.9	-164.1	0	0	110.4	L16 R195 K199 P340 I341	L16-E21 VanDerWaalsContact O-CB 3.29Å; L16-E21 WeakPolarHBondContact O-CB 3.37Å; L16-E21 PolarHBondContact O-N 3.41Å; E21-R195 IonicContact OE1-NH2 3.27Å; E21-R195 IonicContact OE2-CZ 3.68Å; E21-R195 IonicContact OE2-NH1 2.57Å; E21-R195 PolarHBondContact OE2-NH1 3.37Å; E21-R195 IonicContact OE2-NH2 3.68Å; E21-R195 PolarHBondContact OE2-NH2 2.87Å; E21-K199 PolarHBondContact O-NZ 3.05Å; E21-P340 WeakPolarHBondContact OE1-CA 3.33Å; E21-P340 WeakPolarHBondContact OE1-CB 3.27Å; E21-I341 PolarHBondContact OE1-N 3.16Å; E21-I341 WeakPolarHBondContact OE2-CG1 3.16Å
22	P	76.4	Confident	90.1	Very high	46 Å²	46	45.4 Å²	45.4	30%	0.299	23%	0.234	S	C	.	.			trans	-78.2	-15.5	-168.5	27.6	-36.6	0	0	0	115.1	S338 P340	P22-S338 VanDerWaalsContact CG-O 3.31Å; P22-S338 WeakPolarHBondContact CG-O 3.4Å; P22-P340 HydrophobicContact CG-CG 4.47Å
23	F	70.2	Confident	90.2	Very high	138 Å²	138	45.5 Å²	45.5	61%	0.605	24%	0.235	S	C	*	.	S	Bend	trans	-139.3	175	-177.2	-59	-86.7	0	0	0	112.6	T25 P340	F23-T25 PolarHBondContact O-N 3.42Å; F23-T25 VanDerWaalsContact O-N 3.08Å; F23-P340 HydrophobicContact CD2-CG 3.67Å; F23-P340 HydrophobicContact CE2-CG 3.94Å
24	H	76.9	Confident	90.2	Very high	170 Å²	170	43.1 Å²	43.1	79%	0.787	22%	0.223	S	C	*	.			trans	-53.5	115.1	164.3	-70.1	-61.4	0	0	0	109.7	S26	H24-S26 PolarHBondContact O-N 2.84Å
25	T	82.1	Confident	90.1	Very high	11 Å²	11	43.1 Å²	43.1	7%	0.067	23%	0.226	C	C	.	.			trans	-65.3	133.1	175.8	-46.5	0	0	0	0	109.5	L16 F23 D27 I29 I30	L16-T25 HydrophobicContact CD1-CG2 3.56Å; F23-T25 PolarHBondContact O-N 3.42Å; F23-T25 VanDerWaalsContact O-N 3.08Å; T25-D27 PolarHBondContact O-N 3.39Å; T25-I29 HydrophobicContact CG2-CB 3.73Å; T25-I29 HydrophobicContact CG2-CD1 4.08Å; T25-I29 HydrophobicContact CG2-CG1 4.48Å; T25-I29 HydrophobicContact CG2-CG2 3.7Å; T25-I30 HydrophobicContact CG2-CG1 4.32Å
26	S	89	Confident	90	Very high	60 Å²	60	43.3 Å²	43.3	42%	0.42	23%	0.227	S	C	.	.			trans	-55.3	137	173.3	176.3	0	0	0	0	111.6	H24 L28 I29 I30	H24-S26 PolarHBondContact O-N 2.84Å; S26-L28 PolarHBondContact O-N 3.35Å; S26-L28 VanDerWaalsContact O-N 3.08Å; S26-L28 PolarHBondContact OG-N 3.01Å; S26-I29 WeakPolarHBondContact O-CB 3.32Å; S26-I29 PolarHBondContact O-N 3.44Å; S26-I30 PolarHBondContact O-N 3.29Å
27	D	92.5	Very high	90	Very high	115 Å²	115	43.1 Å²	43.1	62%	0.615	23%	0.226	S	C	*	.	H	α-helix	trans	-54.3	-28.6	174	-67.7	-30.7	0	0	0	112.6	T25 I29 I30 N31	T25-D27 PolarHBondContact O-N 3.39Å; D27-I29 VanDerWaalsContact C-N 3.32Å; D27-I29 PolarHBondContact O-N 2.97Å; D27-I30 PolarHBondContact O-N 3.24Å; D27-N31 VanDerWaalsContact O-CB 3.31Å; D27-N31 WeakPolarHBondContact O-CB 3.47Å; D27-N31 PolarHBondContact O-N 3.49Å; D27-N31 PolarHBondContact O-ND2 3.5Å
28	L	94.1	Very high	90	Very high	107 Å²	107	43.1 Å²	43.1	56%	0.56	22%	0.223	S	C	*	.	H	α-helix	trans	-62.4	-38.6	175.5	-64.6	176.3	0	0	0	112.3	S26 L32 L343	S26-L28 PolarHBondContact O-N 3.35Å; S26-L28 VanDerWaalsContact O-N 3.08Å; S26-L28 PolarHBondContact OG-N 3.01Å; L28-L32 VanDerWaalsContact O-CB 3.26Å; L28-L32 WeakPolarHBondContact O-CB 3.4Å; L28-L32 PolarHBondContact O-N 3.26Å; L28-L343 HydrophobicContact CB-CD1 4.24Å; L28-L343 HydrophobicContact CB-CD2 4.21Å; L28-L343 HydrophobicContact CD1-CD2 4.28Å
29	I	95	Very high	89.8	Confident	9 Å²	9	44.6 Å²	44.6	5%	0.046	23%	0.229	C	C	.	.	H	α-helix	trans	-71.1	-42.6	176.9	-66.6	173.6	0	0	0	109.7	L16 T25 S26 D27 L32 L33 I341 L343 I346	L16-I29 HydrophobicContact CD1-CG2 4.19Å; T25-I29 HydrophobicContact CG2-CB 3.73Å; T25-I29 HydrophobicContact CG2-CD1 4.08Å; T25-I29 HydrophobicContact CG2-CG1 4.48Å; T25-I29 HydrophobicContact CG2-CG2 3.7Å; S26-I29 WeakPolarHBondContact O-CB 3.32Å; S26-I29 PolarHBondContact O-N 3.44Å; D27-I29 VanDerWaalsContact C-N 3.32Å; D27-I29 PolarHBondContact O-N 2.97Å; I29-L32 PolarHBondContact O-N 3.49Å; I29-L33 HydrophobicContact CG2-CD1 4.05Å; I29-L33 HydrophobicContact CG2-CG 4.47Å; I29-L33 WeakPolarHBondContact O-CG 3.36Å; I29-L33 PolarHBondContact O-N 3.15Å; I29-I341 VanDerWaalsContact CD1-O 3.23Å; I29-I341 WeakPolarHBondContact CD1-O 3.42Å; I29-L343 HydrophobicContact CG1-CB 4.33Å; I29-L343 HydrophobicContact CG1-CD1 4.07Å; I29-I346 HydrophobicContact CG2-CG1 4.24Å
30	I	95.7	Very high	89.7	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-47.5	178.5	-62.2	171.8	0	0	0	110.2	K9 Q13 T25 S26 D27 L32 L33 Y34	K9-I30 HydrophobicContact CB-CG2 3.74Å; K9-I30 HydrophobicContact CD-CG2 4.36Å; K9-I30 HydrophobicContact CG-CG2 3.92Å; Q13-I30 HydrophobicContact CB-CD1 4.02Å; Q13-I30 HydrophobicContact CG-CD1 3.99Å; T25-I30 HydrophobicContact CG2-CG1 4.32Å; S26-I30 PolarHBondContact O-N 3.29Å; D27-I30 PolarHBondContact O-N 3.24Å; I30-L32 PolarHBondContact O-N 3.41Å; I30-L33 PolarHBondContact O-N 3.47Å; I30-Y34 WeakPolarHBondContact O-CB 3.4Å; I30-Y34 PolarHBondContact O-N 3.46Å
31	N	94.9	Very high	89.8	Confident	57 Å²	57	44.5 Å²	44.5	31%	0.305	23%	0.228	S	C	.	.	H	α-helix	trans	-61.5	-44	177	-72	-33.9	0	0	0	111.7	K9 D27 L33 Y34 D35	K9-N31 WeakPolarHBondContact CE-OD1 3.48Å; K9-N31 PolarHBondContact NZ-OD1 3.07Å; D27-N31 VanDerWaalsContact O-CB 3.31Å; D27-N31 WeakPolarHBondContact O-CB 3.47Å; D27-N31 PolarHBondContact O-N 3.49Å; D27-N31 PolarHBondContact O-ND2 3.5Å; N31-L33 PolarHBondContact O-N 2.69Å; N31-Y34 WeakPolarHBondContact O-CB 3.28Å; N31-Y34 PolarHBondContact O-N 3.36Å; N31-D35 PolarHBondContact O-N 3.28Å
32	L	95.2	Very high	89.7	Confident	37 Å²	37	45 Å²	45	19%	0.194	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-41.9	178.7	-178.4	62.4	0	0	0	112.6	L28 I29 I30 Y36 L343 I346 K347 L350	L28-L32 VanDerWaalsContact O-CB 3.26Å; L28-L32 WeakPolarHBondContact O-CB 3.4Å; L28-L32 PolarHBondContact O-N 3.26Å; I29-L32 PolarHBondContact O-N 3.49Å; I30-L32 PolarHBondContact O-N 3.41Å; L32-Y36 PolarHBondContact O-N 3.49Å; L32-Y36 VanDerWaalsContact O-N 3.1Å; L32-L343 HydrophobicContact CB-CD1 4.31Å; L32-L343 HydrophobicContact CD2-CD1 3.56Å; L32-I346 HydrophobicContact CD2-CB 4.13Å; L32-I346 HydrophobicContact CD2-CG2 3.56Å; L32-I346 HydrophobicContact CG-CG2 4.16Å; L32-K347 HydrophobicContact CD2-CG 3.63Å; L32-L350 HydrophobicContact CD1-CD1 3.83Å; L32-L350 HydrophobicContact CD2-CD1 3.97Å; L32-L350 HydrophobicContact CG-CD1 3.63Å
33	L	95.9	Very high	90.3	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-35	175.9	-70.9	176.1	0	0	0	112.2	I12 L16 I29 I30 N31 Y36 L37 L319 I322 I346	I12-L33 HydrophobicContact CD1-CB 4.43Å; I12-L33 HydrophobicContact CG2-CB 3.85Å; I12-L33 HydrophobicContact CG2-CD1 3.84Å; L16-L33 HydrophobicContact CD1-CD1 3.9Å; L16-L33 HydrophobicContact CD2-CD1 4.02Å; L16-L33 HydrophobicContact CG-CD1 4.23Å; I29-L33 HydrophobicContact CG2-CD1 4.05Å; I29-L33 HydrophobicContact CG2-CG 4.47Å; I29-L33 WeakPolarHBondContact O-CG 3.36Å; I29-L33 PolarHBondContact O-N 3.15Å; I30-L33 PolarHBondContact O-N 3.47Å; N31-L33 PolarHBondContact O-N 2.69Å; L33-Y36 PolarHBondContact O-N 3.1Å; L33-L37 WeakPolarHBondContact O-CG 3.4Å; L33-L37 PolarHBondContact O-N 2.92Å; L33-L319 HydrophobicContact CB-CD2 4.18Å; L33-L319 HydrophobicContact CD2-CD2 4.26Å; L33-I322 HydrophobicContact CD2-CD1 4.03Å; L33-I322 HydrophobicContact CD2-CG2 4.12Å; L33-I346 HydrophobicContact CD2-CD1 4.42Å; L33-I346 HydrophobicContact CD2-CG2 4Å; L33-I346 HydrophobicContact CG-CG2 4.48Å
34	Y	95.1	Very high	91.2	Very high	9 Å²	9	38.2 Å²	38.2	4%	0.035	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-46.1	173.6	176.3	-98.3	0	0	0	111.3	E5 I8 K9 I12 I30 N31 Y36 L37 R38 W235	E5-Y34 HydrophobicContact CB-CE2 4.42Å; E5-Y34 HydrophobicContact CG-CE1 3.87Å; E5-Y34 HydrophobicContact CG-CE2 4.02Å; I8-Y34 HydrophobicContact CB-CD2 4.07Å; I8-Y34 HydrophobicContact CB-CE2 3.85Å; I8-Y34 HydrophobicContact CG1-CE2 4.48Å; I8-Y34 HydrophobicContact CG2-CD2 3.7Å; I8-Y34 HydrophobicContact CG2-CE2 3.83Å; K9-Y34 HydrophobicContact CG-CD2 3.94Å; K9-Y34 HydrophobicContact CG-CG 4.04Å; I12-Y34 HydrophobicContact CD1-CD2 4.27Å; I30-Y34 WeakPolarHBondContact O-CB 3.4Å; I30-Y34 PolarHBondContact O-N 3.46Å; N31-Y34 WeakPolarHBondContact O-CB 3.28Å; N31-Y34 PolarHBondContact O-N 3.36Å; Y34-Y36 VanDerWaalsContact C-N 3.32Å; Y34-Y36 PolarHBondContact O-N 3.49Å; Y34-L37 PolarHBondContact O-N 3.32Å; Y34-R38 WeakPolarHBondContact O-CB 3.31Å; Y34-R38 PolarHBondContact O-N 2.99Å; Y34-W235 AromaticContact CE2-NE1 3.75Å; Y34-W235 AromaticContact CZ-NE1 3.95Å; Y34-W235 PolarHBondContact OH-NE1 2.9Å
35	D	92.6	Very high	91.8	Very high	59 Å²	59	30.1 Å²	30.1	32%	0.316	16%	0.159	S	C	.	.	H	α-helix	trans	-59.6	-43.9	175.6	-78.4	-32	0	0	0	111.8	N31 R38 I39	N31-D35 PolarHBondContact O-N 3.28Å; D35-R38 PolarHBondContact O-N 3.3Å; D35-R38 IonicContact OD1-CZ 3.46Å; D35-R38 IonicContact OD1-NE 3.87Å; D35-R38 IonicContact OD1-NH2 2.72Å; D35-R38 PolarHBondContact OD1-NH2 2.92Å; D35-I39 VanDerWaalsContact O-CG1 3.23Å; D35-I39 WeakPolarHBondContact O-CG1 3.42Å; D35-I39 PolarHBondContact O-N 3.33Å
36	Y	93.3	Very high	91.9	Very high	7 Å²	7	33.8 Å²	33.8	3%	0.027	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-47.6	175	173	-100.1	0	0	0	112.4	L32 L33 Y34 R38 I39 N40 D318 I322 L350 F353 T354	L32-Y36 PolarHBondContact O-N 3.49Å; L32-Y36 VanDerWaalsContact O-N 3.1Å; L33-Y36 PolarHBondContact O-N 3.1Å; Y34-Y36 VanDerWaalsContact C-N 3.32Å; Y34-Y36 PolarHBondContact O-N 3.49Å; Y36-R38 VanDerWaalsContact C-N 3.34Å; Y36-R38 PolarHBondContact O-N 3.22Å; Y36-I39 PolarHBondContact O-N 3.17Å; Y36-N40 WeakPolarHBondContact CE1-ND2 3.49Å; Y36-N40 PolarHBondContact O-N 3.49Å; Y36-N40 PolarHBondContact OH-ND2 2.98Å; Y36-D318 HydrophobicContact CE1-CB 4.11Å; Y36-I322 HydrophobicContact CD1-CD1 3.48Å; Y36-I322 VanDerWaalsContact CD1-CD1 3.48Å; Y36-I322 HydrophobicContact CE1-CD1 3.3Å; Y36-I322 HydrophobicContact CE1-CG1 4.43Å; Y36-I322 HydrophobicContact CE2-CD1 4.47Å; Y36-I322 HydrophobicContact CG-CD1 4.15Å; Y36-L350 HydrophobicContact CD1-CD2 4.14Å; Y36-L350 HydrophobicContact CD2-CD2 3.39Å; Y36-L350 HydrophobicContact CE2-CD2 3.82Å; Y36-L350 HydrophobicContact CG-CD2 3.54Å; Y36-F353 HydrophobicContact CE2-CB 4.24Å; Y36-F353 VanDerWaalsContact OH-CD1 3.32Å; Y36-F353 WeakPolarHBondContact OH-CD1 3.47Å; Y36-T354 HydrophobicContact CD2-CG2 4.42Å; Y36-T354 HydrophobicContact CE2-CG2 4.26Å
37	L	93.7	Very high	91.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-44.5	176.3	-80.7	-179	0	0	0	112.2	I8 I12 L33 Y34 I39 N40 A41 L220 L315 L319	I8-L37 HydrophobicContact CG2-CD1 4.18Å; I12-L37 HydrophobicContact CD1-CD1 3.67Å; I12-L37 HydrophobicContact CG1-CD1 3.77Å; L33-L37 WeakPolarHBondContact O-CG 3.4Å; L33-L37 PolarHBondContact O-N 2.92Å; Y34-L37 PolarHBondContact O-N 3.32Å; L37-I39 VanDerWaalsContact C-N 3.34Å; L37-I39 PolarHBondContact O-N 2.94Å; L37-N40 PolarHBondContact O-N 3.05Å; L37-A41 VanDerWaalsContact O-CB 3.32Å; L37-A41 WeakPolarHBondContact O-CB 3.44Å; L37-A41 PolarHBondContact O-N 3.24Å; L37-L220 HydrophobicContact CD1-CD1 4.18Å; L37-L220 HydrophobicContact CD2-CD1 4.27Å; L37-L315 HydrophobicContact CD2-CB 4.08Å; L37-L315 HydrophobicContact CD2-CD2 4.34Å; L37-L319 HydrophobicContact CD1-CD1 3.89Å; L37-L319 HydrophobicContact CD1-CD2 3.99Å; L37-L319 HydrophobicContact CD1-CG 4.17Å; L37-L319 HydrophobicContact CD2-CD1 4.27Å; L37-L319 HydrophobicContact CD2-CD2 3.93Å; L37-L319 HydrophobicContact CD2-CG 3.83Å; L37-L319 HydrophobicContact CG-CD1 4.41Å; L37-L319 HydrophobicContact CG-CD2 3.76Å; L37-L319 HydrophobicContact CG-CG 4.13Å
38	R	91.9	Very high	91.6	Very high	43 Å²	43	30.1 Å²	30.1	16%	0.162	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-45.1	178.4	-178	-179.1	60.8	174.2	-8	110.9	Y34 D35 Y36 A41 N42 T240 T243	Y34-R38 WeakPolarHBondContact O-CB 3.31Å; Y34-R38 PolarHBondContact O-N 2.99Å; D35-R38 PolarHBondContact O-N 3.3Å; D35-R38 IonicContact OD1-CZ 3.46Å; D35-R38 IonicContact OD1-NE 3.87Å; D35-R38 IonicContact OD1-NH2 2.72Å; D35-R38 PolarHBondContact OD1-NH2 2.92Å; Y36-R38 VanDerWaalsContact C-N 3.34Å; Y36-R38 PolarHBondContact O-N 3.22Å; R38-A41 PolarHBondContact O-N 3.46Å; R38-N42 PolarHBondContact O-N 3.34Å; R38-N42 PolarHBondContact O-ND2 3.42Å; R38-T240 HydrophobicContact CG-CG2 4.37Å; R38-T243 PolarHBondContact NH1-OG1 3.38Å
39	I	89.9	Confident	91.2	Very high	42 Å²	42	26.2 Å²	26.2	22%	0.215	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-45.2	176.4	-68.8	166.2	0	0	0	110.6	D35 Y36 L37 A41 N42 Q43	D35-I39 VanDerWaalsContact O-CG1 3.23Å; D35-I39 WeakPolarHBondContact O-CG1 3.42Å; D35-I39 PolarHBondContact O-N 3.33Å; Y36-I39 PolarHBondContact O-N 3.17Å; L37-I39 VanDerWaalsContact C-N 3.34Å; L37-I39 PolarHBondContact O-N 2.94Å; I39-A41 PolarHBondContact O-N 3.03Å; I39-N42 WeakPolarHBondContact O-CB 3.32Å; I39-N42 PolarHBondContact O-N 2.74Å; I39-Q43 WeakPolarHBondContact O-CG 3.44Å; I39-Q43 PolarHBondContact O-N 2.97Å
40	N	90.4	Very high	90.7	Very high	7 Å²	7	32.3 Å²	32.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-65.1	-39.3	177.8	-80.7	5.9	0	0	0	112.6	Y36 L37 N42 Q43 F44 R69 L315 D318	Y36-N40 WeakPolarHBondContact CE1-ND2 3.49Å; Y36-N40 PolarHBondContact O-N 3.49Å; Y36-N40 PolarHBondContact OH-ND2 2.98Å; L37-N40 PolarHBondContact O-N 3.05Å; N40-N42 VanDerWaalsContact C-N 3.33Å; N40-Q43 WeakPolarHBondContact O-CB 3.26Å; N40-Q43 PolarHBondContact O-N 3.3Å; N40-F44 VanDerWaalsContact O-CD2 3.26Å; N40-F44 WeakPolarHBondContact O-CD2 3.41Å; N40-F44 PolarHBondContact O-N 2.93Å; N40-F44 VanDerWaalsContact O-N 3.1Å; N40-R69 PolarHBondContact ND2-NH2 3.44Å; N40-L315 HydrophobicContact CB-CD2 4.07Å; N40-D318 PolarHBondContact ND2-OD2 3.29Å
41	A	91.4	Very high	90	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-43.6	174.5	0	0	0	0	0	111.2	L37 R38 I39 Q43 F44 L45 W235 F236 T240	L37-A41 VanDerWaalsContact O-CB 3.32Å; L37-A41 WeakPolarHBondContact O-CB 3.44Å; L37-A41 PolarHBondContact O-N 3.24Å; R38-A41 PolarHBondContact O-N 3.46Å; I39-A41 PolarHBondContact O-N 3.03Å; A41-Q43 VanDerWaalsContact C-N 3.31Å; A41-Q43 PolarHBondContact O-N 3.03Å; A41-F44 WeakPolarHBondContact O-CB 3.38Å; A41-F44 PolarHBondContact O-N 3.3Å; A41-F44 VanDerWaalsContact O-N 3.15Å; A41-L45 WeakPolarHBondContact O-CG 3.23Å; A41-L45 PolarHBondContact O-N 3.38Å; A41-W235 HydrophobicContact CB-CH2 4.09Å; A41-F236 HydrophobicContact CB-CD2 3.76Å; A41-F236 HydrophobicContact CB-CE2 3.73Å; A41-T240 HydrophobicContact CB-CG2 3.69Å
42	N	88.2	Confident	89.7	Confident	16 Å²	16	35.7 Å²	35.7	9%	0.086	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-41.8	172.2	-83.4	-36.2	0	0	0	112.7	R38 I39 N40 F44 L45 I46 T240	R38-N42 PolarHBondContact O-N 3.34Å; R38-N42 PolarHBondContact O-ND2 3.42Å; I39-N42 WeakPolarHBondContact O-CB 3.32Å; I39-N42 PolarHBondContact O-N 2.74Å; N40-N42 VanDerWaalsContact C-N 3.33Å; N42-F44 VanDerWaalsContact C-N 3.31Å; N42-F44 PolarHBondContact O-N 3.14Å; N42-L45 PolarHBondContact O-N 3.43Å; N42-I46 WeakPolarHBondContact O-CG1 3.39Å; N42-I46 PolarHBondContact O-N 3.1Å; N42-I46 VanDerWaalsContact O-N 3.1Å; N42-T240 PolarHBondContact ND2-O 3.35Å; N42-T240 WeakPolarHBondContact OD1-CB 3.12Å; N42-T240 PolarHBondContact OD1-O 3.44Å; N42-T240 VanDerWaalsContact OD1-O 3.05Å
43	Q	87.5	Confident	89.4	Confident	41 Å²	41	34.3 Å²	34.3	19%	0.192	17%	0.171	C	C	.	.	H	α-helix	trans	-62.2	-38.4	176.7	-66.5	-64.8	-48.6	0	0	112	I39 N40 A41 H47	I39-Q43 WeakPolarHBondContact O-CG 3.44Å; I39-Q43 PolarHBondContact O-N 2.97Å; N40-Q43 WeakPolarHBondContact O-CB 3.26Å; N40-Q43 PolarHBondContact O-N 3.3Å; A41-Q43 VanDerWaalsContact C-N 3.31Å; A41-Q43 PolarHBondContact O-N 3.03Å; Q43-H47 PolarHBondContact O-CD2 3.44Å; Q43-H47 VanDerWaalsContact O-CD2 3.31Å
44	F	90.8	Very high	89.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-47.1	171.4	-79.7	-73.5	0	0	0	111.7	N40 A41 N42 I46 H47 L48 L59 C62 R69 F236 L311 L314 L315	N40-F44 VanDerWaalsContact O-CD2 3.26Å; N40-F44 WeakPolarHBondContact O-CD2 3.41Å; N40-F44 PolarHBondContact O-N 2.93Å; N40-F44 VanDerWaalsContact O-N 3.1Å; A41-F44 WeakPolarHBondContact O-CB 3.38Å; A41-F44 PolarHBondContact O-N 3.3Å; A41-F44 VanDerWaalsContact O-N 3.15Å; N42-F44 VanDerWaalsContact C-N 3.31Å; N42-F44 PolarHBondContact O-N 3.14Å; F44-I46 PolarHBondContact O-N 3.36Å; F44-H47 PolarHBondContact O-N 2.96Å; F44-L48 HydrophobicContact CB-CD1 4Å; F44-L48 WeakPolarHBondContact O-CB 3.05Å; F44-L48 VanDerWaalsContact O-CG 3.28Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 2.95Å; F44-L59 HydrophobicContact CD1-CD2 4.48Å; F44-C62 HydrophobicContact CD1-CB 4.42Å; F44-C62 WeakPolarHBondContact CD1-SG 3.31Å; F44-R69 VanDerWaalsContact CZ-CZ 3.47Å; F44-F236 HydrophobicContact CB-CE2 4.19Å; F44-F236 HydrophobicContact CB-CZ 3.88Å; F44-L311 HydrophobicContact CB-CD1 4.1Å; F44-L311 HydrophobicContact CD1-CD1 3.9Å; F44-L311 HydrophobicContact CD2-CD1 3.73Å; F44-L311 HydrophobicContact CE1-CD1 4.22Å; F44-L311 HydrophobicContact CE2-CD1 4.06Å; F44-L311 HydrophobicContact CG-CD1 3.65Å; F44-L311 HydrophobicContact CZ-CD1 4.29Å; F44-L314 HydrophobicContact CE1-CD1 4.16Å; F44-L314 HydrophobicContact CZ-CB 4.36Å; F44-L314 HydrophobicContact CZ-CD1 3.96Å; F44-L315 HydrophobicContact CD2-CD2 4.22Å; F44-L315 HydrophobicContact CE2-CD2 4.05Å
45	L	88.3	Confident	88.9	Confident	1 Å²	1	36 Å²	36	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-27.8	-177.5	-71.7	165.6	0	0	0	114.5	A41 N42 H47 F236 Y237 T240 F241	A41-L45 WeakPolarHBondContact O-CG 3.23Å; A41-L45 PolarHBondContact O-N 3.38Å; N42-L45 PolarHBondContact O-N 3.43Å; L45-H47 PolarHBondContact O-N 3.29Å; L45-F236 WeakPolarHBondContact CD1-O 3.43Å; L45-F236 HydrophobicContact CD2-CD1 3.74Å; L45-F236 HydrophobicContact CD2-CE1 3.26Å; L45-F236 HydrophobicContact CD2-CE2 4.37Å; L45-F236 HydrophobicContact CD2-CG 4.46Å; L45-F236 HydrophobicContact CD2-CZ 3.62Å; L45-F236 HydrophobicContact CG-CD1 4.45Å; L45-F236 HydrophobicContact CG-CE1 3.88Å; L45-F236 HydrophobicContact CG-CE2 4.1Å; L45-F236 HydrophobicContact CG-CZ 3.67Å; L45-Y237 HydrophobicContact CD2-CD1 3.52Å; L45-Y237 HydrophobicContact CD2-CE1 3.67Å; L45-Y237 HydrophobicContact CD2-CG 4.06Å; L45-T240 HydrophobicContact CD1-CG2 4.36Å; L45-T240 WeakPolarHBondContact CD1-OG1 3.5Å; L45-F241 HydrophobicContact CB-CE2 3.76Å; L45-F241 HydrophobicContact CB-CZ 3.67Å; L45-F241 HydrophobicContact CD1-CD2 3.85Å; L45-F241 HydrophobicContact CD1-CE2 3.36Å; L45-F241 HydrophobicContact CD1-CZ 4.01Å; L45-F241 HydrophobicContact CD2-CE2 4.22Å; L45-F241 HydrophobicContact CG-CE2 3.99Å; L45-F241 HydrophobicContact CG-CZ 4.39Å
46	I	85.5	Confident	88.8	Confident	88 Å²	88	33.5 Å²	33.5	45%	0.451	17%	0.171	S	C	.	.	H	α-helix	trans	-61.1	-34.9	175.3	-69.6	166.3	0	0	0	110.7	N42 F44	N42-I46 WeakPolarHBondContact O-CG1 3.39Å; N42-I46 PolarHBondContact O-N 3.1Å; N42-I46 VanDerWaalsContact O-N 3.1Å; F44-I46 PolarHBondContact O-N 3.36Å
47	H	85.5	Confident	88.7	Confident	89 Å²	89	35.3 Å²	35.3	41%	0.412	18%	0.181	S	C	.	.	H	α-helix	trans	-102.3	-16.6	-175.5	-58.7	-58.8	0	0	0	113.9	Q43 F44 L45 C62	Q43-H47 PolarHBondContact O-CD2 3.44Å; Q43-H47 VanDerWaalsContact O-CD2 3.31Å; F44-H47 PolarHBondContact O-N 2.96Å; L45-H47 PolarHBondContact O-N 3.29Å; H47-C62 HydrophobicContact CB-CB 4.2Å
48	L	89.6	Confident	88.6	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.042	19%	0.187	C	C	.	.	S	Bend	trans	-88.1	152.1	-178.6	-70.3	178.4	0	0	0	112.4	F44 K50 P54 D58 L59 F236	F44-L48 HydrophobicContact CB-CD1 4Å; F44-L48 WeakPolarHBondContact O-CB 3.05Å; F44-L48 VanDerWaalsContact O-CG 3.28Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 2.95Å; L48-K50 PolarHBondContact O-N 3.49Å; L48-P54 HydrophobicContact CD1-CB 4.07Å; L48-P54 HydrophobicContact CD2-CB 3.97Å; L48-D58 HydrophobicContact CD2-CB 3.59Å; L48-L59 HydrophobicContact CD1-CD2 4.22Å; L48-L59 HydrophobicContact CD2-CD2 4.14Å; L48-F236 HydrophobicContact CD1-CE1 4.09Å; L48-F236 HydrophobicContact CD1-CZ 3.92Å
49	P	84.9	Confident	88.7	Confident	25 Å²	25	34.5 Å²	34.5	16%	0.162	18%	0.18	C	C	.	.			trans	-62.7	133.9	175.1	26.2	-34.2	0	0	0	111.2	K52 Y237	P49-K52 HydrophobicContact CB-CD 4.4Å; P49-K52 HydrophobicContact CB-CG 3.63Å; P49-K52 HydrophobicContact CG-CD 4.37Å; P49-K52 HydrophobicContact CG-CG 3.7Å; P49-Y237 WeakPolarHBondContact O-CE1 3.43Å; P49-Y237 PolarHBondContact O-OH 3.49Å
50	K	83.6	Confident	88.8	Confident	138 Å²	138	32.5 Å²	32.5	60%	0.6	17%	0.169	S	C	*	.	S	Bend	trans	-83.1	-17.9	177.3	-61.7	-174.8	-178.1	-178.8	0	113.7	L48	L48-K50 PolarHBondContact O-N 3.49Å
51	S	82.2	Confident	88.9	Confident	72 Å²	72	35.6 Å²	35.6	50%	0.503	19%	0.186	S	C	.	.	S	Bend	trans	-102.5	-15.3	-172.1	56.3	0	0	0	0	114.5	N277	S51-N277 VanDerWaalsContact O-CB 3.24Å; S51-N277 WeakPolarHBondContact O-CB 3.49Å; S51-N277 PolarHBondContact O-ND2 3.37Å
52	K	87.3	Confident	88.9	Confident	64 Å²	64	36.1 Å²	36.1	28%	0.278	19%	0.189	S	C	.	.	S	Bend	trans	-139.7	161	-177.4	63.4	171.7	-173.5	178.2	0	110.6	P49 Y237 M274 N277	P49-K52 HydrophobicContact CB-CD 4.4Å; P49-K52 HydrophobicContact CB-CG 3.63Å; P49-K52 HydrophobicContact CG-CD 4.37Å; P49-K52 HydrophobicContact CG-CG 3.7Å; K52-Y237 PolarHBondContact O-OH 3.45Å; K52-M274 WeakPolarHBondContact O-CE 3.4Å; K52-N277 HydrophobicContact CB-CB 4.16Å
53	L	89	Confident	89.1	Confident	7 Å²	7	35.3 Å²	35.3	4%	0.037	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-64.8	143.7	177.3	-57.5	171.4	0	0	0	109.1	S55 L233 M274 L275 S278 P304 L308	L53-S55 PolarHBondContact O-N 3.27Å; L53-L233 HydrophobicContact CD2-CD1 3.86Å; L53-L233 HydrophobicContact CD2-CD2 4.21Å; L53-M274 HydrophobicContact CD2-CB 3.94Å; L53-M274 HydrophobicContact CD2-CE 3.93Å; L53-M274 HydrophobicContact CD2-SD 4.19Å; L53-M274 HydrophobicContact CG-CB 4.22Å; L53-L275 HydrophobicContact CD1-CD1 3.89Å; L53-S278 WeakPolarHBondContact CB-OG 3.39Å; L53-S278 WeakPolarHBondContact CG-OG 3.28Å; L53-S278 PolarHBondContact N-OG 2.8Å; L53-P304 WeakPolarHBondContact CD1-O 3.48Å; L53-L308 HydrophobicContact CD2-CD1 3.9Å
54	P	90.5	Very high	89.2	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.019	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-65.2	136.2	179.3	27.6	-33.9	0	0	0	109.9	L48 G307 L308	L48-P54 HydrophobicContact CD1-CB 4.07Å; L48-P54 HydrophobicContact CD2-CB 3.97Å; P54-G307 VanDerWaalsContact O-CA 3.25Å; P54-G307 WeakPolarHBondContact O-CA 3.39Å; P54-L308 HydrophobicContact CG-CD2 3.91Å; P54-L308 HydrophobicContact CG-CG 4.14Å
55	S	90	Very high	89.1	Confident	46 Å²	46	42 Å²	42	32%	0.322	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-92.6	167.2	170.3	68.6	0	0	0	0	111.2	L53 N57 D58 L59	L53-S55 PolarHBondContact O-N 3.27Å; S55-N57 PolarHBondContact O-N 3.49Å; S55-N57 PolarHBondContact OG-N 3.15Å; S55-D58 WeakPolarHBondContact CB-OD2 3.46Å; S55-D58 PolarHBondContact N-OD2 3.17Å; S55-D58 PolarHBondContact O-N 3.1Å; S55-D58 PolarHBondContact OG-N 3.3Å; S55-D58 PolarHBondContact OG-OD2 3.36Å; S55-L59 WeakPolarHBondContact O-CG 3.44Å; S55-L59 PolarHBondContact O-N 3.22Å
56	L	90.9	Very high	89.3	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-39.3	170.4	173.7	59.9	0	0	0	111.6	L59 L60 I73 F77 L144 L147 I310	L56-L59 PolarHBondContact O-N 3.24Å; L56-L60 HydrophobicContact CD1-CD1 4.18Å; L56-L60 HydrophobicContact CD1-CG 4.05Å; L56-L60 HydrophobicContact CG-CD1 4.07Å; L56-L60 HydrophobicContact CG-CG 4.39Å; L56-L60 WeakPolarHBondContact O-CG 3.49Å; L56-L60 PolarHBondContact O-N 2.89Å; L56-I73 HydrophobicContact CD1-CG2 4.1Å; L56-F77 HydrophobicContact CD1-CE2 3.84Å; L56-F77 HydrophobicContact CD1-CZ 4.18Å; L56-F77 HydrophobicContact CD2-CE2 4Å; L56-F77 HydrophobicContact CD2-CZ 3.71Å; L56-L144 HydrophobicContact CD1-CD1 4.22Å; L56-L144 HydrophobicContact CD2-CD1 3.98Å; L56-L147 HydrophobicContact CB-CD1 4.35Å; L56-L147 HydrophobicContact CD2-CD1 3.49Å; L56-L147 VanDerWaalsContact CD2-CD1 3.49Å; L56-L147 HydrophobicContact CG-CD1 3.8Å; L56-I310 HydrophobicContact CD1-CD1 3.74Å
57	N	91.1	Very high	89.6	Confident	45 Å²	45	39.3 Å²	39.3	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-46.5	177.5	-175.9	72.3	0	0	0	111.8	S55 L59 L60 L61 L147 L151	S55-N57 PolarHBondContact O-N 3.49Å; S55-N57 PolarHBondContact OG-N 3.15Å; N57-L59 VanDerWaalsContact C-N 3.28Å; N57-L59 PolarHBondContact O-N 2.9Å; N57-L60 PolarHBondContact O-N 2.84Å; N57-L61 WeakPolarHBondContact O-CG 3.33Å; N57-L61 PolarHBondContact O-N 2.67Å; N57-L147 HydrophobicContact CB-CD2 4.43Å; N57-L151 WeakPolarHBondContact OD1-CD1 3.36Å; N57-L151 WeakPolarHBondContact OD1-CD2 3.47Å
58	D	92	Very high	89.9	Confident	25 Å²	25	35.3 Å²	35.3	13%	0.134	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-38.5	179	-54.3	-43.7	0	0	0	111.3	L48 S55 C62	L48-D58 HydrophobicContact CD2-CB 3.59Å; S55-D58 WeakPolarHBondContact CB-OD2 3.46Å; S55-D58 PolarHBondContact N-OD2 3.17Å; S55-D58 PolarHBondContact O-N 3.1Å; S55-D58 PolarHBondContact OG-N 3.3Å; S55-D58 PolarHBondContact OG-OD2 3.36Å; D58-C62 VanDerWaalsContact O-CB 3.31Å; D58-C62 WeakPolarHBondContact O-CB 3.48Å; D58-C62 PolarHBondContact O-N 2.62Å
59	L	93.5	Very high	90.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-71.1	-39.5	177.9	-66.7	172.6	0	0	0	113.2	F44 L48 S55 L56 N57 C62 C63 G307 I310 L311	F44-L59 HydrophobicContact CD1-CD2 4.48Å; L48-L59 HydrophobicContact CD1-CD2 4.22Å; L48-L59 HydrophobicContact CD2-CD2 4.14Å; S55-L59 WeakPolarHBondContact O-CG 3.44Å; S55-L59 PolarHBondContact O-N 3.22Å; L56-L59 PolarHBondContact O-N 3.24Å; N57-L59 VanDerWaalsContact C-N 3.28Å; N57-L59 PolarHBondContact O-N 2.9Å; L59-C62 PolarHBondContact O-N 3.41Å; L59-C63 VanDerWaalsContact O-CB 3.32Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 2.87Å; L59-C63 PolarHBondContact O-SG 3.27Å; L59-G307 VanDerWaalsContact CD1-O 3.28Å; L59-G307 WeakPolarHBondContact CD1-O 3.36Å; L59-I310 HydrophobicContact CD1-CB 3.69Å; L59-I310 HydrophobicContact CD1-CG2 3.7Å; L59-L311 HydrophobicContact CD2-CB 4.28Å; L59-L311 HydrophobicContact CD2-CD1 4.26Å
60	L	93.5	Very high	90.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-45.3	176.4	-73.6	174.6	0	0	0	110.8	L56 N57 C63 Q64 L70 I73 L147 F148 L151 I153	L56-L60 HydrophobicContact CD1-CD1 4.18Å; L56-L60 HydrophobicContact CD1-CG 4.05Å; L56-L60 HydrophobicContact CG-CD1 4.07Å; L56-L60 HydrophobicContact CG-CG 4.39Å; L56-L60 WeakPolarHBondContact O-CG 3.49Å; L56-L60 PolarHBondContact O-N 2.89Å; N57-L60 PolarHBondContact O-N 2.84Å; L60-C63 CarbonylContact O-C 3.55Å; L60-C63 PolarHBondContact O-N 3.4Å; L60-Q64 PolarHBondContact O-N 2.86Å; L60-L70 HydrophobicContact CD2-CD2 4.16Å; L60-I73 HydrophobicContact CD2-CD1 3.92Å; L60-I73 HydrophobicContact CD2-CG2 4.14Å; L60-L147 HydrophobicContact CD1-CB 3.77Å; L60-L147 HydrophobicContact CD1-CD1 4.37Å; L60-F148 HydrophobicContact CD1-CD2 4.33Å; L60-F148 HydrophobicContact CD1-CE2 4.37Å; L60-F148 HydrophobicContact CD2-CD2 4.22Å; L60-F148 HydrophobicContact CD2-CE1 4.32Å; L60-F148 HydrophobicContact CD2-CE2 3.53Å; L60-F148 HydrophobicContact CD2-CZ 3.58Å; L60-L151 HydrophobicContact CB-CD1 3.55Å; L60-L151 HydrophobicContact CD1-CD1 4.09Å; L60-L151 HydrophobicContact CG-CD1 4.48Å; L60-I153 HydrophobicContact CB-CD1 3.96Å; L60-I153 WeakPolarHBondContact O-CD1 3.36Å
61	L	91.4	Very high	90.9	Very high	72 Å²	72	27.4 Å²	27.4	38%	0.377	16%	0.155	S	C	.	.	H	α-helix	trans	-59.2	-47	173.1	-76.6	172.5	0	0	0	111.7	N57 C63 Q64 L151	N57-L61 WeakPolarHBondContact O-CG 3.33Å; N57-L61 PolarHBondContact O-N 2.67Å; L61-C63 PolarHBondContact O-N 3.45Å; L61-Q64 WeakPolarHBondContact O-CB 3.36Å; L61-Q64 VanDerWaalsContact O-CG 3.28Å; L61-Q64 WeakPolarHBondContact O-CG 3.47Å; L61-Q64 PolarHBondContact O-N 3.45Å; L61-L151 HydrophobicContact CD1-CD2 4.31Å; L61-L151 HydrophobicContact CD2-CD1 4.4Å; L61-L151 HydrophobicContact CD2-CD2 3.7Å; L61-L151 HydrophobicContact CG-CD1 4.12Å; L61-L151 HydrophobicContact CG-CD2 3.92Å
62	C	91.3	Very high	91.4	Very high	11 Å²	11	25 Å²	25	7%	0.074	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-32.8	177.2	-174.6	0	0	0	0	112.8	F44 H47 D58 L59	F44-C62 HydrophobicContact CD1-CB 4.42Å; F44-C62 WeakPolarHBondContact CD1-SG 3.31Å; H47-C62 HydrophobicContact CB-CB 4.2Å; D58-C62 VanDerWaalsContact O-CB 3.31Å; D58-C62 WeakPolarHBondContact O-CB 3.48Å; D58-C62 PolarHBondContact O-N 2.62Å; L59-C62 PolarHBondContact O-N 3.41Å
63	C	92.6	Very high	91.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	4.4	-177.7	-62.8	0	0	0	0	113.8	L59 L60 L61 S65 Q66 R69 L70 I73	L59-C63 VanDerWaalsContact O-CB 3.32Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 2.87Å; L59-C63 PolarHBondContact O-SG 3.27Å; L60-C63 CarbonylContact O-C 3.55Å; L60-C63 PolarHBondContact O-N 3.4Å; L61-C63 PolarHBondContact O-N 3.45Å; C63-S65 PolarHBondContact O-N 2.92Å; C63-Q66 HydrophobicContact CB-CB 4.46Å; C63-Q66 WeakPolarHBondContact O-CA 3.36Å; C63-Q66 WeakPolarHBondContact O-CB 3.08Å; C63-Q66 PolarHBondContact O-N 2.67Å; C63-R69 HydrophobicContact CB-CB 4.21Å; C63-L70 HydrophobicContact CB-CD2 3.87Å; C63-L70 HydrophobicContact CB-CG 4.33Å; C63-L70 WeakPolarHBondContact O-CG 3.4Å; C63-I73 HydrophobicContact CB-CD1 4.4Å
64	Q	90.8	Very high	91.7	Very high	105 Å²	105	21.6 Å²	21.6	49%	0.491	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.2	-170.1	70.2	-177.8	-4.7	0	0	114	L60 L61 I153 Y174	L60-Q64 PolarHBondContact O-N 2.86Å; L61-Q64 WeakPolarHBondContact O-CB 3.36Å; L61-Q64 VanDerWaalsContact O-CG 3.28Å; L61-Q64 WeakPolarHBondContact O-CG 3.47Å; L61-Q64 PolarHBondContact O-N 3.45Å; Q64-I153 HydrophobicContact CB-CD1 4.13Å; Q64-I153 HydrophobicContact CB-CG1 4.35Å; Q64-Y174 PolarHBondContact O-OH 3.41Å
65	S	88.7	Confident	91.5	Very high	76 Å²	76	23.8 Å²	23.8	53%	0.531	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	7.9	178.6	58.4	0	0	0	0	113.5	C63 P67	C63-S65 PolarHBondContact O-N 2.92Å; S65-P67 VanDerWaalsContact O-CD 3.3Å; S65-P67 WeakPolarHBondContact O-CD 3.25Å
66	Q	91.6	Very high	91.4	Very high	31 Å²	31	22.7 Å²	22.7	15%	0.145	12%	0.118	C	C	.	.			trans	-120.1	77.1	-170	-61.9	173.6	-7.4	0	0	109.8	C63 I68 R69 L70 Y358	C63-Q66 HydrophobicContact CB-CB 4.46Å; C63-Q66 WeakPolarHBondContact O-CA 3.36Å; C63-Q66 WeakPolarHBondContact O-CB 3.08Å; C63-Q66 PolarHBondContact O-N 2.67Å; Q66-I68 PolarHBondContact O-N 3.08Å; Q66-I68 VanDerWaalsContact O-N 3.12Å; Q66-R69 HydrophobicContact CB-CB 4.18Å; Q66-R69 PolarHBondContact O-N 2.68Å; Q66-L70 PolarHBondContact O-N 3.06Å; Q66-Y358 HydrophobicContact CB-CD1 4.45Å; Q66-Y358 HydrophobicContact CB-CE1 4.23Å; Q66-Y358 HydrophobicContact CG-CD1 4.12Å; Q66-Y358 HydrophobicContact CG-CE1 4.38Å
67	P	92.1	Very high	91.1	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.013	12%	0.117	C	C	.	.	H	α-helix	trans	-59.6	-34.1	-168.6	21.7	-33.1	0	0	0	113.2	S65 R69 L70 C71 F170 W171 Y174 L178	S65-P67 VanDerWaalsContact O-CD 3.3Å; S65-P67 WeakPolarHBondContact O-CD 3.25Å; P67-R69 PolarHBondContact O-N 3.3Å; P67-L70 PolarHBondContact O-N 3.33Å; P67-C71 PolarHBondContact O-N 2.89Å; P67-C71 PolarHBondContact O-SG 3.1Å; P67-F170 HydrophobicContact CB-CE1 3.72Å; P67-F170 HydrophobicContact CB-CZ 3.71Å; P67-W171 HydrophobicContact CB-CE3 4.35Å; P67-W171 HydrophobicContact CB-CH2 4.11Å; P67-W171 HydrophobicContact CB-CZ3 3.73Å; P67-W171 HydrophobicContact CG-CH2 4.49Å; P67-W171 HydrophobicContact CG-CZ3 3.83Å; P67-Y174 HydrophobicContact CB-CD1 4.04Å; P67-Y174 HydrophobicContact CB-CD2 3.77Å; P67-Y174 HydrophobicContact CB-CE1 4.08Å; P67-Y174 HydrophobicContact CB-CE2 3.83Å; P67-Y174 HydrophobicContact CB-CG 3.89Å; P67-Y174 HydrophobicContact CG-CD1 3.72Å; P67-Y174 HydrophobicContact CG-CD2 4.13Å; P67-Y174 HydrophobicContact CG-CE1 4.13Å; P67-Y174 HydrophobicContact CG-CG 3.72Å; P67-L178 HydrophobicContact CG-CB 4.31Å; P67-L178 HydrophobicContact CG-CD1 3.8Å
68	I	92.4	Very high	90.5	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-63.8	-41.7	178	-62.3	-179.4	0	0	0	111.3	Q66 R72 W171 V181 Y182 L185 I357	Q66-I68 PolarHBondContact O-N 3.08Å; Q66-I68 VanDerWaalsContact O-N 3.12Å; I68-R72 WeakPolarHBondContact O-CB 3.47Å; I68-R72 PolarHBondContact O-N 3.49Å; I68-W171 HydrophobicContact CG1-CH2 4.28Å; I68-V181 HydrophobicContact CD1-CG1 4.14Å; I68-Y182 HydrophobicContact CG1-CD2 4.14Å; I68-Y182 HydrophobicContact CG2-CD2 4.44Å; I68-L185 HydrophobicContact CD1-CD1 3.93Å; I68-L185 HydrophobicContact CG2-CD1 4.32Å; I68-I357 HydrophobicContact CD1-CG2 3.89Å
69	R	94	Very high	89.9	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-38.6	175.5	-75.5	169.4	173.8	179.2	2.2	111.5	N40 F44 C63 Q66 P67 R72 I73 L314 D318 Y358	N40-R69 PolarHBondContact ND2-NH2 3.44Å; F44-R69 VanDerWaalsContact CZ-CZ 3.47Å; C63-R69 HydrophobicContact CB-CB 4.21Å; Q66-R69 HydrophobicContact CB-CB 4.18Å; Q66-R69 PolarHBondContact O-N 2.68Å; P67-R69 PolarHBondContact O-N 3.3Å; R69-R72 CarbonylContact O-C 3.1Å; R69-R72 WeakPolarHBondContact O-CA 3.2Å; R69-R72 WeakPolarHBondContact O-CB 3.43Å; R69-R72 PolarHBondContact O-N 3.15Å; R69-I73 WeakPolarHBondContact O-CG1 3.31Å; R69-I73 PolarHBondContact O-N 2.92Å; R69-L314 HydrophobicContact CB-CD2 4.12Å; R69-L314 HydrophobicContact CG-CD2 4.21Å; R69-D318 IonicContact CZ-OD2 3.97Å; R69-D318 IonicContact NE-OD1 3.44Å; R69-D318 IonicContact NE-OD2 3.43Å; R69-D318 PolarHBondContact NE-OD2 3.34Å; R69-D318 IonicContact NH2-OD2 2.89Å; R69-D318 PolarHBondContact NH2-OD2 3.05Å; R69-Y358 HydrophobicContact CG-CE1 3.89Å; R69-Y358 WeakPolarHBondContact CG-OH 3.44Å
70	L	93.5	Very high	89.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-47.5	173.6	-66.3	175.5	0	0	0	111.7	L60 C63 Q66 P67 R72 I73 V74 F148 I153 P156 F170 Y174	L60-L70 HydrophobicContact CD2-CD2 4.16Å; C63-L70 HydrophobicContact CB-CD2 3.87Å; C63-L70 HydrophobicContact CB-CG 4.33Å; C63-L70 WeakPolarHBondContact O-CG 3.4Å; Q66-L70 PolarHBondContact O-N 3.06Å; P67-L70 PolarHBondContact O-N 3.33Å; L70-R72 PolarHBondContact O-N 3.09Å; L70-I73 PolarHBondContact O-N 3.33Å; L70-V74 PolarHBondContact O-N 3.38Å; L70-F148 HydrophobicContact CD2-CE1 4.17Å; L70-F148 HydrophobicContact CD2-CZ 4.24Å; L70-I153 HydrophobicContact CD1-CG2 3.69Å; L70-I153 HydrophobicContact CD2-CG2 4.17Å; L70-P156 HydrophobicContact CB-CG 3.99Å; L70-F170 HydrophobicContact CB-CZ 4.48Å; L70-Y174 VanDerWaalsContact CD1-OH 3.31Å; L70-Y174 WeakPolarHBondContact CD1-OH 3.3Å
71	C	91.4	Very high	87.9	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-55.9	-39.1	172.3	-68.3	0	0	0	0	111.5	P67 V74 K75 P156 Y182	P67-C71 PolarHBondContact O-N 2.89Å; P67-C71 PolarHBondContact O-SG 3.1Å; C71-V74 PolarHBondContact O-N 3.45Å; C71-K75 WeakPolarHBondContact O-CG 3.44Å; C71-K75 PolarHBondContact O-N 2.89Å; C71-P156 HydrophobicContact CB-CB 4.46Å; C71-Y182 HydrophobicContact CB-CE2 4.03Å
72	R	92	Very high	86.7	Confident	20 Å²	20	28.1 Å²	28.1	8%	0.075	14%	0.143	C	C	.	.	H	α-helix	trans	-68.3	-39.5	178.6	-172.2	175.3	-59.1	122.5	10	112.5	I68 R69 L70 V74 K75 Y76 Y313 L314 D318 D321	I68-R72 WeakPolarHBondContact O-CB 3.47Å; I68-R72 PolarHBondContact O-N 3.49Å; R69-R72 CarbonylContact O-C 3.1Å; R69-R72 WeakPolarHBondContact O-CA 3.2Å; R69-R72 WeakPolarHBondContact O-CB 3.43Å; R69-R72 PolarHBondContact O-N 3.15Å; L70-R72 PolarHBondContact O-N 3.09Å; R72-V74 VanDerWaalsContact C-N 3.34Å; R72-K75 PolarHBondContact O-N 3.29Å; R72-Y76 PolarHBondContact O-N 3.39Å; R72-Y313 HydrophobicContact CG-CD1 3.91Å; R72-Y313 HydrophobicContact CG-CE1 3.36Å; R72-L314 HydrophobicContact CB-CD2 4.02Å; R72-L314 HydrophobicContact CG-CD2 3.97Å; R72-D318 IonicContact CZ-OD1 3.62Å; R72-D318 IonicContact NH1-OD1 2.66Å; R72-D318 PolarHBondContact NH1-OD1 3.22Å; R72-D321 IonicContact CZ-OD1 2.71Å; R72-D321 IonicContact CZ-OD2 2.86Å; R72-D321 IonicContact NH2-OD1 3.35Å; R72-D321 PolarHBondContact NH2-OD1 2.98Å; R72-D321 IonicContact NH2-OD2 3.58Å; R72-D321 PolarHBondContact NH2-OD2 2.94Å
73	I	92.1	Very high	85.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-45.6	173.7	-65.2	171.7	0	0	0	110	L56 L60 C63 R69 L70 K75 Y76 F77 L144 I310 L314	L56-I73 HydrophobicContact CD1-CG2 4.1Å; L60-I73 HydrophobicContact CD2-CD1 3.92Å; L60-I73 HydrophobicContact CD2-CG2 4.14Å; C63-I73 HydrophobicContact CB-CD1 4.4Å; R69-I73 WeakPolarHBondContact O-CG1 3.31Å; R69-I73 PolarHBondContact O-N 2.92Å; L70-I73 PolarHBondContact O-N 3.33Å; I73-K75 VanDerWaalsContact C-N 3.34Å; I73-K75 PolarHBondContact O-N 2.99Å; I73-Y76 WeakPolarHBondContact O-CB 3.3Å; I73-Y76 PolarHBondContact O-N 3.37Å; I73-F77 HydrophobicContact CG2-CD2 4.14Å; I73-F77 HydrophobicContact CG2-CE2 4.04Å; I73-F77 WeakPolarHBondContact O-CD2 3.35Å; I73-F77 PolarHBondContact O-N 3.38Å; I73-L144 HydrophobicContact CG2-CD1 4.14Å; I73-I310 HydrophobicContact CG1-CG2 4.07Å; I73-L314 HydrophobicContact CD1-CD1 4.31Å; I73-L314 HydrophobicContact CG1-CD1 4.3Å; I73-L314 HydrophobicContact CG1-CD2 3.99Å
74	V	89.6	Confident	84.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-47.2	175.2	173.9	0	0	0	0	111.1	L70 C71 R72 Y76 F77 Q78 W141 L144 F148 L155 P156	L70-V74 PolarHBondContact O-N 3.38Å; C71-V74 PolarHBondContact O-N 3.45Å; R72-V74 VanDerWaalsContact C-N 3.34Å; V74-Y76 VanDerWaalsContact C-N 3.29Å; V74-Y76 PolarHBondContact O-N 3.06Å; V74-F77 PolarHBondContact O-N 3.07Å; V74-Q78 HydrophobicContact CG1-CG 4.4Å; V74-Q78 WeakPolarHBondContact O-CG 3.4Å; V74-Q78 PolarHBondContact O-N 3.48Å; V74-W141 HydrophobicContact CG1-CH2 3.82Å; V74-W141 HydrophobicContact CG1-CZ3 3.87Å; V74-L144 HydrophobicContact CG2-CD2 4.41Å; V74-F148 HydrophobicContact CG2-CE2 4.22Å; V74-F148 HydrophobicContact CG2-CZ 4.02Å; V74-L155 HydrophobicContact CG2-CD1 4.12Å; V74-P156 HydrophobicContact CG2-CB 4.34Å; V74-P156 HydrophobicContact CG2-CG 3.77Å
75	K	86.8	Confident	82.6	Confident	50 Å²	50	32.5 Å²	32.5	22%	0.217	17%	0.168	C	C	.	.	H	α-helix	trans	-59.9	-36.3	177.1	-75.4	-178.7	-177.4	-179.4	0	113.3	C71 R72 I73 Q78 T79 H158 Y182	C71-K75 WeakPolarHBondContact O-CG 3.44Å; C71-K75 PolarHBondContact O-N 2.89Å; R72-K75 PolarHBondContact O-N 3.29Å; I73-K75 VanDerWaalsContact C-N 3.34Å; I73-K75 PolarHBondContact O-N 2.99Å; K75-Q78 PolarHBondContact O-N 2.71Å; K75-T79 WeakPolarHBondContact O-CB 3.47Å; K75-T79 PolarHBondContact O-N 2.6Å; K75-T79 PolarHBondContact O-OG1 2.96Å; K75-H158 WeakPolarHBondContact CE-NE2 3.41Å; K75-Y182 VanDerWaalsContact CE-OH 3.29Å; K75-Y182 WeakPolarHBondContact CE-OH 3.43Å; K75-Y182 PolarHBondContact NZ-OH 3.45Å
76	Y	88.2	Confident	81.3	Confident	23 Å²	23	32.2 Å²	32.2	9%	0.09	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-51	176	176.9	-97.2	0	0	0	111.2	R72 I73 V74 T79 I80 I310 Y313	R72-Y76 PolarHBondContact O-N 3.39Å; I73-Y76 WeakPolarHBondContact O-CB 3.3Å; I73-Y76 PolarHBondContact O-N 3.37Å; V74-Y76 VanDerWaalsContact C-N 3.29Å; V74-Y76 PolarHBondContact O-N 3.06Å; Y76-T79 PolarHBondContact O-N 2.85Å; Y76-I80 HydrophobicContact CD1-CD1 3.82Å; Y76-I80 HydrophobicContact CD2-CD1 4.47Å; Y76-I80 HydrophobicContact CE1-CD1 3.23Å; Y76-I80 HydrophobicContact CE1-CG1 4.46Å; Y76-I80 HydrophobicContact CE2-CD1 3.98Å; Y76-I80 HydrophobicContact CG-CD1 4.4Å; Y76-I80 WeakPolarHBondContact O-CG1 3.42Å; Y76-I80 PolarHBondContact O-N 3.16Å; Y76-I310 HydrophobicContact CD1-CD1 4.32Å; Y76-I310 HydrophobicContact CD1-CG1 3.84Å; Y76-I310 HydrophobicContact CE1-CD1 4.1Å; Y76-I310 HydrophobicContact CE1-CG1 3.51Å; Y76-I310 HydrophobicContact CG-CG1 4.49Å; Y76-Y313 AromaticContact CD2-CD1 3.65Å; Y76-Y313 HydrophobicContact CD2-CD1 3.65Å; Y76-Y313 HydrophobicContact CD2-CD2 4.01Å; Y76-Y313 HydrophobicContact CD2-CE1 4.01Å; Y76-Y313 HydrophobicContact CD2-CE2 4.34Å; Y76-Y313 AromaticContact CD2-CG 3.65Å; Y76-Y313 HydrophobicContact CD2-CG 3.65Å; Y76-Y313 HydrophobicContact CE2-CG 4.25Å; Y76-Y313 HydrophobicContact CG-CD1 4.13Å; Y76-Y313 HydrophobicContact CG-CE1 4.3Å
77	F	83.9	Confident	79.7	Confident	6 Å²	6	37.6 Å²	37.6	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-36.8	179.1	-78.4	-79.2	0	0	0	112.7	L56 I73 V74 I80 Y81 N140 L144 I310	L56-F77 HydrophobicContact CD1-CE2 3.84Å; L56-F77 HydrophobicContact CD1-CZ 4.18Å; L56-F77 HydrophobicContact CD2-CE2 4Å; L56-F77 HydrophobicContact CD2-CZ 3.71Å; I73-F77 HydrophobicContact CG2-CD2 4.14Å; I73-F77 HydrophobicContact CG2-CE2 4.04Å; I73-F77 WeakPolarHBondContact O-CD2 3.35Å; I73-F77 PolarHBondContact O-N 3.38Å; V74-F77 PolarHBondContact O-N 3.07Å; F77-I80 PolarHBondContact O-N 3.23Å; F77-Y81 WeakPolarHBondContact O-CB 3.45Å; F77-Y81 PolarHBondContact O-N 3.41Å; F77-N140 HydrophobicContact CD1-CB 4.07Å; F77-N140 HydrophobicContact CE1-CB 4.35Å; F77-L144 HydrophobicContact CB-CD2 3.95Å; F77-L144 HydrophobicContact CD2-CD1 3.78Å; F77-L144 HydrophobicContact CD2-CD2 3.71Å; F77-L144 HydrophobicContact CD2-CG 4.27Å; F77-L144 HydrophobicContact CE2-CD1 3.79Å; F77-L144 HydrophobicContact CG-CD2 3.96Å; F77-I310 HydrophobicContact CE2-CD1 3.82Å; F77-I310 HydrophobicContact CZ-CD1 3.85Å
78	Q	79.5	Confident	78	Confident	40 Å²	40	42.6 Å²	42.6	19%	0.187	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-43.9	172.9	-71.8	176	-29	0	0	111.7	V74 K75 Y81 I82 W141	V74-Q78 HydrophobicContact CG1-CG 4.4Å; V74-Q78 WeakPolarHBondContact O-CG 3.4Å; V74-Q78 PolarHBondContact O-N 3.48Å; K75-Q78 PolarHBondContact O-N 2.71Å; Q78-Y81 WeakPolarHBondContact O-CB 3.43Å; Q78-Y81 PolarHBondContact O-N 2.82Å; Q78-I82 WeakPolarHBondContact O-CD1 3.26Å; Q78-I82 VanDerWaalsContact O-CG1 3.31Å; Q78-I82 WeakPolarHBondContact O-CG1 3.41Å; Q78-I82 PolarHBondContact O-N 3.41Å; Q78-W141 HydrophobicContact CG-CZ3 3.93Å
79	T	78.3	Confident	76	Confident	65 Å²	65	46.1 Å²	46.1	40%	0.399	23%	0.232	S	C	.	.	H	α-helix	trans	-65.8	-43	179.9	-58.9	0	0	0	0	111.3	K75 Y76 Y81 I82 H83	K75-T79 WeakPolarHBondContact O-CB 3.47Å; K75-T79 PolarHBondContact O-N 2.6Å; K75-T79 PolarHBondContact O-OG1 2.96Å; Y76-T79 PolarHBondContact O-N 2.85Å; T79-Y81 VanDerWaalsContact C-N 3.34Å; T79-I82 PolarHBondContact O-N 3.39Å; T79-H83 VanDerWaalsContact O-CB 3.32Å; T79-H83 WeakPolarHBondContact O-CB 3.23Å; T79-H83 PolarHBondContact O-N 3.4Å
80	I	76.9	Confident	73.7	Confident	58 Å²	58	53.1 Å²	53.1	30%	0.297	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-43.6	175.5	-70.7	175.9	0	0	0	110.7	Y76 F77 I82 H83 S84	Y76-I80 HydrophobicContact CD1-CD1 3.82Å; Y76-I80 HydrophobicContact CD2-CD1 4.47Å; Y76-I80 HydrophobicContact CE1-CD1 3.23Å; Y76-I80 HydrophobicContact CE1-CG1 4.46Å; Y76-I80 HydrophobicContact CE2-CD1 3.98Å; Y76-I80 HydrophobicContact CG-CD1 4.4Å; Y76-I80 WeakPolarHBondContact O-CG1 3.42Å; Y76-I80 PolarHBondContact O-N 3.16Å; F77-I80 PolarHBondContact O-N 3.23Å; I80-I82 PolarHBondContact O-N 3.38Å; I80-H83 PolarHBondContact O-N 3.44Å; I80-S84 WeakPolarHBondContact O-CB 3.32Å; I80-S84 PolarHBondContact O-N 2.94Å; I80-S84 PolarHBondContact O-OG 3.48Å
81	Y	68.6	Low	71.5	Confident	55 Å²	55	62 Å²	62	22%	0.216	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-50.6	177.3	172	-123.8	0	0	0	111.9	F77 Q78 T79 H83 S84 F85 N138	F77-Y81 WeakPolarHBondContact O-CB 3.45Å; F77-Y81 PolarHBondContact O-N 3.41Å; Q78-Y81 WeakPolarHBondContact O-CB 3.43Å; Q78-Y81 PolarHBondContact O-N 2.82Å; T79-Y81 VanDerWaalsContact C-N 3.34Å; Y81-H83 VanDerWaalsContact C-N 3.32Å; Y81-H83 PolarHBondContact O-N 2.83Å; Y81-S84 PolarHBondContact O-N 3.32Å; Y81-F85 WeakPolarHBondContact O-CB 3.3Å; Y81-F85 PolarHBondContact O-N 3Å; Y81-N138 WeakPolarHBondContact CB-ND2 3.32Å; Y81-N138 HydrophobicContact CD2-CB 3.91Å; Y81-N138 WeakPolarHBondContact CD2-ND2 3.5Å; Y81-N138 HydrophobicContact CE2-CB 3.91Å
82	I	65.9	Low	69.3	Low	38 Å²	38	68.8 Å²	68.8	20%	0.195	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-44.5	179.5	-68.4	161.4	0	0	0	110.4	Q78 T79 I80 S84 F85 I86 L102 Y106	Q78-I82 WeakPolarHBondContact O-CD1 3.26Å; Q78-I82 VanDerWaalsContact O-CG1 3.31Å; Q78-I82 WeakPolarHBondContact O-CG1 3.41Å; Q78-I82 PolarHBondContact O-N 3.41Å; T79-I82 PolarHBondContact O-N 3.39Å; I80-I82 PolarHBondContact O-N 3.38Å; I82-S84 PolarHBondContact O-N 2.95Å; I82-F85 WeakPolarHBondContact O-CB 3.34Å; I82-F85 PolarHBondContact O-N 2.99Å; I82-I86 HydrophobicContact CG2-CD1 3.74Å; I82-I86 HydrophobicContact CG2-CG1 4.39Å; I82-I86 VanDerWaalsContact O-CG1 3.28Å; I82-I86 WeakPolarHBondContact O-CG1 3.49Å; I82-I86 PolarHBondContact O-N 2.78Å; I82-L102 HydrophobicContact CG1-CD2 4.39Å; I82-L102 HydrophobicContact CG2-CD2 3.95Å; I82-Y106 HydrophobicContact CD1-CE2 3.61Å; I82-Y106 VanDerWaalsContact CD1-OH 3.22Å; I82-Y106 WeakPolarHBondContact CD1-OH 3.37Å
83	H	68.6	Low	67.1	Low	102 Å²	102	75.1 Å²	75.1	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-65.9	-38.2	179.4	-179.2	-94	0	0	0	112.6	T79 I80 Y81 K87	T79-H83 VanDerWaalsContact O-CB 3.32Å; T79-H83 WeakPolarHBondContact O-CB 3.23Å; T79-H83 PolarHBondContact O-N 3.4Å; I80-H83 PolarHBondContact O-N 3.44Å; Y81-H83 VanDerWaalsContact C-N 3.32Å; Y81-H83 PolarHBondContact O-N 2.83Å; H83-K87 WeakPolarHBondContact CE1-CE 3.24Å; H83-K87 PolarHBondContact CE1-NZ 3.05Å; H83-K87 WeakPolarHBondContact O-CG 3.26Å; H83-K87 PolarHBondContact O-N 3.31Å; H83-K87 VanDerWaalsContact O-N 3.12Å
84	S	64.5	Low	64.7	Low	57 Å²	57	77 Å²	77	40%	0.399	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-41.8	172.4	-71.6	0	0	0	0	111.6	I80 Y81 I82 K87 T88	I80-S84 WeakPolarHBondContact O-CB 3.32Å; I80-S84 PolarHBondContact O-N 2.94Å; I80-S84 PolarHBondContact O-OG 3.48Å; Y81-S84 PolarHBondContact O-N 3.32Å; I82-S84 PolarHBondContact O-N 2.95Å; S84-K87 PolarHBondContact O-N 3.15Å; S84-T88 WeakPolarHBondContact O-CG2 3.42Å; S84-T88 PolarHBondContact O-N 3.12Å; S84-T88 PolarHBondContact O-OG1 3.07Å
85	F	56.9	Low	62.8	Low	50 Å²	50	83.2 Å²	83.2	22%	0.219	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-45.6	177.4	-179	-91.3	0	0	0	112.3	Y81 I82 K87 T88 N89 M94 F133	Y81-F85 WeakPolarHBondContact O-CB 3.3Å; Y81-F85 PolarHBondContact O-N 3Å; I82-F85 WeakPolarHBondContact O-CB 3.34Å; I82-F85 PolarHBondContact O-N 2.99Å; F85-K87 PolarHBondContact O-N 2.86Å; F85-T88 WeakPolarHBondContact CA-OG1 3.28Å; F85-T88 PolarHBondContact O-N 3.48Å; F85-T88 PolarHBondContact O-OG1 3.4Å; F85-T88 VanDerWaalsContact O-OG1 3.04Å; F85-N89 WeakPolarHBondContact CE1-ND2 3.28Å; F85-N89 WeakPolarHBondContact CE2-ND2 3.5Å; F85-N89 WeakPolarHBondContact CZ-ND2 3.33Å; F85-N89 WeakPolarHBondContact O-CB 3.49Å; F85-N89 PolarHBondContact O-N 2.91Å; F85-M94 HydrophobicContact CD1-CE 4.48Å; F85-M94 HydrophobicContact CE1-CE 3.7Å; F85-F133 AromaticContact CE1-CE1 3.97Å; F85-F133 HydrophobicContact CE1-CE1 3.97Å; F85-F133 HydrophobicContact CE1-CZ 4.36Å; F85-F133 HydrophobicContact CE2-CE1 4.31Å; F85-F133 AromaticContact CZ-CE1 3.7Å; F85-F133 HydrophobicContact CZ-CE1 3.7Å; F85-F133 AromaticContact CZ-CZ 3.99Å; F85-F133 HydrophobicContact CZ-CZ 3.99Å
86	I	60	Low	61.1	Low	70 Å²	70	87.4 Å²	87.4	36%	0.359	44%	0.442	S	S	.	.	H	α-helix	trans	-60.8	-37.1	175.7	-67.4	165.8	0	0	0	110.8	I82 N89	I82-I86 HydrophobicContact CG2-CD1 3.74Å; I82-I86 HydrophobicContact CG2-CG1 4.39Å; I82-I86 VanDerWaalsContact O-CG1 3.28Å; I82-I86 WeakPolarHBondContact O-CG1 3.49Å; I82-I86 PolarHBondContact O-N 2.78Å; I86-N89 CarbonylContact O-C 3.59Å
87	K	57.8	Low	59.3	Low	144 Å²	144	93.5 Å²	93.5	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-72	-38.1	177.5	-80.7	-175.4	166.2	-169.9	0	113.7	H83 S84 F85	H83-K87 WeakPolarHBondContact CE1-CE 3.24Å; H83-K87 PolarHBondContact CE1-NZ 3.05Å; H83-K87 WeakPolarHBondContact O-CG 3.26Å; H83-K87 PolarHBondContact O-N 3.31Å; H83-K87 VanDerWaalsContact O-N 3.12Å; S84-K87 PolarHBondContact O-N 3.15Å; F85-K87 PolarHBondContact O-N 2.86Å
88	T	56.8	Low	57.7	Low	106 Å²	106	96.3 Å²	96.3	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-76.8	-32.1	-179.2	52.3	0	0	0	0	112	S84 F85 E90	S84-T88 WeakPolarHBondContact O-CG2 3.42Å; S84-T88 PolarHBondContact O-N 3.12Å; S84-T88 PolarHBondContact O-OG1 3.07Å; F85-T88 WeakPolarHBondContact CA-OG1 3.28Å; F85-T88 PolarHBondContact O-N 3.48Å; F85-T88 PolarHBondContact O-OG1 3.4Å; F85-T88 VanDerWaalsContact O-OG1 3.04Å; T88-E90 PolarHBondContact O-N 2.82Å
89	N	51.6	Low	56	Low	78 Å²	78	98.4 Å²	98.4	42%	0.417	49%	0.491	S	S	.	.	S	Bend	trans	-101.7	61.5	177.6	-60.5	-4	0	0	0	108.4	F85 I86 F91	F85-N89 WeakPolarHBondContact CE1-ND2 3.28Å; F85-N89 WeakPolarHBondContact CE2-ND2 3.5Å; F85-N89 WeakPolarHBondContact CZ-ND2 3.33Å; F85-N89 WeakPolarHBondContact O-CB 3.49Å; F85-N89 PolarHBondContact O-N 2.91Å; I86-N89 CarbonylContact O-C 3.59Å; N89-F91 PolarHBondContact O-N 3.37Å
90	E	45.4	Very low	54.5	Low	151 Å²	151	99 Å²	99	71%	0.706	49%	0.494	S	S	*	.			trans	-31.5	142.2	170.7	-77.5	-176.4	149.2	0	0	110.9	T88 D92	T88-E90 PolarHBondContact O-N 2.82Å; E90-D92 PolarHBondContact O-N 2.94Å
91	F	47.6	Very low	53.2	Low	188 Å²	188	98.7 Å²	98.7	83%	0.825	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-33	-6.1	-170.5	-90.1	-90.7	0	0	0	119.9	N89 L93	N89-F91 PolarHBondContact O-N 3.37Å; F91-L93 PolarHBondContact O-N 3.01Å
92	D	44	Very low	52	Low	143 Å²	143	97.3 Å²	97.3	77%	0.765	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.2	-174.7	-76.1	-20.4	0	0	0	116.5	E90	E90-D92 PolarHBondContact O-N 2.94Å
93	L	45.3	Very low	50.9	Low	153 Å²	153	99.1 Å²	99.1	80%	0.801	50%	0.503	S	S	*	.	S	Bend	trans	-143.8	11	-179.2	-122.4	105	0	0	0	117.4	F91 N95	F91-L93 PolarHBondContact O-N 3.01Å; L93-N95 PolarHBondContact O-N 3.22Å
94	M	43.3	Very low	49.7	Very low	41 Å²	41	99.6 Å²	99.6	20%	0.202	51%	0.505	C	S	.	.			trans	-91.2	97.8	166.1	-85.4	-151.8	155	0	0	110.2	F85 N96 Q98 F99 L102	F85-M94 HydrophobicContact CD1-CE 4.48Å; F85-M94 HydrophobicContact CE1-CE 3.7Å; M94-N96 PolarHBondContact O-N 3.48Å; M94-Q98 HydrophobicContact CE-CB 4.08Å; M94-Q98 HydrophobicContact CG-CB 4.3Å; M94-Q98 HydrophobicContact SD-CB 4.29Å; M94-F99 HydrophobicContact SD-CB 4.39Å; M94-F99 HydrophobicContact SD-CD2 4.35Å; M94-L102 HydrophobicContact CE-CD1 3.09Å; M94-L102 HydrophobicContact SD-CD1 3.83Å
95	N	49.9	Very low	48.7	Very low	130 Å²	130	101 Å²	101	70%	0.695	51%	0.505	S	S	*	.			trans	-51.7	138.1	162.8	-104.3	-22.7	0	0	0	108.5	L93 K97 Q98 F99	L93-N95 PolarHBondContact O-N 3.22Å; N95-K97 CarbonylContact O-C 3.58Å; N95-K97 PolarHBondContact O-N 2.71Å; N95-Q98 PolarHBondContact O-N 3.35Å; N95-F99 PolarHBondContact O-N 3.2Å
96	N	49.8	Very low	47.9	Very low	137 Å²	137	103.2 Å²	103.2	73%	0.733	51%	0.513	S	S	*	.	H	α-helix	trans	-44.6	-28.7	-177.8	-81.8	-31.5	0	0	0	113.9	M94 T100	M94-N96 PolarHBondContact O-N 3.48Å; N96-T100 WeakPolarHBondContact O-CB 3.31Å; N96-T100 PolarHBondContact O-N 2.9Å; N96-T100 PolarHBondContact O-OG1 3.3Å
97	K	51.9	Low	47	Very low	152 Å²	152	103.7 Å²	103.7	66%	0.661	52%	0.519	S	S	*	.	H	α-helix	trans	-65.2	-38.9	174.1	-69.1	-175.9	177.9	-176	0	114.9	N95 T100 S101	N95-K97 CarbonylContact O-C 3.58Å; N95-K97 PolarHBondContact O-N 2.71Å; K97-T100 VanDerWaalsContact CA-OG1 3.24Å; K97-T100 WeakPolarHBondContact CA-OG1 3.16Å; K97-T100 PolarHBondContact O-OG1 3.04Å; K97-S101 WeakPolarHBondContact O-CB 3.47Å; K97-S101 PolarHBondContact O-N 2.96Å; K97-S101 PolarHBondContact O-OG 3.5Å
98	Q	49.7	Very low	45.9	Very low	65 Å²	65	99.8 Å²	99.8	30%	0.304	51%	0.508	S	S	.	.	H	α-helix	trans	-74.1	-39.6	177.1	-68.6	-178.9	-7.4	0	0	111.2	M94 N95 S101 L102	M94-Q98 HydrophobicContact CE-CB 4.08Å; M94-Q98 HydrophobicContact CG-CB 4.3Å; M94-Q98 HydrophobicContact SD-CB 4.29Å; N95-Q98 PolarHBondContact O-N 3.35Å; Q98-S101 WeakPolarHBondContact CA-OG 3.33Å; Q98-S101 PolarHBondContact O-N 3.46Å; Q98-S101 PolarHBondContact O-OG 2.93Å; Q98-L102 WeakPolarHBondContact O-CB 3.45Å; Q98-L102 WeakPolarHBondContact O-CD1 3.19Å; Q98-L102 PolarHBondContact O-N 3.25Å
99	F	43.2	Very low	45	Very low	83 Å²	83	98.5 Å²	98.5	36%	0.364	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-43.3	174.5	-169	-107.4	0	0	0	111.2	M94 N95 L102 I103	M94-F99 HydrophobicContact SD-CB 4.39Å; M94-F99 HydrophobicContact SD-CD2 4.35Å; N95-F99 PolarHBondContact O-N 3.2Å; F99-L102 PolarHBondContact O-N 3.2Å; F99-I103 HydrophobicContact CD1-CD1 3.58Å; F99-I103 HydrophobicContact CD1-CG1 4.45Å; F99-I103 HydrophobicContact CE1-CD1 3.14Å; F99-I103 HydrophobicContact CE1-CG1 4.3Å; F99-I103 HydrophobicContact CE2-CD1 4.25Å; F99-I103 HydrophobicContact CG-CD1 4.31Å; F99-I103 HydrophobicContact CZ-CD1 3.53Å; F99-I103 HydrophobicContact CZ-CG1 4.48Å; F99-I103 WeakPolarHBondContact O-CB 3.42Å; F99-I103 VanDerWaalsContact O-CG1 3.32Å; F99-I103 WeakPolarHBondContact O-CG1 3.39Å; F99-I103 PolarHBondContact O-N 3.48Å
100	T	46.6	Very low	44.2	Very low	77 Å²	77	101.5 Å²	101.5	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-40	172.1	39.9	0	0	0	0	111.7	N96 K97 L102 I103 H104	N96-T100 WeakPolarHBondContact O-CB 3.31Å; N96-T100 PolarHBondContact O-N 2.9Å; N96-T100 PolarHBondContact O-OG1 3.3Å; K97-T100 VanDerWaalsContact CA-OG1 3.24Å; K97-T100 WeakPolarHBondContact CA-OG1 3.16Å; K97-T100 PolarHBondContact O-OG1 3.04Å; T100-L102 PolarHBondContact O-N 2.96Å; T100-I103 PolarHBondContact O-N 3.34Å; T100-H104 WeakPolarHBondContact O-CA 3.42Å; T100-H104 WeakPolarHBondContact O-CB 3.41Å; T100-H104 PolarHBondContact O-N 3.06Å
101	S	50.5	Low	43.5	Very low	52 Å²	52	101 Å²	101	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-62.1	-42.5	175.5	67.6	0	0	0	0	112.1	K97 Q98 I103 H104 E105	K97-S101 WeakPolarHBondContact O-CB 3.47Å; K97-S101 PolarHBondContact O-N 2.96Å; K97-S101 PolarHBondContact O-OG 3.5Å; Q98-S101 WeakPolarHBondContact CA-OG 3.33Å; Q98-S101 PolarHBondContact O-N 3.46Å; Q98-S101 PolarHBondContact O-OG 2.93Å; S101-I103 PolarHBondContact O-N 3.39Å; S101-H104 PolarHBondContact O-N 3.32Å; S101-E105 WeakPolarHBondContact O-CB 3.49Å; S101-E105 PolarHBondContact O-N 3.08Å
102	L	42.4	Very low	42.7	Very low	26 Å²	26	96.9 Å²	96.9	14%	0.136	52%	0.519	C	S	.	.	H	α-helix	trans	-62.8	-38.2	174.3	-95.3	142.6	0	0	0	112.9	I82 M94 Q98 F99 T100 Y106	I82-L102 HydrophobicContact CG1-CD2 4.39Å; I82-L102 HydrophobicContact CG2-CD2 3.95Å; M94-L102 HydrophobicContact CE-CD1 3.09Å; M94-L102 HydrophobicContact SD-CD1 3.83Å; Q98-L102 WeakPolarHBondContact O-CB 3.45Å; Q98-L102 WeakPolarHBondContact O-CD1 3.19Å; Q98-L102 PolarHBondContact O-N 3.25Å; F99-L102 PolarHBondContact O-N 3.2Å; T100-L102 PolarHBondContact O-N 2.96Å; L102-Y106 VanDerWaalsContact O-CD2 3.3Å; L102-Y106 WeakPolarHBondContact O-CD2 3.45Å
103	I	44	Very low	42.2	Very low	76 Å²	76	97.8 Å²	97.8	39%	0.39	52%	0.524	S	S	.	.	H	α-helix	trans	-76.5	-41.7	177.2	-70.3	-178.8	0	0	0	111.5	F99 T100 S101 E105 Y106 T107	F99-I103 HydrophobicContact CD1-CD1 3.58Å; F99-I103 HydrophobicContact CD1-CG1 4.45Å; F99-I103 HydrophobicContact CE1-CD1 3.14Å; F99-I103 HydrophobicContact CE1-CG1 4.3Å; F99-I103 HydrophobicContact CE2-CD1 4.25Å; F99-I103 HydrophobicContact CG-CD1 4.31Å; F99-I103 HydrophobicContact CZ-CD1 3.53Å; F99-I103 HydrophobicContact CZ-CG1 4.48Å; F99-I103 WeakPolarHBondContact O-CB 3.42Å; F99-I103 VanDerWaalsContact O-CG1 3.32Å; F99-I103 WeakPolarHBondContact O-CG1 3.39Å; F99-I103 PolarHBondContact O-N 3.48Å; T100-I103 PolarHBondContact O-N 3.34Å; S101-I103 PolarHBondContact O-N 3.39Å; I103-E105 VanDerWaalsContact C-N 3.33Å; I103-Y106 CarbonylContact O-C 3.58Å; I103-Y106 WeakPolarHBondContact O-CA 3.41Å; I103-Y106 VanDerWaalsContact O-CB 3.31Å; I103-Y106 WeakPolarHBondContact O-CB 3.25Å; I103-Y106 PolarHBondContact O-N 3.31Å; I103-T107 HydrophobicContact CG2-CG2 4.25Å; I103-T107 PolarHBondContact O-N 2.84Å; I103-T107 PolarHBondContact O-OG1 3.25Å
104	H	43.5	Very low	41.6	Very low	113 Å²	113	98.2 Å²	98.2	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-32.3	-178	-147.3	-78.3	0	0	0	110.8	T100 S101 Y106 T107 T108	T100-H104 WeakPolarHBondContact O-CA 3.42Å; T100-H104 WeakPolarHBondContact O-CB 3.41Å; T100-H104 PolarHBondContact O-N 3.06Å; S101-H104 PolarHBondContact O-N 3.32Å; H104-Y106 PolarHBondContact O-N 3.3Å; H104-T107 WeakPolarHBondContact CA-OG1 3.27Å; H104-T107 PolarHBondContact O-N 2.74Å; H104-T108 WeakPolarHBondContact CE1-CG2 3.22Å; H104-T108 PolarHBondContact CE1-OG1 2.93Å; H104-T108 PolarHBondContact ND1-OG1 3.43Å; H104-T108 PolarHBondContact O-N 2.88Å; H104-T108 PolarHBondContact O-OG1 3.48Å
105	E	42.3	Very low	41.2	Very low	85 Å²	85	104 Å²	104	40%	0.397	55%	0.553	S	S	.	*	H	α-helix	trans	-61.5	-29.9	167.8	-169.7	174.6	-159.4	0	0	111.9	S101 I103 N109 H160	S101-E105 WeakPolarHBondContact O-CB 3.49Å; S101-E105 PolarHBondContact O-N 3.08Å; I103-E105 VanDerWaalsContact C-N 3.33Å; E105-N109 PolarHBondContact O-ND2 3.42Å; E105-N109 VanDerWaalsContact O-ND2 3.07Å; E105-H160 VanDerWaalsContact CG-NE2 3.29Å; E105-H160 WeakPolarHBondContact CG-NE2 3.48Å; E105-H160 IonicContact OE1-CD2 2.9Å; E105-H160 PolarHBondContact OE1-CD2 3.31Å; E105-H160 IonicContact OE1-NE2 3.95Å; E105-H160 PolarHBondContact OE1-NE2 3.28Å
106	Y	41.4	Very low	40.4	Very low	98 Å²	98	104.4 Å²	104.4	38%	0.384	56%	0.555	S	S	.	*	H	α-helix	trans	-89	-25.9	176.9	-93.4	-98.4	0	0	0	114.8	I82 L102 I103 H104	I82-Y106 HydrophobicContact CD1-CE2 3.61Å; I82-Y106 VanDerWaalsContact CD1-OH 3.22Å; I82-Y106 WeakPolarHBondContact CD1-OH 3.37Å; L102-Y106 VanDerWaalsContact O-CD2 3.3Å; L102-Y106 WeakPolarHBondContact O-CD2 3.45Å; I103-Y106 CarbonylContact O-C 3.58Å; I103-Y106 WeakPolarHBondContact O-CA 3.41Å; I103-Y106 VanDerWaalsContact O-CB 3.31Å; I103-Y106 WeakPolarHBondContact O-CB 3.25Å; I103-Y106 PolarHBondContact O-N 3.31Å; H104-Y106 PolarHBondContact O-N 3.3Å
107	T	40.4	Very low	39.7	Very low	79 Å²	79	105.7 Å²	105.7	49%	0.485	56%	0.562	S	S	.	*	H	α-helix	trans	-106.9	-18.6	-175	51.4	0	0	0	0	114.6	I103 H104	I103-T107 HydrophobicContact CG2-CG2 4.25Å; I103-T107 PolarHBondContact O-N 2.84Å; I103-T107 PolarHBondContact O-OG1 3.25Å; H104-T107 WeakPolarHBondContact CA-OG1 3.27Å; H104-T107 PolarHBondContact O-N 2.74Å
108	T	33.6	Very low	38.7	Very low	63 Å²	63	102.2 Å²	102.2	39%	0.387	57%	0.57	S	S	.	*			trans	-125.7	97.8	-178	65.9	0	0	0	0	111.9	H104	H104-T108 WeakPolarHBondContact CE1-CG2 3.22Å; H104-T108 PolarHBondContact CE1-OG1 2.93Å; H104-T108 PolarHBondContact ND1-OG1 3.43Å; H104-T108 PolarHBondContact O-N 2.88Å; H104-T108 PolarHBondContact O-OG1 3.48Å
109	N	38.1	Very low	37.8	Very low	79 Å²	79	103.1 Å²	103.1	42%	0.422	60%	0.596	S	S	.	*	S	Bend	trans	-139	107.4	159.4	-74.6	-69.2	0	0	0	107	E105 H160	E105-N109 PolarHBondContact O-ND2 3.42Å; E105-N109 VanDerWaalsContact O-ND2 3.07Å; N109-H160 PolarHBondContact ND2-CE1 3Å; N109-H160 PolarHBondContact ND2-ND1 3.49Å; N109-H160 PolarHBondContact OD1-ND1 3.04Å
110	N	35.7	Very low	37.1	Very low	140 Å²	140	103.3 Å²	103.3	75%	0.749	62%	0.622	S	S	*	*			trans	91.8	60.3	179	-56.9	-19.8	0	0	0	118
111	C	29.8	Very low	36.3	Very low	141 Å²	141	103.6 Å²	103.6	95%	0.953	64%	0.64	S	S	*	*			trans	-116.3	79.3	142.1	-74	0	0	0	0	107.8
112	S	31.4	Very low	35.3	Very low	101 Å²	101	104.7 Å²	104.7	71%	0.706	66%	0.66	S	S	*	*			trans	-126.8	80.3	162.4	63.5	0	0	0	0	106.8
113	N	34.5	Very low	34.9	Very low	162 Å²	162	111.1 Å²	111.1	87%	0.866	69%	0.694	S	S	*	*			trans	-85.6	117.2	148.9	-77.2	-13.2	0	0	0	104.6	D115	N113-D115 PolarHBondContact O-N 3.45Å
114	H	32.6	Very low	34.2	Very low	163 Å²	163	112.8 Å²	112.8	76%	0.755	71%	0.71	S	S	*	*			trans	-42.5	125.1	163.2	-102.7	-66.7	0	0	0	109.7
115	D	34.9	Very low	33.7	Very low	161 Å²	161	113.1 Å²	113.1	86%	0.861	72%	0.715	S	S	*	*			trans	-140.7	117.9	137.7	-77.6	-43	0	0	0	105.9	N113	N113-D115 PolarHBondContact O-N 3.45Å
116	D	32.9	Very low	33	Very low	139 Å²	139	115.6 Å²	115.6	74%	0.743	73%	0.731	S	S	*	*			trans	-58.1	133.1	170.7	-83	-52	0	0	0	110.2
117	D	34.9	Very low	32.6	Very low	164 Å²	164	117.3 Å²	117.3	88%	0.877	75%	0.746	S	S	*	*				169.8	125.8	127.6	-94.8	-28.1	0	0	0	112.9
118	G	30.2	Very low	32.1	Very low	80 Å²	80	121.4 Å²	121.4	83%	0.825	76%	0.757	S	S	*	*			trans	86.6	110.2	132.2	0	0	0	0	0	121.2
119	G	31.5	Very low	32.1	Very low	84 Å²	84	121.7 Å²	121.7	87%	0.866	76%	0.762	S	S	*	*			trans	87.7	121.3	148.3	0	0	0	0	0	115.3
120	G	28.3	Very low	31.8	Very low	87 Å²	87	123.1 Å²	123.1	90%	0.897	77%	0.769	S	S	*	*			cis	100.6	85.8	42.9	0	0	0	0	0	109
121	G	30.2	Very low	31.7	Very low	83 Å²	83	122.9 Å²	122.9	86%	0.856	77%	0.768	S	S	*	*			trans	168.1	93.4	174.6	0	0	0	0	0	116.4
122	G	29.1	Very low	31.8	Very low	75 Å²	75	123.1 Å²	123.1	77%	0.773	76%	0.76	S	S	*	*			trans	50.1	104.9	142.1	0	0	0	0	0	120.5
123	D	33.7	Very low	32.4	Very low	161 Å²	161	122 Å²	122	86%	0.861	74%	0.742	S	S	*	*			trans	-57.8	138.5	164	-113.9	-28.8	0	0	0	112.1
124	P	30.2	Very low	32.8	Very low	111 Å²	111	116.9 Å²	116.9	72%	0.721	72%	0.719	S	S	*	*				-142.5	109	122.3	33.3	-17.4	0	0	0	109.2
125	L	31.9	Very low	33.6	Very low	119 Å²	119	110.3 Å²	110.3	62%	0.623	69%	0.691	S	S	*	*			trans	-173.1	99.3	149.2	-96.4	153.2	0	0	0	110.1	N127	L125-N127 PolarHBondContact O-N 2.82Å; L125-N127 VanDerWaalsContact O-N 3.12Å
126	N	28	Very low	34.3	Very low	138 Å²	138	105.1 Å²	105.1	74%	0.738	67%	0.667	S	S	*	*			trans	-59	108.7	173	-145.4	-13.5	0	0	0	109.5	K128	N126-K128 PolarHBondContact O-N 3.39Å
127	N	32.2	Very low	35	Very low	133 Å²	133	105.7 Å²	105.7	71%	0.711	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	28.9	-172.8	-83.7	-29.3	0	0	0	116.4	L125	L125-N127 PolarHBondContact O-N 2.82Å; L125-N127 VanDerWaalsContact O-N 3.12Å
128	K	29.7	Very low	36.4	Very low	165 Å²	165	99.1 Å²	99.1	72%	0.717	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-18.5	-175.9	-83.6	-177.2	174.3	179.9	0	115.3	N126	N126-K128 PolarHBondContact O-N 3.39Å
129	S	33.4	Very low	38.3	Very low	69 Å²	69	98.3 Å²	98.3	48%	0.483	62%	0.617	S	S	.	*	S	Bend	trans	-91.6	-9.1	-175.5	60.8	0	0	0	0	115.4
130	L	33	Very low	40.2	Very low	109 Å²	109	96 Å²	96	57%	0.571	59%	0.585	S	S	*	*	S	Bend	trans	-90.6	-19.6	178.3	-113.5	90.6	0	0	0	113.8	D132 F133	L130-D132 VanDerWaalsContact C-N 3.3Å; L130-D132 PolarHBondContact O-N 2.99Å; L130-F133 PolarHBondContact O-N 3.38Å
131	N	32.5	Very low	42.4	Very low	136 Å²	136	93.7 Å²	93.7	73%	0.727	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.5	-177.8	-76.7	-17.3	0	0	0	113.9	F133	N131-F133 VanDerWaalsContact C-N 3.32Å
132	D	33.8	Very low	44.6	Very low	145 Å²	145	94 Å²	94	78%	0.775	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-5.8	175.5	-71.8	-24.3	0	0	0	113.2	L130 S134	L130-D132 VanDerWaalsContact C-N 3.3Å; L130-D132 PolarHBondContact O-N 2.99Å; D132-S134 PolarHBondContact O-N 3.44Å
133	F	43.1	Very low	47.1	Very low	77 Å²	77	93.3 Å²	93.3	34%	0.338	51%	0.505	S	S	.	.			trans	-78.4	25	175.8	-82.9	-87.1	0	0	0	113.7	F85 L130 N131 P135	F85-F133 AromaticContact CE1-CE1 3.97Å; F85-F133 HydrophobicContact CE1-CE1 3.97Å; F85-F133 HydrophobicContact CE1-CZ 4.36Å; F85-F133 HydrophobicContact CE2-CE1 4.31Å; F85-F133 AromaticContact CZ-CE1 3.7Å; F85-F133 HydrophobicContact CZ-CE1 3.7Å; F85-F133 AromaticContact CZ-CZ 3.99Å; F85-F133 HydrophobicContact CZ-CZ 3.99Å; L130-F133 PolarHBondContact O-N 3.38Å; N131-F133 VanDerWaalsContact C-N 3.32Å; F133-P135 WeakPolarHBondContact O-CD 3.39Å
134	S	42.5	Very low	49.6	Very low	56 Å²	56	85.7 Å²	85.7	39%	0.392	46%	0.464	S	S	.	.			trans	-68	126.6	174.4	175.9	0	0	0	0	109.5	D132 S136	D132-S134 PolarHBondContact O-N 3.44Å; S134-S136 WeakPolarHBondContact CB-OG 3.37Å; S134-S136 PolarHBondContact O-N 2.92Å; S134-S136 VanDerWaalsContact OG-CB 3.22Å; S134-S136 WeakPolarHBondContact OG-CB 3.37Å; S134-S136 PolarHBondContact OG-N 3.36Å; S134-S136 PolarHBondContact OG-OG 3.27Å
135	P	50.2	Low	52.1	Low	24 Å²	24	82.7 Å²	82.7	16%	0.156	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-56.8	-6.1	171.8	-23.3	33.2	0	0	0	114.1	F133 N137 N138 W141	F133-P135 WeakPolarHBondContact O-CD 3.39Å; P135-N137 PolarHBondContact O-N 3.24Å; P135-N137 VanDerWaalsContact O-N 3.09Å; P135-N138 PolarHBondContact O-N 3.49Å; P135-N138 VanDerWaalsContact O-N 3.12Å; P135-W141 HydrophobicContact CB-CB 4.1Å; P135-W141 VanDerWaalsContact CB-CD1 3.46Å; P135-W141 HydrophobicContact CB-CD2 3.58Å; P135-W141 HydrophobicContact CB-CE3 4.32Å; P135-W141 HydrophobicContact CB-CG 3.43Å; P135-W141 VanDerWaalsContact CB-CG 3.43Å; P135-W141 HydrophobicContact CB-CZ2 4.46Å; P135-W141 HydrophobicContact CG-CD2 4.43Å; P135-W141 WeakPolarHBondContact O-CB 3.48Å; P135-W141 VanDerWaalsContact O-CD1 3.26Å
136	S	48.2	Very low	54.6	Low	52 Å²	52	84.2 Å²	84.2	36%	0.364	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-57.5	-21.9	-173.5	55.3	0	0	0	0	115.4	S134 L142	S134-S136 WeakPolarHBondContact CB-OG 3.37Å; S134-S136 PolarHBondContact O-N 2.92Å; S134-S136 VanDerWaalsContact OG-CB 3.22Å; S134-S136 WeakPolarHBondContact OG-CB 3.37Å; S134-S136 PolarHBondContact OG-N 3.36Å; S134-S136 PolarHBondContact OG-OG 3.27Å; S136-L142 WeakPolarHBondContact O-CD1 3.37Å; S136-L142 VanDerWaalsContact O-CD2 3.29Å; S136-L142 WeakPolarHBondContact O-CD2 3.35Å; S136-L142 WeakPolarHBondContact O-CG 3.38Å
137	N	47.6	Very low	57.4	Low	152 Å²	152	78.7 Å²	78.7	81%	0.813	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-99.4	-0.9	-179.8	-71.2	0.5	0	0	0	114.1	P135	P135-N137 PolarHBondContact O-N 3.24Å; P135-N137 VanDerWaalsContact O-N 3.09Å
138	N	64.9	Low	60.1	Low	26 Å²	26	72.4 Å²	72.4	14%	0.139	38%	0.377	C	S	.	.			trans	-85.2	122.5	176.1	-178	-12.7	0	0	0	110.5	Y81 P135 N140 W141 L142	Y81-N138 WeakPolarHBondContact CB-ND2 3.32Å; Y81-N138 HydrophobicContact CD2-CB 3.91Å; Y81-N138 WeakPolarHBondContact CD2-ND2 3.5Å; Y81-N138 HydrophobicContact CE2-CB 3.91Å; P135-N138 PolarHBondContact O-N 3.49Å; P135-N138 VanDerWaalsContact O-N 3.12Å; N138-N140 PolarHBondContact O-N 3.12Å; N138-N140 VanDerWaalsContact O-N 3.16Å; N138-N140 PolarHBondContact OD1-N 3.34Å; N138-W141 HydrophobicContact CB-CB 4.06Å; N138-W141 PolarHBondContact O-N 3.02Å; N138-L142 PolarHBondContact O-N 3.34Å
139	S	69.6	Low	62.7	Low	62 Å²	62	69.5 Å²	69.5	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-51.5	-38.5	177.3	60.6	0	0	0	0	113	R143 S300	S139-R143 VanDerWaalsContact O-CB 3.31Å; S139-R143 WeakPolarHBondContact O-CB 3.26Å; S139-R143 PolarHBondContact O-N 2.97Å; S139-S300 PolarHBondContact OG-OG 3.37Å
140	N	73.2	Confident	65.4	Low	37 Å²	37	71.7 Å²	71.7	20%	0.198	37%	0.372	C	S	.	.	H	α-helix	trans	-71.7	-36.6	178.7	-71.5	-36.7	0	0	0	112.5	F77 N138 L144	F77-N140 HydrophobicContact CD1-CB 4.07Å; F77-N140 HydrophobicContact CE1-CB 4.35Å; N138-N140 PolarHBondContact O-N 3.12Å; N138-N140 VanDerWaalsContact O-N 3.16Å; N138-N140 PolarHBondContact OD1-N 3.34Å; N140-L144 WeakPolarHBondContact O-CB 3.31Å; N140-L144 PolarHBondContact O-N 3.26Å
141	W	74.7	Confident	68	Low	38 Å²	38	68.1 Å²	68.1	14%	0.144	35%	0.353	C	S	.	.	H	α-helix	trans	-70.8	-42.7	176	-177.2	-99.6	0	0	0	111.4	V74 Q78 P135 N138 R143 L144 N145 L155	V74-W141 HydrophobicContact CG1-CH2 3.82Å; V74-W141 HydrophobicContact CG1-CZ3 3.87Å; Q78-W141 HydrophobicContact CG-CZ3 3.93Å; P135-W141 HydrophobicContact CB-CB 4.1Å; P135-W141 VanDerWaalsContact CB-CD1 3.46Å; P135-W141 HydrophobicContact CB-CD2 3.58Å; P135-W141 HydrophobicContact CB-CE3 4.32Å; P135-W141 HydrophobicContact CB-CG 3.43Å; P135-W141 VanDerWaalsContact CB-CG 3.43Å; P135-W141 HydrophobicContact CB-CZ2 4.46Å; P135-W141 HydrophobicContact CG-CD2 4.43Å; P135-W141 WeakPolarHBondContact O-CB 3.48Å; P135-W141 VanDerWaalsContact O-CD1 3.26Å; N138-W141 HydrophobicContact CB-CB 4.06Å; N138-W141 PolarHBondContact O-N 3.02Å; W141-R143 VanDerWaalsContact C-N 3.33Å; W141-R143 PolarHBondContact O-N 2.89Å; W141-L144 HydrophobicContact CE3-CD2 4.21Å; W141-L144 HydrophobicContact CZ3-CD2 4.13Å; W141-L144 PolarHBondContact O-N 3.37Å; W141-N145 WeakPolarHBondContact O-CB 3.44Å; W141-N145 PolarHBondContact O-N 3.02Å; W141-L155 HydrophobicContact CZ2-CD2 4.07Å
142	L	76	Confident	70.6	Confident	88 Å²	88	66.8 Å²	66.8	46%	0.461	35%	0.354	S	S	.	.	H	α-helix	trans	-58.8	-45.3	173.4	-73.5	172.8	0	0	0	111.2	S136 N138 L144 N145 Y146	S136-L142 WeakPolarHBondContact O-CD1 3.37Å; S136-L142 VanDerWaalsContact O-CD2 3.29Å; S136-L142 WeakPolarHBondContact O-CD2 3.35Å; S136-L142 WeakPolarHBondContact O-CG 3.38Å; N138-L142 PolarHBondContact O-N 3.34Å; L142-L144 PolarHBondContact O-N 2.88Å; L142-N145 PolarHBondContact O-N 3.05Å; L142-Y146 VanDerWaalsContact O-CB 3.25Å; L142-Y146 WeakPolarHBondContact O-CB 3.3Å; L142-Y146 PolarHBondContact O-N 2.99Å
143	R	81.7	Confident	72.9	Confident	62 Å²	62	60.3 Å²	60.3	23%	0.234	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-43.5	175.5	-165.7	-172.1	75.8	-153.3	-1.3	112	S139 W141 L147 E306	S139-R143 VanDerWaalsContact O-CB 3.31Å; S139-R143 WeakPolarHBondContact O-CB 3.26Å; S139-R143 PolarHBondContact O-N 2.97Å; W141-R143 VanDerWaalsContact C-N 3.33Å; W141-R143 PolarHBondContact O-N 2.89Å; R143-L147 HydrophobicContact CG-CD1 4.43Å; R143-L147 WeakPolarHBondContact O-CG 3.31Å; R143-L147 PolarHBondContact O-N 2.87Å; R143-E306 IonicContact CZ-OE1 2.7Å; R143-E306 IonicContact CZ-OE2 3.73Å; R143-E306 IonicContact NH1-OE1 2.86Å; R143-E306 IonicContact NH1-OE2 3.4Å; R143-E306 IonicContact NH2-OE1 3.58Å; R143-E306 PolarHBondContact NH2-OE1 3.04Å; R143-E306 IonicContact NH2-OE2 2.66Å; R143-E306 PolarHBondContact NH2-OE2 3.47Å
144	L	85.1	Confident	74.8	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-51.1	176.8	-172.9	68.3	0	0	0	110.9	L56 I73 V74 F77 N140 W141 L142 Y146 L147 F148	L56-L144 HydrophobicContact CD1-CD1 4.22Å; L56-L144 HydrophobicContact CD2-CD1 3.98Å; I73-L144 HydrophobicContact CG2-CD1 4.14Å; V74-L144 HydrophobicContact CG2-CD2 4.41Å; F77-L144 HydrophobicContact CB-CD2 3.95Å; F77-L144 HydrophobicContact CD2-CD1 3.78Å; F77-L144 HydrophobicContact CD2-CD2 3.71Å; F77-L144 HydrophobicContact CD2-CG 4.27Å; F77-L144 HydrophobicContact CE2-CD1 3.79Å; F77-L144 HydrophobicContact CG-CD2 3.96Å; N140-L144 WeakPolarHBondContact O-CB 3.31Å; N140-L144 PolarHBondContact O-N 3.26Å; W141-L144 HydrophobicContact CE3-CD2 4.21Å; W141-L144 HydrophobicContact CZ3-CD2 4.13Å; W141-L144 PolarHBondContact O-N 3.37Å; L142-L144 PolarHBondContact O-N 2.88Å; L144-Y146 VanDerWaalsContact C-N 3.32Å; L144-Y146 PolarHBondContact O-N 3.2Å; L144-L147 PolarHBondContact O-N 3.05Å; L144-L147 VanDerWaalsContact O-N 3.14Å; L144-F148 HydrophobicContact CD1-CD2 3.96Å; L144-F148 HydrophobicContact CD1-CE2 3.64Å; L144-F148 HydrophobicContact CD2-CE2 4.28Å; L144-F148 HydrophobicContact CG-CD2 3.84Å; L144-F148 HydrophobicContact CG-CE2 3.78Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å; L144-F148 PolarHBondContact O-N 3.44Å
145	N	82.3	Confident	76.6	Confident	47 Å²	47	56.9 Å²	56.9	25%	0.251	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-41.9	-179.9	-167.6	23	0	0	0	111.6	W141 L142 L147 F148 N149	W141-N145 WeakPolarHBondContact O-CB 3.44Å; W141-N145 PolarHBondContact O-N 3.02Å; L142-N145 PolarHBondContact O-N 3.05Å; N145-L147 PolarHBondContact O-N 3.14Å; N145-F148 PolarHBondContact O-N 3.22Å; N145-N149 WeakPolarHBondContact O-CB 3.27Å; N145-N149 VanDerWaalsContact O-CG 3.28Å; N145-N149 PolarHBondContact O-N 3.32Å; N145-N149 PolarHBondContact O-ND2 3.28Å
146	Y	85.7	Confident	78	Confident	152 Å²	152	56 Å²	56	60%	0.596	30%	0.297	S	S	*	.	H	α-helix	trans	-57.7	-47.1	173.2	178.2	-96	0	0	0	111.8	L142 L144 N149 Q150	L142-Y146 VanDerWaalsContact O-CB 3.25Å; L142-Y146 WeakPolarHBondContact O-CB 3.3Å; L142-Y146 PolarHBondContact O-N 2.99Å; L144-Y146 VanDerWaalsContact C-N 3.32Å; L144-Y146 PolarHBondContact O-N 3.2Å; Y146-N149 PolarHBondContact O-N 3.17Å; Y146-Q150 VanDerWaalsContact CE1-OE1 3.23Å; Y146-Q150 VanDerWaalsContact O-CB 3.3Å; Y146-Q150 WeakPolarHBondContact O-CB 3.28Å; Y146-Q150 PolarHBondContact O-N 3.4Å
147	L	87.1	Confident	78.9	Confident	22 Å²	22	58.5 Å²	58.5	12%	0.115	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-41.7	178.7	-72.7	170.1	0	0	0	112.8	L56 N57 L60 R143 L144 N145 N149 Q150 L151	L56-L147 HydrophobicContact CB-CD1 4.35Å; L56-L147 HydrophobicContact CD2-CD1 3.49Å; L56-L147 VanDerWaalsContact CD2-CD1 3.49Å; L56-L147 HydrophobicContact CG-CD1 3.8Å; N57-L147 HydrophobicContact CB-CD2 4.43Å; L60-L147 HydrophobicContact CD1-CB 3.77Å; L60-L147 HydrophobicContact CD1-CD1 4.37Å; R143-L147 HydrophobicContact CG-CD1 4.43Å; R143-L147 WeakPolarHBondContact O-CG 3.31Å; R143-L147 PolarHBondContact O-N 2.87Å; L144-L147 PolarHBondContact O-N 3.05Å; L144-L147 VanDerWaalsContact O-N 3.14Å; N145-L147 PolarHBondContact O-N 3.14Å; L147-N149 VanDerWaalsContact C-N 3.32Å; L147-N149 PolarHBondContact O-N 3.26Å; L147-Q150 PolarHBondContact O-N 2.88Å; L147-L151 VanDerWaalsContact O-CB 3.28Å; L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.48Å; L147-L151 PolarHBondContact O-N 2.86Å
148	F	87.5	Confident	79.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-45.8	174.1	-91.2	-93.1	0	0	0	110.9	L60 L70 V74 L144 N145 L151 S152 I153 L155 P156	L60-F148 HydrophobicContact CD1-CD2 4.33Å; L60-F148 HydrophobicContact CD1-CE2 4.37Å; L60-F148 HydrophobicContact CD2-CD2 4.22Å; L60-F148 HydrophobicContact CD2-CE1 4.32Å; L60-F148 HydrophobicContact CD2-CE2 3.53Å; L60-F148 HydrophobicContact CD2-CZ 3.58Å; L70-F148 HydrophobicContact CD2-CE1 4.17Å; L70-F148 HydrophobicContact CD2-CZ 4.24Å; V74-F148 HydrophobicContact CG2-CE2 4.22Å; V74-F148 HydrophobicContact CG2-CZ 4.02Å; L144-F148 HydrophobicContact CD1-CD2 3.96Å; L144-F148 HydrophobicContact CD1-CE2 3.64Å; L144-F148 HydrophobicContact CD2-CE2 4.28Å; L144-F148 HydrophobicContact CG-CD2 3.84Å; L144-F148 HydrophobicContact CG-CE2 3.78Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å; L144-F148 PolarHBondContact O-N 3.44Å; N145-F148 PolarHBondContact O-N 3.22Å; F148-L151 PolarHBondContact O-N 2.9Å; F148-S152 PolarHBondContact O-N 3.04Å; F148-S152 VanDerWaalsContact O-N 3.12Å; F148-I153 CarbonylContact C-O 3.5Å; F148-I153 HydrophobicContact CD1-CB 3.7Å; F148-I153 HydrophobicContact CD1-CG2 3.5Å; F148-I153 VanDerWaalsContact CD1-CG2 3.5Å; F148-I153 WeakPolarHBondContact CD1-O 3.38Å; F148-I153 HydrophobicContact CE1-CB 4.2Å; F148-I153 HydrophobicContact CE1-CG2 3.51Å; F148-I153 PolarHBondContact O-N 3.04Å; F148-L155 HydrophobicContact CB-CD1 4.17Å; F148-L155 HydrophobicContact CD1-CB 4.49Å; F148-L155 HydrophobicContact CD1-CD1 4.03Å; F148-L155 HydrophobicContact CD2-CD1 3.66Å; F148-L155 HydrophobicContact CE1-CD1 4.34Å; F148-L155 HydrophobicContact CE2-CD1 3.97Å; F148-L155 HydrophobicContact CG-CD1 3.69Å; F148-L155 HydrophobicContact CZ-CD1 4.3Å; F148-P156 HydrophobicContact CE1-CG 4.44Å
149	N	85.7	Confident	78.3	Confident	105 Å²	105	58.5 Å²	58.5	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-64.6	-45.9	176.9	-69.6	-26	0	0	0	112.4	N145 Y146 L147 L151 S152	N145-N149 WeakPolarHBondContact O-CB 3.27Å; N145-N149 VanDerWaalsContact O-CG 3.28Å; N145-N149 PolarHBondContact O-N 3.32Å; N145-N149 PolarHBondContact O-ND2 3.28Å; Y146-N149 PolarHBondContact O-N 3.17Å; L147-N149 VanDerWaalsContact C-N 3.32Å; L147-N149 PolarHBondContact O-N 3.26Å; N149-L151 VanDerWaalsContact C-N 3.3Å; N149-L151 PolarHBondContact O-N 3.41Å; N149-S152 PolarHBondContact O-N 3.32Å
150	Q	89.4	Confident	77.1	Confident	114 Å²	114	59.7 Å²	59.7	53%	0.533	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-40.8	179.1	-176.3	-176.9	0.5	0	0	111.8	Y146 L147 S152	Y146-Q150 VanDerWaalsContact CE1-OE1 3.23Å; Y146-Q150 VanDerWaalsContact O-CB 3.3Å; Y146-Q150 WeakPolarHBondContact O-CB 3.28Å; Y146-Q150 PolarHBondContact O-N 3.4Å; L147-Q150 PolarHBondContact O-N 2.88Å; Q150-S152 PolarHBondContact O-N 3.42Å
151	L	87.2	Confident	75.5	Confident	34 Å²	34	64.2 Å²	64.2	18%	0.178	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.3	178.7	-64.6	179	0	0	0	113.1	N57 L60 L61 L147 F148 N149 I153	N57-L151 WeakPolarHBondContact OD1-CD1 3.36Å; N57-L151 WeakPolarHBondContact OD1-CD2 3.47Å; L60-L151 HydrophobicContact CB-CD1 3.55Å; L60-L151 HydrophobicContact CD1-CD1 4.09Å; L60-L151 HydrophobicContact CG-CD1 4.48Å; L61-L151 HydrophobicContact CD1-CD2 4.31Å; L61-L151 HydrophobicContact CD2-CD1 4.4Å; L61-L151 HydrophobicContact CD2-CD2 3.7Å; L61-L151 HydrophobicContact CG-CD1 4.12Å; L61-L151 HydrophobicContact CG-CD2 3.92Å; L147-L151 VanDerWaalsContact O-CB 3.28Å; L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.48Å; L147-L151 PolarHBondContact O-N 2.86Å; F148-L151 PolarHBondContact O-N 2.9Å; N149-L151 VanDerWaalsContact C-N 3.3Å; N149-L151 PolarHBondContact O-N 3.41Å; L151-I153 HydrophobicContact CB-CD1 3.76Å; L151-I153 HydrophobicContact CB-CG1 3.78Å; L151-I153 HydrophobicContact CD1-CD1 3.87Å; L151-I153 PolarHBondContact O-N 3.25Å; L151-I153 VanDerWaalsContact O-N 3.15Å
152	S	86.7	Confident	74.1	Confident	108 Å²	108	67.7 Å²	67.7	76%	0.755	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	30.3	-172.7	-56.5	0	0	0	0	113.1	F148 N149 Q150	F148-S152 PolarHBondContact O-N 3.04Å; F148-S152 VanDerWaalsContact O-N 3.12Å; N149-S152 PolarHBondContact O-N 3.32Å; Q150-S152 PolarHBondContact O-N 3.42Å
153	I	82.9	Confident	72.7	Confident	9 Å²	9	70.4 Å²	70.4	5%	0.046	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-88.6	125.2	174.7	-58.7	172.2	0	0	0	107.2	L60 Q64 L70 F148 L151 L155	L60-I153 HydrophobicContact CB-CD1 3.96Å; L60-I153 WeakPolarHBondContact O-CD1 3.36Å; Q64-I153 HydrophobicContact CB-CD1 4.13Å; Q64-I153 HydrophobicContact CB-CG1 4.35Å; L70-I153 HydrophobicContact CD1-CG2 3.69Å; L70-I153 HydrophobicContact CD2-CG2 4.17Å; F148-I153 CarbonylContact C-O 3.5Å; F148-I153 HydrophobicContact CD1-CB 3.7Å; F148-I153 HydrophobicContact CD1-CG2 3.5Å; F148-I153 VanDerWaalsContact CD1-CG2 3.5Å; F148-I153 WeakPolarHBondContact CD1-O 3.38Å; F148-I153 HydrophobicContact CE1-CB 4.2Å; F148-I153 HydrophobicContact CE1-CG2 3.51Å; F148-I153 PolarHBondContact O-N 3.04Å; L151-I153 HydrophobicContact CB-CD1 3.76Å; L151-I153 HydrophobicContact CB-CG1 3.78Å; L151-I153 HydrophobicContact CD1-CD1 3.87Å; L151-I153 PolarHBondContact O-N 3.25Å; L151-I153 VanDerWaalsContact O-N 3.15Å; I153-L155 PolarHBondContact O-N 2.89Å
154	P	82.3	Confident	71.2	Confident	43 Å²	43	72.6 Å²	72.6	28%	0.279	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-62.2	126.2	175.6	-15	25.2	0	0	0	110.2	P156 F170 L173	P154-P156 VanDerWaalsContact O-CD 3.28Å; P154-P156 WeakPolarHBondContact O-CD 3.44Å; P154-F170 HydrophobicContact CB-CD2 4.01Å; P154-F170 WeakPolarHBondContact O-CD2 3.25Å; P154-F170 VanDerWaalsContact O-CE2 3.31Å; P154-F170 WeakPolarHBondContact O-CE2 3.23Å; P154-L173 HydrophobicContact CB-CD1 3.6Å; P154-L173 HydrophobicContact CG-CD1 3.1Å; P154-L173 HydrophobicContact CG-CG 4.49Å
155	L	81.7	Confident	69.7	Low	19 Å²	19	75.7 Å²	75.7	10%	0.099	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-68	123.3	177.7	-170.8	71.6	0	0	0	110	V74 W141 F148 I153 Y157	V74-L155 HydrophobicContact CG2-CD1 4.12Å; W141-L155 HydrophobicContact CZ2-CD2 4.07Å; F148-L155 HydrophobicContact CB-CD1 4.17Å; F148-L155 HydrophobicContact CD1-CB 4.49Å; F148-L155 HydrophobicContact CD1-CD1 4.03Å; F148-L155 HydrophobicContact CD2-CD1 3.66Å; F148-L155 HydrophobicContact CE1-CD1 4.34Å; F148-L155 HydrophobicContact CE2-CD1 3.97Å; F148-L155 HydrophobicContact CG-CD1 3.69Å; F148-L155 HydrophobicContact CZ-CD1 4.3Å; I153-L155 PolarHBondContact O-N 2.89Å; L155-Y157 HydrophobicContact CD2-CE2 4.45Å; L155-Y157 PolarHBondContact O-N 3.26Å
156	P	78.8	Confident	68.7	Low	4 Å²	4	76 Å²	76	3%	0.026	39%	0.39	C	S	.	.			trans	-64.6	104.8	169.6	-7.4	16	0	0	0	109.7	L70 C71 V74 F148 P154 H158 F170	L70-P156 HydrophobicContact CB-CG 3.99Å; C71-P156 HydrophobicContact CB-CB 4.46Å; V74-P156 HydrophobicContact CG2-CB 4.34Å; V74-P156 HydrophobicContact CG2-CG 3.77Å; F148-P156 HydrophobicContact CE1-CG 4.44Å; P154-P156 VanDerWaalsContact O-CD 3.28Å; P154-P156 WeakPolarHBondContact O-CD 3.44Å; P156-H158 PolarHBondContact O-N 3.12Å; P156-F170 HydrophobicContact CB-CD1 4.45Å; P156-F170 HydrophobicContact CB-CD2 4.11Å; P156-F170 HydrophobicContact CB-CE1 4.22Å; P156-F170 HydrophobicContact CB-CE2 3.89Å; P156-F170 HydrophobicContact CB-CG 4.41Å; P156-F170 HydrophobicContact CB-CZ 3.94Å; P156-F170 HydrophobicContact CG-CD2 4.2Å; P156-F170 HydrophobicContact CG-CE2 3.58Å; P156-F170 HydrophobicContact CG-CZ 3.76Å
157	Y	66.7	Low	67.8	Low	106 Å²	106	71.1 Å²	71.1	42%	0.416	37%	0.372	S	S	.	.			trans	-75.2	120.8	175.6	-91.2	-86.7	0	0	0	110.7	L155 N166 H167	L155-Y157 HydrophobicContact CD2-CE2 4.45Å; L155-Y157 PolarHBondContact O-N 3.26Å; Y157-N166 HydrophobicContact CD2-CB 4.03Å; Y157-N166 HydrophobicContact CG-CB 4.24Å; Y157-H167 PolarHBondContact O-CD2 3.45Å
158	H	54.4	Low	66.9	Low	49 Å²	49	73.7 Å²	73.7	23%	0.227	39%	0.386	C	S	.	.			trans	-105.6	91.5	162.2	-82.3	-47.6	0	0	0	108.6	K75 P156 Y182	K75-H158 WeakPolarHBondContact CE-NE2 3.41Å; P156-H158 PolarHBondContact O-N 3.12Å; H158-Y182 PolarHBondContact CE1-OH 3.18Å; H158-Y182 PolarHBondContact NE2-OH 2.79Å
159	H	44.7	Very low	66.5	Low	128 Å²	128	78.9 Å²	78.9	59%	0.593	41%	0.409	S	S	*	.			trans	-127.8	136.3	156.6	-89.9	-47.9	0	0	0	109.6	H161	H159-H161 PolarHBondContact O-N 3.24Å
160	H	46.2	Very low	66.5	Low	87 Å²	87	74.1 Å²	74.1	40%	0.403	38%	0.383	S	S	.	.	S	Bend	trans	-69.8	25.2	-162.6	-74.3	-85.6	0	0	0	116	E105 N109	E105-H160 VanDerWaalsContact CG-NE2 3.29Å; E105-H160 WeakPolarHBondContact CG-NE2 3.48Å; E105-H160 IonicContact OE1-CD2 2.9Å; E105-H160 PolarHBondContact OE1-CD2 3.31Å; E105-H160 IonicContact OE1-NE2 3.95Å; E105-H160 PolarHBondContact OE1-NE2 3.28Å; N109-H160 PolarHBondContact ND2-CE1 3Å; N109-H160 PolarHBondContact ND2-ND1 3.49Å; N109-H160 PolarHBondContact OD1-ND1 3.04Å
161	H	38.8	Very low	66.4	Low	133 Å²	133	69 Å²	69	62%	0.616	36%	0.359	S	S	*	.			trans	-114.5	113.3	172.1	-103.5	-75.6	0	0	0	110.7	H159 N163 H164	H159-H161 PolarHBondContact O-N 3.24Å; H161-N163 PolarHBondContact O-N 3.34Å; H161-H164 PolarHBondContact O-N 3Å
162	P	46.3	Very low	66.3	Low	111 Å²	111	74.5 Å²	74.5	72%	0.721	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-6.8	176.8	21.2	-30	0	0	0	114.1
163	N	45.6	Very low	66.3	Low	145 Å²	145	74.8 Å²	74.8	78%	0.775	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	4.2	177	-67.2	-11	0	0	0	114.3	H161 S165	H161-N163 PolarHBondContact O-N 3.34Å; N163-S165 PolarHBondContact O-N 3.33Å
164	H	50.9	Low	66.5	Low	108 Å²	108	76 Å²	76	50%	0.5	38%	0.38	S	S	.	.			trans	-80.3	115.7	177.1	-118.2	-80.3	0	0	0	111.3	H161 N166 H167	H161-H164 PolarHBondContact O-N 3Å; H164-N166 PolarHBondContact O-N 3.46Å; H164-H167 PolarHBondContact O-N 3.28Å
165	S	53.5	Low	66.7	Low	66 Å²	66	79.8 Å²	79.8	46%	0.462	39%	0.392	S	S	.	.	H	α-helix	trans	-50	-26.3	-176.4	59.7	0	0	0	0	114.8	N163 K169	N163-S165 PolarHBondContact O-N 3.33Å; S165-K169 VanDerWaalsContact O-CG 3.28Å; S165-K169 WeakPolarHBondContact O-CG 3.37Å; S165-K169 PolarHBondContact O-N 3.29Å; S165-K169 VanDerWaalsContact O-N 3.08Å
166	N	59.7	Low	66.9	Low	53 Å²	53	84.4 Å²	84.4	28%	0.283	42%	0.423	S	S	.	.	H	α-helix	trans	-76.7	-31.1	-174.5	-68	-12.5	0	0	0	114.9	Y157 H164 K169 F170	Y157-N166 HydrophobicContact CD2-CB 4.03Å; Y157-N166 HydrophobicContact CG-CB 4.24Å; H164-N166 PolarHBondContact O-N 3.46Å; N166-K169 PolarHBondContact O-N 3.48Å; N166-K169 PolarHBondContact OD1-NZ 3.15Å; N166-F170 PolarHBondContact O-N 2.57Å; N166-F170 VanDerWaalsContact O-N 3.1Å
167	H	67.4	Low	67.3	Low	50 Å²	50	87.8 Å²	87.8	23%	0.231	44%	0.436	C	S	.	.	H	α-helix	trans	-67.6	-41	174.6	-179.8	-87.6	0	0	0	110.5	Y157 H164 K169 F170 W171	Y157-H167 PolarHBondContact O-CD2 3.45Å; H164-H167 PolarHBondContact O-N 3.28Å; H167-K169 VanDerWaalsContact C-N 3.34Å; H167-K169 PolarHBondContact O-N 3.21Å; H167-F170 PolarHBondContact O-N 2.87Å; H167-W171 AromaticContact CD2-NE1 3.89Å; H167-W171 AromaticContact CE1-CD1 3.18Å; H167-W171 AromaticContact CE1-NE1 3.05Å; H167-W171 PolarHBondContact CE1-NE1 3.06Å; H167-W171 AromaticContact ND1-CD1 3.52Å; H167-W171 AromaticContact ND1-NE1 3.82Å; H167-W171 AromaticContact NE2-CD1 3.59Å; H167-W171 AromaticContact NE2-NE1 3.05Å; H167-W171 PolarHBondContact NE2-NE1 3.04Å; H167-W171 VanDerWaalsContact O-CD1 3.26Å; H167-W171 PolarHBondContact O-N 2.89Å
168	N	69.5	Low	68.4	Low	75 Å²	75	83.3 Å²	83.3	40%	0.401	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-39.7	175	-70.6	-19.1	0	0	0	111.3	F170 W171 Q172	N168-F170 PolarHBondContact O-N 2.9Å; N168-W171 PolarHBondContact O-N 2.86Å; N168-Q172 WeakPolarHBondContact O-CB 3.47Å; N168-Q172 WeakPolarHBondContact O-CG 3.47Å; N168-Q172 PolarHBondContact O-N 3.07Å
169	K	78.3	Confident	70.1	Confident	110 Å²	110	82.1 Å²	82.1	48%	0.478	42%	0.415	S	S	.	.	H	α-helix	trans	-58.2	-42.7	173.9	-74.1	172.7	-169.9	170.8	0	113.1	S165 N166 H167 Q172 L173	S165-K169 VanDerWaalsContact O-CG 3.28Å; S165-K169 WeakPolarHBondContact O-CG 3.37Å; S165-K169 PolarHBondContact O-N 3.29Å; S165-K169 VanDerWaalsContact O-N 3.08Å; N166-K169 PolarHBondContact O-N 3.48Å; N166-K169 PolarHBondContact OD1-NZ 3.15Å; H167-K169 VanDerWaalsContact C-N 3.34Å; H167-K169 PolarHBondContact O-N 3.21Å; K169-Q172 PolarHBondContact O-N 3.27Å; K169-L173 WeakPolarHBondContact O-CG 3.46Å
170	F	85.3	Confident	72.3	Confident	4 Å²	4	81.7 Å²	81.7	2%	0.018	41%	0.413	C	S	.	.	H	α-helix	trans	-58.7	-51.5	176.5	173.8	-95.6	0	0	0	111.2	P67 L70 P154 P156 N166 H167 N168 Q172 L173 Y174	P67-F170 HydrophobicContact CB-CE1 3.72Å; P67-F170 HydrophobicContact CB-CZ 3.71Å; L70-F170 HydrophobicContact CB-CZ 4.48Å; P154-F170 HydrophobicContact CB-CD2 4.01Å; P154-F170 WeakPolarHBondContact O-CD2 3.25Å; P154-F170 VanDerWaalsContact O-CE2 3.31Å; P154-F170 WeakPolarHBondContact O-CE2 3.23Å; P156-F170 HydrophobicContact CB-CD1 4.45Å; P156-F170 HydrophobicContact CB-CD2 4.11Å; P156-F170 HydrophobicContact CB-CE1 4.22Å; P156-F170 HydrophobicContact CB-CE2 3.89Å; P156-F170 HydrophobicContact CB-CG 4.41Å; P156-F170 HydrophobicContact CB-CZ 3.94Å; P156-F170 HydrophobicContact CG-CD2 4.2Å; P156-F170 HydrophobicContact CG-CE2 3.58Å; P156-F170 HydrophobicContact CG-CZ 3.76Å; N166-F170 PolarHBondContact O-N 2.57Å; N166-F170 VanDerWaalsContact O-N 3.1Å; H167-F170 PolarHBondContact O-N 2.87Å; N168-F170 PolarHBondContact O-N 2.9Å; F170-Q172 VanDerWaalsContact C-N 3.32Å; F170-Q172 PolarHBondContact O-N 2.92Å; F170-L173 WeakPolarHBondContact O-CB 3.38Å; F170-L173 PolarHBondContact O-N 3.4Å; F170-Y174 HydrophobicContact CD1-CE2 4.48Å; F170-Y174 HydrophobicContact CD2-CE2 4.24Å; F170-Y174 HydrophobicContact CE1-CD2 4.34Å; F170-Y174 HydrophobicContact CE1-CE2 4.04Å; F170-Y174 AromaticContact CE2-CE2 3.76Å; F170-Y174 HydrophobicContact CE2-CE2 3.76Å; F170-Y174 HydrophobicContact CZ-CD2 4.38Å; F170-Y174 AromaticContact CZ-CE2 3.64Å; F170-Y174 HydrophobicContact CZ-CE2 3.64Å; F170-Y174 VanDerWaalsContact O-CD2 3.26Å; F170-Y174 WeakPolarHBondContact O-CD2 3.5Å
171	W	86.7	Confident	74.5	Confident	8 Å²	8	78 Å²	78	3%	0.03	40%	0.397	C	S	.	.	H	α-helix	trans	-72	-23.4	-177.8	-71	104.9	0	0	0	114	P67 I68 H167 N168 L173 Y174 L178 N179 Y182	P67-W171 HydrophobicContact CB-CE3 4.35Å; P67-W171 HydrophobicContact CB-CH2 4.11Å; P67-W171 HydrophobicContact CB-CZ3 3.73Å; P67-W171 HydrophobicContact CG-CH2 4.49Å; P67-W171 HydrophobicContact CG-CZ3 3.83Å; I68-W171 HydrophobicContact CG1-CH2 4.28Å; H167-W171 AromaticContact CD2-NE1 3.89Å; H167-W171 AromaticContact CE1-CD1 3.18Å; H167-W171 AromaticContact CE1-NE1 3.05Å; H167-W171 PolarHBondContact CE1-NE1 3.06Å; H167-W171 AromaticContact ND1-CD1 3.52Å; H167-W171 AromaticContact ND1-NE1 3.82Å; H167-W171 AromaticContact NE2-CD1 3.59Å; H167-W171 AromaticContact NE2-NE1 3.05Å; H167-W171 PolarHBondContact NE2-NE1 3.04Å; H167-W171 VanDerWaalsContact O-CD1 3.26Å; H167-W171 PolarHBondContact O-N 2.89Å; N168-W171 PolarHBondContact O-N 2.86Å; W171-L173 PolarHBondContact O-N 3.18Å; W171-Y174 PolarHBondContact O-N 3.14Å; W171-Y174 VanDerWaalsContact O-N 3.17Å; W171-Y174 VanDerWaalsContact O-O 3.1Å; W171-L178 HydrophobicContact CE3-CB 4.36Å; W171-L178 HydrophobicContact CZ3-CB 3.88Å; W171-N179 HydrophobicContact CB-CB 4.06Å; W171-N179 HydrophobicContact CD2-CB 3.64Å; W171-N179 HydrophobicContact CE3-CB 3.7Å; W171-N179 HydrophobicContact CG-CB 3.81Å; W171-N179 HydrophobicContact CZ3-CB 4.4Å; W171-Y182 HydrophobicContact CH2-CD1 4.27Å; W171-Y182 HydrophobicContact CH2-CD2 4.03Å; W171-Y182 AromaticContact CH2-CG 3.7Å; W171-Y182 HydrophobicContact CH2-CG 3.7Å; W171-Y182 AromaticContact CZ2-CD1 3.62Å; W171-Y182 HydrophobicContact CZ2-CD1 3.62Å; W171-Y182 HydrophobicContact CZ2-CD2 4.04Å; W171-Y182 HydrophobicContact CZ2-CE1 4.19Å; W171-Y182 AromaticContact CZ2-CG 3.53Å; W171-Y182 HydrophobicContact CZ2-CG 3.53Å
172	Q	85.9	Confident	77	Confident	148 Å²	148	72.5 Å²	72.5	69%	0.692	37%	0.37	S	S	*	.	H	α-helix	trans	-62.6	-21.7	173.7	-81.2	167.4	-2	0	0	113	N168 K169 F170 Y174	N168-Q172 WeakPolarHBondContact O-CB 3.47Å; N168-Q172 WeakPolarHBondContact O-CG 3.47Å; N168-Q172 PolarHBondContact O-N 3.07Å; K169-Q172 PolarHBondContact O-N 3.27Å; F170-Q172 VanDerWaalsContact C-N 3.32Å; F170-Q172 PolarHBondContact O-N 2.92Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å
173	L	86.1	Confident	79.2	Confident	115 Å²	115	73.1 Å²	73.1	60%	0.602	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.4	178.8	-60.4	170.4	0	0	0	113.1	P154 K169 F170 W171	P154-L173 HydrophobicContact CB-CD1 3.6Å; P154-L173 HydrophobicContact CG-CD1 3.1Å; P154-L173 HydrophobicContact CG-CG 4.49Å; K169-L173 WeakPolarHBondContact O-CG 3.46Å; F170-L173 WeakPolarHBondContact O-CB 3.38Å; F170-L173 PolarHBondContact O-N 3.4Å; W171-L173 PolarHBondContact O-N 3.18Å
174	Y	87.5	Confident	81.5	Confident	34 Å²	34	67.8 Å²	67.8	13%	0.133	33%	0.332	C	S	.	.	S	Bend	trans	-118.9	168.9	-179.2	-57.9	-85	0	0	0	110.5	Q64 P67 L70 F170 W171 Q172	Q64-Y174 PolarHBondContact O-OH 3.41Å; P67-Y174 HydrophobicContact CB-CD1 4.04Å; P67-Y174 HydrophobicContact CB-CD2 3.77Å; P67-Y174 HydrophobicContact CB-CE1 4.08Å; P67-Y174 HydrophobicContact CB-CE2 3.83Å; P67-Y174 HydrophobicContact CB-CG 3.89Å; P67-Y174 HydrophobicContact CG-CD1 3.72Å; P67-Y174 HydrophobicContact CG-CD2 4.13Å; P67-Y174 HydrophobicContact CG-CE1 4.13Å; P67-Y174 HydrophobicContact CG-CG 3.72Å; L70-Y174 VanDerWaalsContact CD1-OH 3.31Å; L70-Y174 WeakPolarHBondContact CD1-OH 3.3Å; F170-Y174 HydrophobicContact CD1-CE2 4.48Å; F170-Y174 HydrophobicContact CD2-CE2 4.24Å; F170-Y174 HydrophobicContact CE1-CD2 4.34Å; F170-Y174 HydrophobicContact CE1-CE2 4.04Å; F170-Y174 AromaticContact CE2-CE2 3.76Å; F170-Y174 HydrophobicContact CE2-CE2 3.76Å; F170-Y174 HydrophobicContact CZ-CD2 4.38Å; F170-Y174 AromaticContact CZ-CE2 3.64Å; F170-Y174 HydrophobicContact CZ-CE2 3.64Å; F170-Y174 VanDerWaalsContact O-CD2 3.26Å; F170-Y174 WeakPolarHBondContact O-CD2 3.5Å; W171-Y174 PolarHBondContact O-N 3.14Å; W171-Y174 VanDerWaalsContact O-N 3.17Å; W171-Y174 VanDerWaalsContact O-O 3.1Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å
175	K	87.7	Confident	83.6	Confident	123 Å²	123	62.9 Å²	62.9	54%	0.535	31%	0.31	S	S	.	.			trans	-58.8	130.3	178.5	-63.2	-180	-178.7	179.2	0	109.9	Y177 L178	K175-Y177 HydrophobicContact CB-CD1 3.77Å; K175-Y177 HydrophobicContact CB-CE1 3.45Å; K175-Y177 VanDerWaalsContact CB-CE1 3.45Å; K175-Y177 HydrophobicContact CB-CE2 4.41Å; K175-Y177 HydrophobicContact CB-CG 4.45Å; K175-Y177 HydrophobicContact CD-CD1 4.45Å; K175-Y177 HydrophobicContact CD-CE1 3.38Å; K175-Y177 VanDerWaalsContact CD-OH 3.25Å; K175-Y177 WeakPolarHBondContact CD-OH 3.35Å; K175-Y177 HydrophobicContact CG-CE1 4.04Å; K175-Y177 PolarHBondContact O-N 3.02Å; K175-L178 HydrophobicContact CB-CD1 4.24Å; K175-L178 HydrophobicContact CB-CG 4.47Å; K175-L178 WeakPolarHBondContact O-CB 3.31Å; K175-L178 PolarHBondContact O-N 2.92Å
176	P	84.1	Confident	85.4	Confident	115 Å²	115	62.4 Å²	62.4	75%	0.747	30%	0.302	S	S	*	.	H	α-helix	trans	-54.6	-33.1	-172.1	-29.7	34.5	0	0	0	114.8	L178 N179	P176-L178 PolarHBondContact O-N 3.44Å; P176-N179 PolarHBondContact O-N 3.48Å
177	Y	88	Confident	87.1	Confident	75 Å²	75	65.3 Å²	65.3	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-25.1	178.2	68.5	-110.9	0	0	0	112.9	K175 N179 Q180 V181 I356	K175-Y177 HydrophobicContact CB-CD1 3.77Å; K175-Y177 HydrophobicContact CB-CE1 3.45Å; K175-Y177 VanDerWaalsContact CB-CE1 3.45Å; K175-Y177 HydrophobicContact CB-CE2 4.41Å; K175-Y177 HydrophobicContact CB-CG 4.45Å; K175-Y177 HydrophobicContact CD-CD1 4.45Å; K175-Y177 HydrophobicContact CD-CE1 3.38Å; K175-Y177 VanDerWaalsContact CD-OH 3.25Å; K175-Y177 WeakPolarHBondContact CD-OH 3.35Å; K175-Y177 HydrophobicContact CG-CE1 4.04Å; K175-Y177 PolarHBondContact O-N 3.02Å; Y177-N179 VanDerWaalsContact C-N 3.32Å; Y177-N179 PolarHBondContact O-N 2.85Å; Y177-Q180 WeakPolarHBondContact O-CB 3.47Å; Y177-Q180 PolarHBondContact O-N 3.41Å; Y177-Q180 VanDerWaalsContact O-N 3.14Å; Y177-V181 WeakPolarHBondContact O-CG2 3.48Å; Y177-V181 PolarHBondContact O-N 2.83Å; Y177-I356 HydrophobicContact CD2-CG2 3.41Å; Y177-I356 VanDerWaalsContact CD2-CG2 3.41Å; Y177-I356 HydrophobicContact CE2-CB 4.26Å; Y177-I356 HydrophobicContact CE2-CG2 3.05Å; Y177-I356 HydrophobicContact CG-CG2 4.45Å; Y177-I356 PolarHBondContact OH-O 3.27Å; Y177-I356 VanDerWaalsContact OH-O 3.06Å
178	L	90.6	Very high	88.5	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.063	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-35.4	-178.1	-71.1	168.6	0	0	0	111.5	P67 W171 K175 P176 Q180 V181 Y182	P67-L178 HydrophobicContact CG-CB 4.31Å; P67-L178 HydrophobicContact CG-CD1 3.8Å; W171-L178 HydrophobicContact CE3-CB 4.36Å; W171-L178 HydrophobicContact CZ3-CB 3.88Å; K175-L178 HydrophobicContact CB-CD1 4.24Å; K175-L178 HydrophobicContact CB-CG 4.47Å; K175-L178 WeakPolarHBondContact O-CB 3.31Å; K175-L178 PolarHBondContact O-N 2.92Å; P176-L178 PolarHBondContact O-N 3.44Å; L178-Q180 VanDerWaalsContact C-N 3.33Å; L178-V181 PolarHBondContact O-N 3.5Å; L178-Y182 WeakPolarHBondContact O-CB 3.26Å; L178-Y182 PolarHBondContact O-N 3.29Å
179	N	89.7	Confident	89.7	Confident	24 Å²	24	63.8 Å²	63.8	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-39.5	172.8	-172.7	6.2	0	0	0	110.8	W171 P176 Y177 Y182 K183	W171-N179 HydrophobicContact CB-CB 4.06Å; W171-N179 HydrophobicContact CD2-CB 3.64Å; W171-N179 HydrophobicContact CE3-CB 3.7Å; W171-N179 HydrophobicContact CG-CB 3.81Å; W171-N179 HydrophobicContact CZ3-CB 4.4Å; P176-N179 PolarHBondContact O-N 3.48Å; Y177-N179 VanDerWaalsContact C-N 3.32Å; Y177-N179 PolarHBondContact O-N 2.85Å; N179-Y182 PolarHBondContact O-N 3.13Å; N179-K183 WeakPolarHBondContact O-CG 3.49Å; N179-K183 PolarHBondContact O-N 3.5Å; N179-K183 WeakPolarHBondContact OD1-CE 3.5Å
180	Q	91.2	Very high	90.4	Very high	119 Å²	119	62.3 Å²	62.3	56%	0.556	30%	0.296	S	S	*	.	H	α-helix	trans	-62.4	-47.5	174.8	-175.2	179.4	3.2	0	0	111.2	Y177 L178 Y182 K183 Q184	Y177-Q180 WeakPolarHBondContact O-CB 3.47Å; Y177-Q180 PolarHBondContact O-N 3.41Å; Y177-Q180 VanDerWaalsContact O-N 3.14Å; L178-Q180 VanDerWaalsContact C-N 3.33Å; Q180-Y182 VanDerWaalsContact C-N 3.33Å; Q180-Y182 PolarHBondContact O-N 3.25Å; Q180-K183 WeakPolarHBondContact O-CB 3.37Å; Q180-K183 PolarHBondContact O-N 3.45Å; Q180-Q184 VanDerWaalsContact O-CG 3.3Å; Q180-Q184 WeakPolarHBondContact O-CG 3.44Å; Q180-Q184 PolarHBondContact O-N 3.28Å
181	V	92.2	Very high	90.9	Very high	11 Å²	11	62.9 Å²	62.9	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-44.4	175.3	171.1	0	0	0	0	110.9	I68 Y177 L178 K183 Q184 L185 M325 I357	I68-V181 HydrophobicContact CD1-CG1 4.14Å; Y177-V181 WeakPolarHBondContact O-CG2 3.48Å; Y177-V181 PolarHBondContact O-N 2.83Å; L178-V181 PolarHBondContact O-N 3.5Å; V181-K183 VanDerWaalsContact C-N 3.32Å; V181-K183 PolarHBondContact O-N 2.93Å; V181-Q184 WeakPolarHBondContact O-CA 3.37Å; V181-Q184 WeakPolarHBondContact O-CB 3.44Å; V181-Q184 PolarHBondContact O-N 3.27Å; V181-L185 HydrophobicContact CG1-CD1 4.27Å; V181-L185 HydrophobicContact CG1-CG 4.42Å; V181-L185 WeakPolarHBondContact O-CG 3.33Å; V181-L185 PolarHBondContact O-N 3.07Å; V181-M325 HydrophobicContact CG1-CE 3.83Å; V181-I357 HydrophobicContact CG1-CD1 3.52Å; V181-I357 HydrophobicContact CG1-CG1 3.93Å
182	Y	91.4	Very high	91.3	Very high	16 Å²	16	63.5 Å²	63.5	6%	0.063	30%	0.301	C	S	.	.	H	α-helix	trans	-59.3	-41	176.3	-176.4	-101.8	0	0	0	112.7	I68 C71 K75 H158 W171 L178 N179 Q180 L185 N186	I68-Y182 HydrophobicContact CG1-CD2 4.14Å; I68-Y182 HydrophobicContact CG2-CD2 4.44Å; C71-Y182 HydrophobicContact CB-CE2 4.03Å; K75-Y182 VanDerWaalsContact CE-OH 3.29Å; K75-Y182 WeakPolarHBondContact CE-OH 3.43Å; K75-Y182 PolarHBondContact NZ-OH 3.45Å; H158-Y182 PolarHBondContact CE1-OH 3.18Å; H158-Y182 PolarHBondContact NE2-OH 2.79Å; W171-Y182 HydrophobicContact CH2-CD1 4.27Å; W171-Y182 HydrophobicContact CH2-CD2 4.03Å; W171-Y182 AromaticContact CH2-CG 3.7Å; W171-Y182 HydrophobicContact CH2-CG 3.7Å; W171-Y182 AromaticContact CZ2-CD1 3.62Å; W171-Y182 HydrophobicContact CZ2-CD1 3.62Å; W171-Y182 HydrophobicContact CZ2-CD2 4.04Å; W171-Y182 HydrophobicContact CZ2-CE1 4.19Å; W171-Y182 AromaticContact CZ2-CG 3.53Å; W171-Y182 HydrophobicContact CZ2-CG 3.53Å; L178-Y182 WeakPolarHBondContact O-CB 3.26Å; L178-Y182 PolarHBondContact O-N 3.29Å; N179-Y182 PolarHBondContact O-N 3.13Å; Q180-Y182 VanDerWaalsContact C-N 3.33Å; Q180-Y182 PolarHBondContact O-N 3.25Å; Y182-L185 PolarHBondContact O-N 3.49Å; Y182-N186 VanDerWaalsContact CE1-ND2 3.27Å; Y182-N186 WeakPolarHBondContact CE1-ND2 3.38Å; Y182-N186 PolarHBondContact O-N 2.89Å; Y182-N186 PolarHBondContact O-ND2 2.95Å
183	K	91.3	Very high	91.6	Very high	124 Å²	124	58.8 Å²	58.8	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-64.5	-38.3	173	-70.3	174.6	-177.4	-176.8	0	112.2	N179 Q180 V181 N186 K187	N179-K183 WeakPolarHBondContact O-CG 3.49Å; N179-K183 PolarHBondContact O-N 3.5Å; N179-K183 WeakPolarHBondContact OD1-CE 3.5Å; Q180-K183 WeakPolarHBondContact O-CB 3.37Å; Q180-K183 PolarHBondContact O-N 3.45Å; V181-K183 VanDerWaalsContact C-N 3.32Å; V181-K183 PolarHBondContact O-N 2.93Å; K183-N186 PolarHBondContact O-N 3.24Å; K183-K187 PolarHBondContact O-N 2.94Å; K183-K187 VanDerWaalsContact O-N 3.08Å
184	Q	94.1	Very high	91.9	Very high	34 Å²	34	59.4 Å²	59.4	16%	0.159	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-43.1	175.8	-67.8	170.9	-20.4	0	0	111.5	Q180 V181 N186 K187 G188 M325 Y328	Q180-Q184 VanDerWaalsContact O-CG 3.3Å; Q180-Q184 WeakPolarHBondContact O-CG 3.44Å; Q180-Q184 PolarHBondContact O-N 3.28Å; V181-Q184 WeakPolarHBondContact O-CA 3.37Å; V181-Q184 WeakPolarHBondContact O-CB 3.44Å; V181-Q184 PolarHBondContact O-N 3.27Å; Q184-N186 VanDerWaalsContact C-N 3.34Å; Q184-N186 PolarHBondContact O-N 3.47Å; Q184-K187 WeakPolarHBondContact O-CB 3.3Å; Q184-K187 PolarHBondContact O-N 3.46Å; Q184-G188 PolarHBondContact O-N 3.14Å; Q184-M325 HydrophobicContact CB-CE 3.98Å; Q184-M325 HydrophobicContact CB-SD 4.32Å; Q184-Y328 HydrophobicContact CB-CD1 3.88Å; Q184-Y328 HydrophobicContact CB-CD2 4.44Å; Q184-Y328 HydrophobicContact CB-CE1 3.84Å; Q184-Y328 HydrophobicContact CB-CE2 4.42Å; Q184-Y328 HydrophobicContact CB-CG 4.18Å; Q184-Y328 HydrophobicContact CG-CD1 4.08Å; Q184-Y328 HydrophobicContact CG-CE1 3.49Å; Q184-Y328 VanDerWaalsContact CG-CE1 3.49Å; Q184-Y328 HydrophobicContact CG-CE2 4.21Å
185	L	94.8	Very high	92	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-42.7	173.9	-68.3	173.9	0	0	0	111.8	I68 V181 Y182 K187 G188 R189 D321 D324 M325 F353	I68-L185 HydrophobicContact CD1-CD1 3.93Å; I68-L185 HydrophobicContact CG2-CD1 4.32Å; V181-L185 HydrophobicContact CG1-CD1 4.27Å; V181-L185 HydrophobicContact CG1-CG 4.42Å; V181-L185 WeakPolarHBondContact O-CG 3.33Å; V181-L185 PolarHBondContact O-N 3.07Å; Y182-L185 PolarHBondContact O-N 3.49Å; L185-K187 VanDerWaalsContact C-N 3.34Å; L185-K187 PolarHBondContact O-N 2.93Å; L185-G188 PolarHBondContact O-N 2.86Å; L185-R189 PolarHBondContact O-N 3.28Å; L185-D321 HydrophobicContact CD1-CB 4.24Å; L185-D321 HydrophobicContact CD2-CB 3.78Å; L185-D321 WeakPolarHBondContact CD2-O 3.36Å; L185-D324 HydrophobicContact CD2-CB 4.36Å; L185-M325 HydrophobicContact CD2-CB 3.99Å; L185-M325 HydrophobicContact CD2-CE 3.76Å; L185-M325 HydrophobicContact CG-CE 3.98Å; L185-F353 HydrophobicContact CD2-CZ 4.13Å
186	N	92.2	Very high	92.2	Very high	55 Å²	55	52.5 Å²	52.5	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-40.8	175.5	-71.9	-34.8	0	0	0	112.2	Y182 K183 Q184 R189 L190	Y182-N186 VanDerWaalsContact CE1-ND2 3.27Å; Y182-N186 WeakPolarHBondContact CE1-ND2 3.38Å; Y182-N186 PolarHBondContact O-N 2.89Å; Y182-N186 PolarHBondContact O-ND2 2.95Å; K183-N186 PolarHBondContact O-N 3.24Å; Q184-N186 VanDerWaalsContact C-N 3.34Å; Q184-N186 PolarHBondContact O-N 3.47Å; N186-R189 PolarHBondContact O-N 2.96Å; N186-L190 WeakPolarHBondContact O-CG 3.45Å; N186-L190 PolarHBondContact O-N 3.18Å
187	K	94.7	Very high	92.4	Very high	114 Å²	114	51.4 Å²	51.4	50%	0.496	24%	0.237	S	C	.	.	H	α-helix	trans	-62.9	-45.4	172.6	-70.9	-176.7	176.8	-170.8	0	111.4	K183 Q184 L185 R189 L190 L191 Y328	K183-K187 PolarHBondContact O-N 2.94Å; K183-K187 VanDerWaalsContact O-N 3.08Å; Q184-K187 WeakPolarHBondContact O-CB 3.3Å; Q184-K187 PolarHBondContact O-N 3.46Å; L185-K187 VanDerWaalsContact C-N 3.34Å; L185-K187 PolarHBondContact O-N 2.93Å; K187-R189 VanDerWaalsContact C-N 3.31Å; K187-R189 PolarHBondContact O-N 3.16Å; K187-L190 WeakPolarHBondContact O-CB 3.38Å; K187-L190 PolarHBondContact O-N 2.94Å; K187-L190 VanDerWaalsContact O-N 3.13Å; K187-L191 WeakPolarHBondContact O-CG 3.28Å; K187-L191 PolarHBondContact O-N 2.96Å; K187-L191 VanDerWaalsContact O-N 3.09Å; K187-Y328 HydrophobicContact CB-CD2 3.92Å; K187-Y328 HydrophobicContact CB-CE2 4.34Å; K187-Y328 HydrophobicContact CD-CD2 4.39Å; K187-Y328 HydrophobicContact CD-CE2 3.96Å
188	G	96.3	Very high	92.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-55	-43.7	174.9	0	0	0	0	0	113.3	Q184 L185 L190 L191 R192 D324	Q184-G188 PolarHBondContact O-N 3.14Å; L185-G188 PolarHBondContact O-N 2.86Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 2.66Å; G188-L191 WeakPolarHBondContact O-CB 3.33Å; G188-L191 PolarHBondContact O-N 3.3Å; G188-L191 VanDerWaalsContact O-N 3.14Å; G188-R192 PolarHBondContact O-N 2.94Å; G188-D324 WeakPolarHBondContact CA-O 3.2Å
189	R	94.9	Very high	92	Very high	93 Å²	93	54.5 Å²	54.5	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-43	175.1	177.2	180	174.8	-159.7	-1.6	112.4	L185 N186 K187 L191 R192 L193 D324	L185-R189 PolarHBondContact O-N 3.28Å; N186-R189 PolarHBondContact O-N 2.96Å; K187-R189 VanDerWaalsContact C-N 3.31Å; K187-R189 PolarHBondContact O-N 3.16Å; R189-L191 VanDerWaalsContact C-N 3.32Å; R189-R192 WeakPolarHBondContact O-CB 3.3Å; R189-R192 PolarHBondContact O-N 3.43Å; R189-L193 WeakPolarHBondContact O-CG 3.43Å; R189-L193 PolarHBondContact O-N 3.47Å; R189-D324 VanDerWaalsContact CA-OD1 3.25Å; R189-D324 WeakPolarHBondContact CA-OD1 3.49Å; R189-D324 PolarHBondContact N-OD1 3.31Å
190	L	94.3	Very high	91.8	Very high	80 Å²	80	54.8 Å²	54.8	42%	0.419	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-39.9	176.6	-65.1	174.4	0	0	0	111.2	N186 K187 G188 R192 L193 K194	N186-L190 WeakPolarHBondContact O-CG 3.45Å; N186-L190 PolarHBondContact O-N 3.18Å; K187-L190 WeakPolarHBondContact O-CB 3.38Å; K187-L190 PolarHBondContact O-N 2.94Å; K187-L190 VanDerWaalsContact O-N 3.13Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 2.66Å; L190-R192 VanDerWaalsContact C-N 3.34Å; L190-R192 PolarHBondContact O-N 2.91Å; L190-L193 PolarHBondContact O-N 3.29Å; L190-K194 PolarHBondContact O-N 3.13Å
191	L	95.4	Very high	91.3	Very high	16 Å²	16	53.1 Å²	53.1	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-39.3	174.2	-60.8	172.8	0	0	0	112.1	K187 G188 R189 K194 R195 L327 Q331 L337	K187-L191 WeakPolarHBondContact O-CG 3.28Å; K187-L191 PolarHBondContact O-N 2.96Å; K187-L191 VanDerWaalsContact O-N 3.09Å; G188-L191 WeakPolarHBondContact O-CB 3.33Å; G188-L191 PolarHBondContact O-N 3.3Å; G188-L191 VanDerWaalsContact O-N 3.14Å; R189-L191 VanDerWaalsContact C-N 3.32Å; L191-K194 PolarHBondContact O-N 3.11Å; L191-R195 WeakPolarHBondContact O-CB 3.14Å; L191-R195 PolarHBondContact O-N 3.23Å; L191-L327 HydrophobicContact CB-CB 4.09Å; L191-L327 HydrophobicContact CD1-CB 4.24Å; L191-L327 VanDerWaalsContact CD1-O 3.29Å; L191-L327 WeakPolarHBondContact CD1-O 3.18Å; L191-Q331 HydrophobicContact CD1-CB 3.73Å; L191-Q331 HydrophobicContact CD1-CG 4.42Å; L191-L337 HydrophobicContact CB-CD1 4.49Å; L191-L337 HydrophobicContact CD2-CD1 3.86Å
192	R	94.8	Very high	90.6	Very high	20 Å²	20	61.1 Å²	61.1	8%	0.075	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-45.8	174.1	-175.9	174.1	57.9	-140.1	-13.6	111.5	G188 R189 L190 R195 I196 L320 D324 L327	G188-R192 PolarHBondContact O-N 2.94Å; R189-R192 WeakPolarHBondContact O-CB 3.3Å; R189-R192 PolarHBondContact O-N 3.43Å; L190-R192 VanDerWaalsContact C-N 3.34Å; L190-R192 PolarHBondContact O-N 2.91Å; R192-R195 WeakPolarHBondContact O-CB 3.3Å; R192-R195 PolarHBondContact O-N 3.48Å; R192-I196 HydrophobicContact CG-CD1 4.11Å; R192-I196 WeakPolarHBondContact O-CG1 3.38Å; R192-I196 PolarHBondContact O-N 3.11Å; R192-L320 VanDerWaalsContact NH1-CA 3.29Å; R192-L320 PolarHBondContact NH1-O 2.88Å; R192-D324 VanDerWaalsContact CZ-CG 3.44Å; R192-D324 IonicContact CZ-OD1 2.76Å; R192-D324 IonicContact CZ-OD2 2.73Å; R192-D324 VanDerWaalsContact CZ-OD2 3.27Å; R192-D324 IonicContact NE-OD1 3.2Å; R192-D324 PolarHBondContact NE-OD1 3.23Å; R192-D324 VanDerWaalsContact NH1-CG 3.28Å; R192-D324 IonicContact NH1-OD1 2.8Å; R192-D324 PolarHBondContact NH1-OD1 2.89Å; R192-D324 IonicContact NH1-OD2 3.09Å; R192-D324 PolarHBondContact NH1-OD2 3.47Å; R192-D324 VanDerWaalsContact NH2-CG 3.33Å; R192-D324 IonicContact NH2-OD1 3.2Å; R192-D324 PolarHBondContact NH2-OD1 3.43Å; R192-D324 VanDerWaalsContact NH2-OD1 3.08Å; R192-D324 IonicContact NH2-OD2 3.3Å; R192-D324 PolarHBondContact NH2-OD2 2.9Å; R192-L327 HydrophobicContact CB-CD1 3.61Å; R192-L327 HydrophobicContact CG-CD1 4.22Å
193	L	92.6	Very high	90.3	Very high	50 Å²	50	64.6 Å²	64.6	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-47.1	176.8	-68.2	175.6	0	0	0	110.9	R189 L190 R195 I196 D197	R189-L193 WeakPolarHBondContact O-CG 3.43Å; R189-L193 PolarHBondContact O-N 3.47Å; L190-L193 PolarHBondContact O-N 3.29Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.89Å; L193-I196 WeakPolarHBondContact O-CB 3.49Å; L193-I196 PolarHBondContact O-N 3.23Å; L193-I196 VanDerWaalsContact O-N 3.09Å; L193-D197 VanDerWaalsContact O-CG 3.29Å; L193-D197 PolarHBondContact O-N 3.27Å
194	K	91.4	Very high	90.2	Very high	127 Å²	127	61.3 Å²	61.3	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-57.4	-40.9	174.4	-174.8	175.5	-178.3	175.9	0	112.5	L190 L191 D197 L198	L190-K194 PolarHBondContact O-N 3.13Å; L191-K194 PolarHBondContact O-N 3.11Å; K194-D197 PolarHBondContact O-N 2.93Å; K194-L198 HydrophobicContact CG-CD1 4.24Å; K194-L198 WeakPolarHBondContact O-CB 3.35Å; K194-L198 VanDerWaalsContact O-CG 3.25Å; K194-L198 WeakPolarHBondContact O-CG 3.01Å; K194-L198 PolarHBondContact O-N 3.39Å
195	R	90.4	Very high	90	Very high	9 Å²	9	66.2 Å²	66.2	3%	0.034	33%	0.327	C	S	.	.	H	α-helix	trans	-63.3	-40.8	176.5	-170	-176.7	-164.9	-158.2	4.1	111.8	G20 E21 L191 R192 L193 K199 L337 S339	G20-R195 PolarHBondContact O-NE 3.41Å; E21-R195 IonicContact OE1-NH2 3.27Å; E21-R195 IonicContact OE2-CZ 3.68Å; E21-R195 IonicContact OE2-NH1 2.57Å; E21-R195 PolarHBondContact OE2-NH1 3.37Å; E21-R195 IonicContact OE2-NH2 3.68Å; E21-R195 PolarHBondContact OE2-NH2 2.87Å; L191-R195 WeakPolarHBondContact O-CB 3.14Å; L191-R195 PolarHBondContact O-N 3.23Å; R192-R195 WeakPolarHBondContact O-CB 3.3Å; R192-R195 PolarHBondContact O-N 3.48Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.89Å; R195-K199 WeakPolarHBondContact O-CB 3.37Å; R195-K199 PolarHBondContact O-N 3.1Å; R195-K199 VanDerWaalsContact O-N 3.07Å; R195-L337 PolarHBondContact NE-O 2.89Å; R195-S339 PolarHBondContact NH2-O 3.48Å
196	I	91	Very high	89.8	Confident	3 Å²	3	73.6 Å²	73.6	2%	0.015	36%	0.362	C	S	.	.	H	α-helix	trans	-63.9	-46.8	174.6	-69.1	163.3	0	0	0	110.6	S18 R192 L193 L198 K199 L200 F211	S18-I196 WeakPolarHBondContact O-CD1 3.47Å; R192-I196 HydrophobicContact CG-CD1 4.11Å; R192-I196 WeakPolarHBondContact O-CG1 3.38Å; R192-I196 PolarHBondContact O-N 3.11Å; L193-I196 WeakPolarHBondContact O-CB 3.49Å; L193-I196 PolarHBondContact O-N 3.23Å; L193-I196 VanDerWaalsContact O-N 3.09Å; I196-L198 PolarHBondContact O-N 3.22Å; I196-K199 WeakPolarHBondContact O-CB 3.16Å; I196-K199 PolarHBondContact O-N 2.66Å; I196-K199 VanDerWaalsContact O-N 3.16Å; I196-L200 HydrophobicContact CG2-CD1 3.91Å; I196-L200 WeakPolarHBondContact O-CG 3.46Å; I196-L200 PolarHBondContact O-N 3.42Å; I196-L200 VanDerWaalsContact O-N 3.11Å; I196-F211 HydrophobicContact CG2-CE1 3.7Å; I196-F211 HydrophobicContact CG2-CZ 4.17Å
197	D	88.3	Confident	89.5	Confident	93 Å²	93	76.1 Å²	76.1	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-60.2	-47.9	179.9	-63.3	-24	0	0	0	110.4	L193 K194 K199 L200 C201	L193-D197 VanDerWaalsContact O-CG 3.29Å; L193-D197 PolarHBondContact O-N 3.27Å; K194-D197 PolarHBondContact O-N 2.93Å; D197-K199 VanDerWaalsContact C-N 3.27Å; D197-K199 PolarHBondContact O-N 2.82Å; D197-L200 PolarHBondContact O-N 3.03Å; D197-C201 PolarHBondContact O-N 3.12Å; D197-C201 PolarHBondContact O-SG 3.04Å
198	L	86.2	Confident	89.2	Confident	91 Å²	91	74.9 Å²	74.9	48%	0.476	37%	0.366	S	S	.	.	H	α-helix	trans	-58.3	-37.3	176	-72.5	172.1	0	0	0	113	K194 I196 L200	K194-L198 HydrophobicContact CG-CD1 4.24Å; K194-L198 WeakPolarHBondContact O-CB 3.35Å; K194-L198 VanDerWaalsContact O-CG 3.25Å; K194-L198 WeakPolarHBondContact O-CG 3.01Å; K194-L198 PolarHBondContact O-N 3.39Å; I196-L198 PolarHBondContact O-N 3.22Å; L198-L200 VanDerWaalsContact C-N 3.27Å; L198-L200 PolarHBondContact O-N 2.85Å
199	K	84.6	Confident	88.9	Confident	60 Å²	60	79 Å²	79	26%	0.261	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-32.6	175.8	-175.6	172.7	-178.6	172.9	0	111.7	E21 R195 I196 D197 E203 F211	E21-K199 PolarHBondContact O-NZ 3.05Å; R195-K199 WeakPolarHBondContact O-CB 3.37Å; R195-K199 PolarHBondContact O-N 3.1Å; R195-K199 VanDerWaalsContact O-N 3.07Å; I196-K199 WeakPolarHBondContact O-CB 3.16Å; I196-K199 PolarHBondContact O-N 2.66Å; I196-K199 VanDerWaalsContact O-N 3.16Å; D197-K199 VanDerWaalsContact C-N 3.27Å; D197-K199 PolarHBondContact O-N 2.82Å; K199-E203 WeakPolarHBondContact O-CG 3.23Å; K199-F211 HydrophobicContact CD-CE2 4.25Å
200	L	85.5	Confident	88.6	Confident	30 Å²	30	77.3 Å²	77.3	16%	0.157	39%	0.39	C	S	.	.	H	α-helix	trans	-92.7	-19.5	-175.5	-66.6	173	0	0	0	114.2	I196 D197 L198 H202 E203 F208 F211	I196-L200 HydrophobicContact CG2-CD1 3.91Å; I196-L200 WeakPolarHBondContact O-CG 3.46Å; I196-L200 PolarHBondContact O-N 3.42Å; I196-L200 VanDerWaalsContact O-N 3.11Å; D197-L200 PolarHBondContact O-N 3.03Å; L198-L200 VanDerWaalsContact C-N 3.27Å; L198-L200 PolarHBondContact O-N 2.85Å; L200-H202 PolarHBondContact O-N 3.36Å; L200-E203 PolarHBondContact O-N 3.15Å; L200-F208 HydrophobicContact CB-CD2 4.42Å; L200-F208 HydrophobicContact CD1-CD2 4.13Å; L200-F208 HydrophobicContact CD1-CE2 4.13Å; L200-F208 HydrophobicContact CD2-CD2 4.1Å; L200-F208 HydrophobicContact CG-CD2 4.46Å; L200-F211 HydrophobicContact CD1-CD1 3.83Å; L200-F211 HydrophobicContact CD1-CE1 3.91Å; L200-F211 HydrophobicContact CD2-CB 4.08Å; L200-F211 HydrophobicContact CD2-CD1 3.57Å; L200-F211 HydrophobicContact CD2-CE1 4.18Å; L200-F211 HydrophobicContact CD2-CG 3.94Å; L200-F211 HydrophobicContact CG-CD1 4.07Å; L200-F211 HydrophobicContact CG-CE1 4.22Å
201	C	80.8	Confident	88.4	Confident	84 Å²	84	74.3 Å²	74.3	57%	0.568	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-20.4	-174.1	-77.6	0	0	0	0	115.4	D197	D197-C201 PolarHBondContact O-N 3.12Å; D197-C201 PolarHBondContact O-SG 3.04Å
202	H	78	Confident	88.1	Confident	179 Å²	179	79.3 Å²	79.3	83%	0.829	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	12.5	-175.8	-57.6	-53.8	0	0	0	113.8	L200	L200-H202 PolarHBondContact O-N 3.36Å
203	E	84.3	Confident	87.9	Confident	89 Å²	89	84.2 Å²	84.2	42%	0.416	42%	0.416	S	S	.	.			trans	-85.7	153.9	-178.7	-69.6	-71.1	180	0	0	111.5	K199 L200 H207	K199-E203 WeakPolarHBondContact O-CG 3.23Å; L200-E203 PolarHBondContact O-N 3.15Å; E203-H207 HydrophobicContact CB-CB 3.9Å; E203-H207 HydrophobicContact CG-CB 4.41Å; E203-H207 WeakPolarHBondContact OE2-CB 3.37Å; E203-H207 IonicContact OE2-CD2 3.56Å; E203-H207 IonicContact OE2-CG 3.53Å
204	S	89.8	Confident	87.8	Confident	56 Å²	56	83.6 Å²	83.6	39%	0.392	41%	0.413	S	S	.	.			trans	-64	157.5	171.4	73.6	0	0	0	0	110.8	E206 H207 F208	S204-E206 PolarHBondContact O-N 3.48Å; S204-H207 PolarHBondContact O-N 3.3Å; S204-H207 PolarHBondContact OG-CD2 3.42Å; S204-H207 PolarHBondContact OG-N 3.28Å; S204-F208 PolarHBondContact O-N 3.33Å
205	M	89.1	Confident	87.7	Confident	136 Å²	136	82.4 Å²	82.4	67%	0.67	41%	0.405	S	S	*	.	H	α-helix	trans	-55.6	-36.2	174.7	-179.1	64.1	93	0	0	111.9	F208 L209	M205-F208 PolarHBondContact O-N 3.1Å; M205-F208 HydrophobicContact SD-CD1 4.19Å; M205-L209 HydrophobicContact CG-CD1 4.18Å; M205-L209 HydrophobicContact CG-CG 4.43Å; M205-L209 WeakPolarHBondContact O-CB 3.37Å; M205-L209 VanDerWaalsContact O-CG 3.32Å; M205-L209 WeakPolarHBondContact O-CG 3.27Å; M205-L209 PolarHBondContact O-N 3.5Å; M205-L209 HydrophobicContact SD-CG 4.31Å
206	E	90.2	Very high	87.5	Confident	161 Å²	161	87.2 Å²	87.2	75%	0.752	43%	0.428	S	S	*	.	H	α-helix	trans	-64.6	-43.2	176	-64.2	-179.2	170.6	0	0	112.1	S204 L209 S210	S204-E206 PolarHBondContact O-N 3.48Å; E206-L209 PolarHBondContact O-N 2.92Å; E206-S210 WeakPolarHBondContact O-CB 3.38Å; E206-S210 PolarHBondContact O-N 3.19Å; E206-S210 PolarHBondContact O-OG 2.87Å
207	H	87.8	Confident	87.5	Confident	108 Å²	108	90.3 Å²	90.3	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-65.9	-39.4	174.1	-87.1	-58.5	0	0	0	112	E203 S204 S210 F211	E203-H207 HydrophobicContact CB-CB 3.9Å; E203-H207 HydrophobicContact CG-CB 4.41Å; E203-H207 WeakPolarHBondContact OE2-CB 3.37Å; E203-H207 IonicContact OE2-CD2 3.56Å; E203-H207 IonicContact OE2-CG 3.53Å; S204-H207 PolarHBondContact O-N 3.3Å; S204-H207 PolarHBondContact OG-CD2 3.42Å; S204-H207 PolarHBondContact OG-N 3.28Å; H207-S210 WeakPolarHBondContact CA-OG 3.4Å; H207-S210 PolarHBondContact O-OG 3.37Å; H207-F211 WeakPolarHBondContact O-CB 3.37Å; H207-F211 PolarHBondContact O-N 2.95Å
208	F	87.8	Confident	87.6	Confident	88 Å²	88	86.3 Å²	86.3	39%	0.386	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-49.9	173.7	175.6	-92.2	0	0	0	111.9	L200 S204 M205 F211 Y212	L200-F208 HydrophobicContact CB-CD2 4.42Å; L200-F208 HydrophobicContact CD1-CD2 4.13Å; L200-F208 HydrophobicContact CD1-CE2 4.13Å; L200-F208 HydrophobicContact CD2-CD2 4.1Å; L200-F208 HydrophobicContact CG-CD2 4.46Å; S204-F208 PolarHBondContact O-N 3.33Å; M205-F208 PolarHBondContact O-N 3.1Å; M205-F208 HydrophobicContact SD-CD1 4.19Å; F208-F211 PolarHBondContact O-N 3.08Å; F208-Y212 VanDerWaalsContact O-CB 3.3Å; F208-Y212 WeakPolarHBondContact O-CB 3.4Å; F208-Y212 PolarHBondContact O-N 3.45Å
209	L	89.4	Confident	87.9	Confident	87 Å²	87	83 Å²	83	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-44.6	-179.5	-72.1	174.4	0	0	0	112.1	M205 E206 Y212 Q213	M205-L209 HydrophobicContact CG-CD1 4.18Å; M205-L209 HydrophobicContact CG-CG 4.43Å; M205-L209 WeakPolarHBondContact O-CB 3.37Å; M205-L209 VanDerWaalsContact O-CG 3.32Å; M205-L209 WeakPolarHBondContact O-CG 3.27Å; M205-L209 PolarHBondContact O-N 3.5Å; M205-L209 HydrophobicContact SD-CG 4.31Å; E206-L209 PolarHBondContact O-N 2.92Å; L209-Y212 PolarHBondContact O-N 2.96Å; L209-Q213 WeakPolarHBondContact O-CG 3.2Å; L209-Q213 PolarHBondContact O-N 3.36Å
210	S	89.6	Confident	88.2	Confident	56 Å²	56	80.1 Å²	80.1	39%	0.392	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-40.9	177.1	58.9	0	0	0	0	111.9	E206 H207 Q213 L214	E206-S210 WeakPolarHBondContact O-CB 3.38Å; E206-S210 PolarHBondContact O-N 3.19Å; E206-S210 PolarHBondContact O-OG 2.87Å; H207-S210 WeakPolarHBondContact CA-OG 3.4Å; H207-S210 PolarHBondContact O-OG 3.37Å; S210-Q213 PolarHBondContact O-N 3.07Å; S210-L214 WeakPolarHBondContact O-CB 3.36Å; S210-L214 PolarHBondContact O-N 3.05Å
211	F	89.9	Confident	88.4	Confident	17 Å²	17	79.8 Å²	79.8	8%	0.075	40%	0.397	C	S	.	.	H	α-helix	trans	-66.8	-37.6	174.7	-176.3	-97	0	0	0	112.5	I17 I196 K199 L200 H207 F208 L214 R215	I17-F211 WeakPolarHBondContact O-CE2 3.35Å; I196-F211 HydrophobicContact CG2-CE1 3.7Å; I196-F211 HydrophobicContact CG2-CZ 4.17Å; K199-F211 HydrophobicContact CD-CE2 4.25Å; L200-F211 HydrophobicContact CD1-CD1 3.83Å; L200-F211 HydrophobicContact CD1-CE1 3.91Å; L200-F211 HydrophobicContact CD2-CB 4.08Å; L200-F211 HydrophobicContact CD2-CD1 3.57Å; L200-F211 HydrophobicContact CD2-CE1 4.18Å; L200-F211 HydrophobicContact CD2-CG 3.94Å; L200-F211 HydrophobicContact CG-CD1 4.07Å; L200-F211 HydrophobicContact CG-CE1 4.22Å; H207-F211 WeakPolarHBondContact O-CB 3.37Å; H207-F211 PolarHBondContact O-N 2.95Å; F208-F211 PolarHBondContact O-N 3.08Å; F211-L214 HydrophobicContact CD2-CD2 4.39Å; F211-L214 WeakPolarHBondContact O-CB 3.45Å; F211-L214 PolarHBondContact O-N 3.2Å; F211-R215 HydrophobicContact CD1-CG 4.24Å; F211-R215 HydrophobicContact CE1-CG 3.86Å; F211-R215 HydrophobicContact CZ-CG 4.19Å; F211-R215 PolarHBondContact O-N 3.48Å
212	Y	88.4	Confident	88.6	Confident	122 Å²	122	77.8 Å²	77.8	48%	0.478	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-44.5	175.2	-177.8	-107.8	0	0	0	111.8	F208 L209 L214 R215 Q216	F208-Y212 VanDerWaalsContact O-CB 3.3Å; F208-Y212 WeakPolarHBondContact O-CB 3.4Å; F208-Y212 PolarHBondContact O-N 3.45Å; L209-Y212 PolarHBondContact O-N 2.96Å; Y212-L214 VanDerWaalsContact C-N 3.33Å; Y212-L214 PolarHBondContact O-N 3.36Å; Y212-R215 WeakPolarHBondContact O-CB 3.38Å; Y212-R215 PolarHBondContact O-N 3.18Å; Y212-Q216 WeakPolarHBondContact O-CG 3.33Å; Y212-Q216 PolarHBondContact O-N 2.89Å; Y212-Q216 VanDerWaalsContact O-N 3.08Å; Y212-Q216 PolarHBondContact OH-NE2 3.05Å
213	Q	89.9	Confident	89	Confident	122 Å²	122	69.9 Å²	69.9	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-61	-41.2	172.7	-71.9	175.3	-5.4	0	0	112	L209 S210 R215 Q216 T217	L209-Q213 WeakPolarHBondContact O-CG 3.2Å; L209-Q213 PolarHBondContact O-N 3.36Å; S210-Q213 PolarHBondContact O-N 3.07Å; Q213-R215 PolarHBondContact O-N 2.94Å; Q213-Q216 PolarHBondContact O-N 3.41Å; Q213-T217 WeakPolarHBondContact O-CG2 3.29Å; Q213-T217 PolarHBondContact O-N 2.94Å; Q213-T217 VanDerWaalsContact O-N 3.11Å; Q213-T217 PolarHBondContact O-OG1 2.85Å
214	L	91.3	Very high	88.9	Confident	37 Å²	37	65.8 Å²	65.8	19%	0.194	33%	0.326	C	S	.	.	H	α-helix	trans	-58	-47.1	172.9	176	66.8	0	0	0	110.9	K14 I17 S210 F211 Y212 Q216 T217 A218	K14-L214 HydrophobicContact CB-CD1 3.94Å; K14-L214 HydrophobicContact CD-CD1 4.32Å; K14-L214 HydrophobicContact CG-CD1 3.74Å; I17-L214 HydrophobicContact CB-CD2 4.05Å; I17-L214 HydrophobicContact CG2-CD2 3.49Å; I17-L214 VanDerWaalsContact CG2-CD2 3.49Å; S210-L214 WeakPolarHBondContact O-CB 3.36Å; S210-L214 PolarHBondContact O-N 3.05Å; F211-L214 HydrophobicContact CD2-CD2 4.39Å; F211-L214 WeakPolarHBondContact O-CB 3.45Å; F211-L214 PolarHBondContact O-N 3.2Å; Y212-L214 VanDerWaalsContact C-N 3.33Å; Y212-L214 PolarHBondContact O-N 3.36Å; L214-Q216 VanDerWaalsContact C-N 3.31Å; L214-Q216 PolarHBondContact O-N 3.24Å; L214-T217 CarbonylContact O-C 3.48Å; L214-T217 PolarHBondContact O-N 3.43Å; L214-T217 VanDerWaalsContact O-N 3.09Å; L214-T217 PolarHBondContact O-OG1 2.7Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 3.41Å
215	R	89.6	Confident	88.3	Confident	103 Å²	103	69.8 Å²	69.8	39%	0.389	34%	0.336	S	S	.	.	H	α-helix	trans	-60.4	-37.8	178.2	-78.6	-175.5	68.8	-172	4.1	113.2	F211 Y212 Q213 T217	F211-R215 HydrophobicContact CD1-CG 4.24Å; F211-R215 HydrophobicContact CE1-CG 3.86Å; F211-R215 HydrophobicContact CZ-CG 4.19Å; F211-R215 PolarHBondContact O-N 3.48Å; Y212-R215 WeakPolarHBondContact O-CB 3.38Å; Y212-R215 PolarHBondContact O-N 3.18Å; Q213-R215 PolarHBondContact O-N 2.94Å; R215-T217 VanDerWaalsContact C-N 3.28Å; R215-T217 PolarHBondContact O-N 3.45Å
216	Q	86.9	Confident	87.3	Confident	110 Å²	110	65.2 Å²	65.2	51%	0.514	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-32.1	176.2	-68.4	-175.2	-1.7	0	0	112.4	Y212 Q213 L214 N222	Y212-Q216 WeakPolarHBondContact O-CG 3.33Å; Y212-Q216 PolarHBondContact O-N 2.89Å; Y212-Q216 VanDerWaalsContact O-N 3.08Å; Y212-Q216 PolarHBondContact OH-NE2 3.05Å; Q213-Q216 PolarHBondContact O-N 3.41Å; L214-Q216 VanDerWaalsContact C-N 3.31Å; L214-Q216 PolarHBondContact O-N 3.24Å; Q216-N222 PolarHBondContact O-ND2 3.28Å
217	T	89.6	Confident	86.6	Confident	67 Å²	67	64.7 Å²	64.7	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-92.3	-20.7	-177.8	57.1	0	0	0	0	113.7	Q213 L214 R215 S219 N222	Q213-T217 WeakPolarHBondContact O-CG2 3.29Å; Q213-T217 PolarHBondContact O-N 2.94Å; Q213-T217 VanDerWaalsContact O-N 3.11Å; Q213-T217 PolarHBondContact O-OG1 2.85Å; L214-T217 CarbonylContact O-C 3.48Å; L214-T217 PolarHBondContact O-N 3.43Å; L214-T217 VanDerWaalsContact O-N 3.09Å; L214-T217 PolarHBondContact O-OG1 2.7Å; R215-T217 VanDerWaalsContact C-N 3.28Å; R215-T217 PolarHBondContact O-N 3.45Å; T217-S219 VanDerWaalsContact C-N 3.26Å; T217-S219 PolarHBondContact O-N 3.04Å; T217-N222 WeakPolarHBondContact CA-ND2 3.37Å; T217-N222 PolarHBondContact O-ND2 3.35Å
218	A	91.3	Very high	86.3	Confident	9 Å²	9	62.4 Å²	62.4	7%	0.074	30%	0.304	C	S	.	.			trans	-77	66.5	-179.2	0	0	0	0	0	112.7	K14 V15 S18 L214	K14-A218 HydrophobicContact CB-CB 3.84Å; K14-A218 WeakPolarHBondContact O-CB 3.14Å; V15-A218 HydrophobicContact CG2-CB 4.48Å; V15-A218 WeakPolarHBondContact CG2-O 3.24Å; S18-A218 VanDerWaalsContact OG-CB 3.22Å; S18-A218 WeakPolarHBondContact OG-CB 3.42Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 3.41Å
219	S	92	Very high	86.2	Confident	22 Å²	22	59.1 Å²	59.1	15%	0.154	29%	0.29	C	S	.	.	S	Bend	trans	-152.6	139.8	172.4	-172	0	0	0	0	111.4	M11 T217 L221 N222 N316	M11-S219 WeakPolarHBondContact CE-O 2.9Å; M11-S219 VanDerWaalsContact SD-C 3.53Å; M11-S219 PolarHBondContact SD-N 3.28Å; M11-S219 VanDerWaalsContact SD-O 3.38Å; T217-S219 VanDerWaalsContact C-N 3.26Å; T217-S219 PolarHBondContact O-N 3.04Å; S219-L221 PolarHBondContact O-N 2.86Å; S219-L221 VanDerWaalsContact O-N 3.11Å; S219-L221 WeakPolarHBondContact OG-CB 3.46Å; S219-L221 PolarHBondContact OG-N 3.41Å; S219-N222 WeakPolarHBondContact O-CB 3.48Å; S219-N222 PolarHBondContact O-N 3Å; S219-N316 WeakPolarHBondContact CA-OD1 3.45Å; S219-N316 PolarHBondContact OG-OD1 3.02Å
220	L	90.8	Very high	85.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.3	168.6	-65.7	171.8	0	0	0	112	I8 M11 L37 N222 L223 A312 L315 N316 L319	I8-L220 HydrophobicContact CD1-CD2 4.29Å; I8-L220 HydrophobicContact CG2-CD2 4.5Å; M11-L220 HydrophobicContact CB-CD2 4.25Å; M11-L220 HydrophobicContact CG-CD2 3.84Å; M11-L220 HydrophobicContact CG-CG 4.35Å; L37-L220 HydrophobicContact CD1-CD1 4.18Å; L37-L220 HydrophobicContact CD2-CD1 4.27Å; L220-N222 PolarHBondContact O-N 2.66Å; L220-L223 HydrophobicContact CD2-CD1 3.82Å; L220-L223 VanDerWaalsContact O-CB 3.3Å; L220-L223 WeakPolarHBondContact O-CB 3.33Å; L220-L223 PolarHBondContact O-N 2.76Å; L220-A312 HydrophobicContact CB-CB 4.3Å; L220-L315 HydrophobicContact CD1-CB 3.68Å; L220-N316 HydrophobicContact CB-CB 4.19Å; L220-N316 HydrophobicContact CD1-CB 4.37Å; L220-N316 HydrophobicContact CG-CB 4.45Å; L220-N316 PolarHBondContact N-OD1 3Å; L220-N316 VanDerWaalsContact N-OD1 3.13Å; L220-L319 HydrophobicContact CD1-CD1 4.35Å
221	L	89	Confident	85.7	Confident	23 Å²	23	55.8 Å²	55.8	12%	0.12	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.6	174.2	-173.5	67.5	0	0	0	112.7	S219 L223 T224 K225 H309	S219-L221 PolarHBondContact O-N 2.86Å; S219-L221 VanDerWaalsContact O-N 3.11Å; S219-L221 WeakPolarHBondContact OG-CB 3.46Å; S219-L221 PolarHBondContact OG-N 3.41Å; L221-L223 VanDerWaalsContact C-N 3.25Å; L221-L223 PolarHBondContact O-N 3.06Å; L221-T224 PolarHBondContact O-N 3.46Å; L221-T224 VanDerWaalsContact O-N 3.1Å; L221-T224 PolarHBondContact O-OG1 3.33Å; L221-K225 PolarHBondContact O-N 2.85Å; L221-H309 HydrophobicContact CD1-CB 3.89Å; L221-H309 WeakPolarHBondContact CD1-O 3.46Å
222	N	86.4	Confident	85.7	Confident	41 Å²	41	55.1 Å²	55.1	22%	0.219	26%	0.263	C	S	.	.	H	α-helix	trans	-72	-22.6	176.8	-69.9	-40.8	0	0	0	112.8	Q216 T217 S219 L220 T224 K225 S226	Q216-N222 PolarHBondContact O-ND2 3.28Å; T217-N222 WeakPolarHBondContact CA-ND2 3.37Å; T217-N222 PolarHBondContact O-ND2 3.35Å; S219-N222 WeakPolarHBondContact O-CB 3.48Å; S219-N222 PolarHBondContact O-N 3Å; L220-N222 PolarHBondContact O-N 2.66Å; N222-T224 PolarHBondContact O-N 3.15Å; N222-K225 PolarHBondContact O-N 2.96Å; N222-S226 PolarHBondContact O-OG 2.89Å
223	L	85.5	Confident	85.7	Confident	13 Å²	13	49.4 Å²	49.4	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-19.5	170.8	-56	176.7	0	0	0	111.8	I8 M11 L220 L221 H228 L229 F232	I8-L223 HydrophobicContact CD1-CD1 3.5Å; I8-L223 VanDerWaalsContact CD1-CD1 3.5Å; M11-L223 HydrophobicContact CE-CD2 3.87Å; M11-L223 HydrophobicContact CE-CG 4.03Å; L220-L223 HydrophobicContact CD2-CD1 3.82Å; L220-L223 VanDerWaalsContact O-CB 3.3Å; L220-L223 WeakPolarHBondContact O-CB 3.33Å; L220-L223 PolarHBondContact O-N 2.76Å; L221-L223 VanDerWaalsContact C-N 3.25Å; L221-L223 PolarHBondContact O-N 3.06Å; L223-H228 HydrophobicContact CD2-CB 4.27Å; L223-H228 CarbonylContact O-C 3.6Å; L223-L229 WeakPolarHBondContact O-CA 3.38Å; L223-L229 PolarHBondContact O-N 3.43Å; L223-F232 HydrophobicContact CB-CB 4.02Å; L223-F232 HydrophobicContact CB-CD2 4.16Å; L223-F232 HydrophobicContact CB-CG 4.28Å; L223-F232 HydrophobicContact CD1-CD2 4.08Å
224	T	83.5	Confident	85.5	Confident	4 Å²	4	44.8 Å²	44.8	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-98.3	-11	179.1	73.5	0	0	0	0	114.4	L221 N222 L229 F232 H309 A312	L221-T224 PolarHBondContact O-N 3.46Å; L221-T224 VanDerWaalsContact O-N 3.1Å; L221-T224 PolarHBondContact O-OG1 3.33Å; N222-T224 PolarHBondContact O-N 3.15Å; T224-L229 HydrophobicContact CG2-CD1 4.44Å; T224-F232 HydrophobicContact CG2-CD1 3.63Å; T224-F232 HydrophobicContact CG2-CE1 3.84Å; T224-F232 HydrophobicContact CG2-CG 4.18Å; T224-H309 WeakPolarHBondContact CB-CD2 3.47Å; T224-H309 PolarHBondContact O-NE2 3.49Å; T224-H309 VanDerWaalsContact O-NE2 3.12Å; T224-H309 PolarHBondContact OG1-CD2 3.32Å; T224-A312 HydrophobicContact CG2-CB 3.48Å; T224-A312 VanDerWaalsContact CG2-CB 3.48Å
225	K	76.8	Confident	85.4	Confident	139 Å²	139	43.1 Å²	43.1	60%	0.604	21%	0.209	S	C	*	.	H	α-helix	trans	-94.8	-11.5	179.6	-71.2	178.3	177.2	176.5	0	114	L221 N222	L221-K225 PolarHBondContact O-N 2.85Å; N222-K225 PolarHBondContact O-N 2.96Å
226	S	68.3	Low	85.4	Confident	40 Å²	40	38.2 Å²	38.2	28%	0.28	19%	0.191	S	C	.	.	S	Bend	trans	-118.2	-177.6	-167	57.3	0	0	0	0	111.8	N222 H228 L229	N222-S226 PolarHBondContact O-OG 2.89Å; S226-H228 PolarHBondContact O-N 2.99Å; S226-H228 WeakPolarHBondContact OG-CB 3.48Å; S226-H228 PolarHBondContact OG-CD2 3.46Å; S226-H228 PolarHBondContact OG-N 2.84Å; S226-L229 PolarHBondContact O-N 3.42Å
227	H	74	Confident	85.3	Confident	150 Å²	150	33.4 Å²	33.4	69%	0.694	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-10.1	168.7	62.9	-82.2	0	0	0	113.4
228	H	82.6	Confident	84.8	Confident	61 Å²	61	34 Å²	34	28%	0.282	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.2	174	-54.3	-53.3	0	0	0	115	L223 S226 K230 N231 F232	L223-H228 HydrophobicContact CD2-CB 4.27Å; L223-H228 CarbonylContact O-C 3.6Å; S226-H228 PolarHBondContact O-N 2.99Å; S226-H228 WeakPolarHBondContact OG-CB 3.48Å; S226-H228 PolarHBondContact OG-CD2 3.46Å; S226-H228 PolarHBondContact OG-N 2.84Å; H228-K230 PolarHBondContact O-N 3.27Å; H228-N231 WeakPolarHBondContact O-CA 3.34Å; H228-N231 VanDerWaalsContact O-CB 3.27Å; H228-N231 WeakPolarHBondContact O-CB 3.49Å; H228-N231 PolarHBondContact O-N 2.79Å; H228-F232 PolarHBondContact O-N 2.92Å
229	L	85.2	Confident	83.9	Confident	19 Å²	19	34.1 Å²	34.1	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-54.7	-42.4	-178.3	175.6	66.2	0	0	0	112	L223 T224 S226 N231 F232 L233 Y271 L308	L223-L229 WeakPolarHBondContact O-CA 3.38Å; L223-L229 PolarHBondContact O-N 3.43Å; T224-L229 HydrophobicContact CG2-CD1 4.44Å; S226-L229 PolarHBondContact O-N 3.42Å; L229-N231 VanDerWaalsContact C-N 3.34Å; L229-F232 PolarHBondContact O-N 3.33Å; L229-L233 WeakPolarHBondContact O-CB 3.32Å; L229-L233 PolarHBondContact O-N 3.25Å; L229-Y271 HydrophobicContact CD2-CE2 4.12Å; L229-L308 HydrophobicContact CD1-CD1 4.04Å
230	K	84.4	Confident	82.7	Confident	60 Å²	60	33 Å²	33	26%	0.261	16%	0.156	S	C	.	.	H	α-helix	trans	-65.3	-38.8	178	-62.6	-179	179.1	173.4	0	111.8	H228 L233 Y234 M264 N268 Y271	H228-K230 PolarHBondContact O-N 3.27Å; K230-L233 PolarHBondContact O-N 3.28Å; K230-Y234 VanDerWaalsContact O-CB 3.31Å; K230-Y234 WeakPolarHBondContact O-CB 3.44Å; K230-Y234 PolarHBondContact O-N 3.28Å; K230-M264 HydrophobicContact CD-CE 4.29Å; K230-N268 WeakPolarHBondContact CD-OD1 3.43Å; K230-N268 WeakPolarHBondContact CE-OD1 3.32Å; K230-N268 PolarHBondContact NZ-OD1 3.2Å; K230-Y271 HydrophobicContact CD-CD1 4.45Å; K230-Y271 HydrophobicContact CD-CG 4.37Å; K230-Y271 HydrophobicContact CG-CD1 4.44Å; K230-Y271 HydrophobicContact CG-CD2 4.04Å; K230-Y271 HydrophobicContact CG-CG 3.99Å
231	N	85.4	Confident	81.3	Confident	13 Å²	13	36.8 Å²	36.8	7%	0.07	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-46.2	175.7	-64.2	-5	0	0	0	110.9	I2 L4 H228 L229 Y234 W235	I2-N231 WeakPolarHBondContact CD1-OD1 3.41Å; L4-N231 HydrophobicContact CD2-CB 3.38Å; L4-N231 WeakPolarHBondContact CD2-O 2.93Å; H228-N231 WeakPolarHBondContact O-CA 3.34Å; H228-N231 VanDerWaalsContact O-CB 3.27Å; H228-N231 WeakPolarHBondContact O-CB 3.49Å; H228-N231 PolarHBondContact O-N 2.79Å; L229-N231 VanDerWaalsContact C-N 3.34Å; N231-Y234 PolarHBondContact O-N 3.01Å; N231-W235 WeakPolarHBondContact O-CB 3.42Å; N231-W235 PolarHBondContact O-N 3.47Å
232	F	89	Confident	79.7	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-45.2	177.1	-180	-102	0	0	0	111.7	I8 L223 T224 H228 L229 Y234 W235 F236 A312 L315	I8-F232 HydrophobicContact CD1-CD2 4.36Å; L223-F232 HydrophobicContact CB-CB 4.02Å; L223-F232 HydrophobicContact CB-CD2 4.16Å; L223-F232 HydrophobicContact CB-CG 4.28Å; L223-F232 HydrophobicContact CD1-CD2 4.08Å; T224-F232 HydrophobicContact CG2-CD1 3.63Å; T224-F232 HydrophobicContact CG2-CE1 3.84Å; T224-F232 HydrophobicContact CG2-CG 4.18Å; H228-F232 PolarHBondContact O-N 2.92Å; L229-F232 PolarHBondContact O-N 3.33Å; F232-Y234 VanDerWaalsContact C-N 3.32Å; F232-Y234 PolarHBondContact O-N 3.19Å; F232-W235 AromaticContact CD2-CE3 3.94Å; F232-W235 HydrophobicContact CD2-CE3 3.94Å; F232-W235 HydrophobicContact CD2-CZ3 4.22Å; F232-W235 AromaticContact CE2-CE3 3.8Å; F232-W235 HydrophobicContact CE2-CE3 3.8Å; F232-W235 AromaticContact CE2-CZ3 3.6Å; F232-W235 HydrophobicContact CE2-CZ3 3.6Å; F232-W235 HydrophobicContact CZ-CZ3 4.21Å; F232-W235 PolarHBondContact O-N 2.94Å; F232-F236 VanDerWaalsContact O-CB 3.28Å; F232-F236 WeakPolarHBondContact O-CB 3.12Å; F232-F236 PolarHBondContact O-N 2.91Å; F232-A312 HydrophobicContact CE1-CB 4.02Å; F232-A312 HydrophobicContact CE2-CB 4.39Å; F232-A312 HydrophobicContact CZ-CB 3.75Å; F232-L315 HydrophobicContact CZ-CD1 4.35Å
233	L	88.9	Confident	78	Confident	2 Å²	2	40 Å²	40	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-48.2	175.9	-179.8	71.7	0	0	0	111	L53 L229 K230 F236 Y237 Y270 Y271 M274 L308	L53-L233 HydrophobicContact CD2-CD1 3.86Å; L53-L233 HydrophobicContact CD2-CD2 4.21Å; L229-L233 WeakPolarHBondContact O-CB 3.32Å; L229-L233 PolarHBondContact O-N 3.25Å; K230-L233 PolarHBondContact O-N 3.28Å; L233-F236 PolarHBondContact O-N 2.99Å; L233-Y237 HydrophobicContact CD1-CD2 3.45Å; L233-Y237 VanDerWaalsContact CD1-CD2 3.45Å; L233-Y237 HydrophobicContact CD1-CE2 3.47Å; L233-Y237 VanDerWaalsContact CD1-CE2 3.47Å; L233-Y237 HydrophobicContact CG-CD2 4.12Å; L233-Y237 PolarHBondContact O-N 3.08Å; L233-Y270 HydrophobicContact CD2-CD1 4.34Å; L233-Y270 HydrophobicContact CD2-CE1 4.42Å; L233-Y270 HydrophobicContact CG-CE1 4.48Å; L233-Y271 HydrophobicContact CD2-CD2 3.73Å; L233-Y271 HydrophobicContact CD2-CG 4.45Å; L233-M274 HydrophobicContact CD1-CE 4.36Å; L233-M274 HydrophobicContact CD1-SD 3.88Å; L233-M274 HydrophobicContact CD2-SD 3.9Å; L233-M274 HydrophobicContact CG-SD 4.2Å; L233-L308 HydrophobicContact CD1-CD1 3.96Å; L233-L308 HydrophobicContact CD1-CD2 3.93Å
234	Y	85.9	Confident	76	Confident	25 Å²	25	45.4 Å²	45.4	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-46.2	-178.9	-166.4	-78.9	0	0	0	111.6	L4 K230 N231 F232 F236 Y237 Y238 I262 M267	L4-Y234 HydrophobicContact CD1-CD1 3.42Å; L4-Y234 VanDerWaalsContact CD1-CD1 3.42Å; L4-Y234 HydrophobicContact CD1-CE1 4.3Å; L4-Y234 HydrophobicContact CD1-CG 4.16Å; K230-Y234 VanDerWaalsContact O-CB 3.31Å; K230-Y234 WeakPolarHBondContact O-CB 3.44Å; K230-Y234 PolarHBondContact O-N 3.28Å; N231-Y234 PolarHBondContact O-N 3.01Å; F232-Y234 VanDerWaalsContact C-N 3.32Å; F232-Y234 PolarHBondContact O-N 3.19Å; Y234-F236 VanDerWaalsContact C-N 3.26Å; Y234-F236 PolarHBondContact O-N 3.01Å; Y234-Y237 PolarHBondContact O-N 2.96Å; Y234-Y238 HydrophobicContact CD1-CD2 4.34Å; Y234-Y238 AromaticContact CD2-CD2 3.59Å; Y234-Y238 HydrophobicContact CD2-CD2 3.59Å; Y234-Y238 HydrophobicContact CD2-CE2 4.04Å; Y234-Y238 HydrophobicContact CD2-CG 4.39Å; Y234-Y238 VanDerWaalsContact CE1-CB 3.46Å; Y234-Y238 HydrophobicContact CE1-CD2 4.11Å; Y234-Y238 AromaticContact CE1-CG 4Å; Y234-Y238 HydrophobicContact CE1-CG 4Å; Y234-Y238 AromaticContact CE2-CD2 3.39Å; Y234-Y238 HydrophobicContact CE2-CD2 3.39Å; Y234-Y238 AromaticContact CE2-CE2 3.76Å; Y234-Y238 HydrophobicContact CE2-CE2 3.76Å; Y234-Y238 AromaticContact CE2-CG 3.89Å; Y234-Y238 HydrophobicContact CE2-CG 3.89Å; Y234-Y238 HydrophobicContact CG-CD2 4.08Å; Y234-Y238 AromaticContact CZ-CD2 3.66Å; Y234-Y238 AromaticContact CZ-CG 3.65Å; Y234-Y238 WeakPolarHBondContact O-CB 3.48Å; Y234-Y238 PolarHBondContact O-N 3.24Å; Y234-I262 HydrophobicContact CD1-CD1 3.97Å; Y234-I262 HydrophobicContact CD2-CG2 4.44Å; Y234-I262 HydrophobicContact CE1-CB 4.44Å; Y234-I262 HydrophobicContact CE1-CD1 3.06Å; Y234-I262 HydrophobicContact CE1-CG1 3.79Å; Y234-I262 HydrophobicContact CE1-CG2 4.41Å; Y234-I262 HydrophobicContact CE2-CG1 4.4Å; Y234-I262 HydrophobicContact CE2-CG2 3.81Å; Y234-I262 WeakPolarHBondContact OH-CD1 3.17Å; Y234-I262 VanDerWaalsContact OH-CG1 3.24Å; Y234-I262 WeakPolarHBondContact OH-CG1 3.34Å; Y234-M267 HydrophobicContact CD2-CB 4.32Å; Y234-M267 HydrophobicContact CD2-CG 3.56Å; Y234-M267 HydrophobicContact CD2-SD 4.37Å; Y234-M267 HydrophobicContact CE2-CG 4.15Å; Y234-M267 HydrophobicContact CG-CG 3.85Å; Y234-M267 HydrophobicContact CG-SD 4.03Å
235	W	88.8	Confident	73.8	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.254	C	S	.	.	I	π-helix	trans	-54.8	-47.1	173.3	168.4	76	0	0	0	110.9	L4 I8 Y34 A41 N231 F232 C239 T240 L315	L4-W235 HydrophobicContact CB-CB 4.33Å; L4-W235 HydrophobicContact CD1-CB 4.4Å; I8-W235 HydrophobicContact CD1-CD2 3.89Å; I8-W235 HydrophobicContact CD1-CE3 4.02Å; I8-W235 HydrophobicContact CD1-CG 4.24Å; I8-W235 HydrophobicContact CD1-CZ3 4.46Å; I8-W235 HydrophobicContact CG1-CD2 3.8Å; I8-W235 HydrophobicContact CG1-CE3 4.43Å; I8-W235 HydrophobicContact CG1-CG 3.89Å; I8-W235 HydrophobicContact CG1-CZ2 4.38Å; I8-W235 HydrophobicContact CG2-CZ2 4.22Å; Y34-W235 AromaticContact CE2-NE1 3.75Å; Y34-W235 AromaticContact CZ-NE1 3.95Å; Y34-W235 PolarHBondContact OH-NE1 2.9Å; A41-W235 HydrophobicContact CB-CH2 4.09Å; N231-W235 WeakPolarHBondContact O-CB 3.42Å; N231-W235 PolarHBondContact O-N 3.47Å; F232-W235 AromaticContact CD2-CE3 3.94Å; F232-W235 HydrophobicContact CD2-CE3 3.94Å; F232-W235 HydrophobicContact CD2-CZ3 4.22Å; F232-W235 AromaticContact CE2-CE3 3.8Å; F232-W235 HydrophobicContact CE2-CE3 3.8Å; F232-W235 AromaticContact CE2-CZ3 3.6Å; F232-W235 HydrophobicContact CE2-CZ3 3.6Å; F232-W235 HydrophobicContact CZ-CZ3 4.21Å; F232-W235 PolarHBondContact O-N 2.94Å; W235-C239 PolarHBondContact O-N 3.08Å; W235-T240 WeakPolarHBondContact O-CG2 3.49Å; W235-T240 PolarHBondContact O-N 2.98Å; W235-L315 HydrophobicContact CH2-CD1 4.26Å; W235-L315 HydrophobicContact CZ3-CD1 4.15Å
236	F	89.2	Confident	71.9	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-64.4	-43.9	-177.4	-178.6	-108.2	0	0	0	112.5	A41 F44 L45 L48 F232 L233 Y234 T240 L311	A41-F236 HydrophobicContact CB-CD2 3.76Å; A41-F236 HydrophobicContact CB-CE2 3.73Å; F44-F236 HydrophobicContact CB-CE2 4.19Å; F44-F236 HydrophobicContact CB-CZ 3.88Å; L45-F236 WeakPolarHBondContact CD1-O 3.43Å; L45-F236 HydrophobicContact CD2-CD1 3.74Å; L45-F236 HydrophobicContact CD2-CE1 3.26Å; L45-F236 HydrophobicContact CD2-CE2 4.37Å; L45-F236 HydrophobicContact CD2-CG 4.46Å; L45-F236 HydrophobicContact CD2-CZ 3.62Å; L45-F236 HydrophobicContact CG-CD1 4.45Å; L45-F236 HydrophobicContact CG-CE1 3.88Å; L45-F236 HydrophobicContact CG-CE2 4.1Å; L45-F236 HydrophobicContact CG-CZ 3.67Å; L48-F236 HydrophobicContact CD1-CE1 4.09Å; L48-F236 HydrophobicContact CD1-CZ 3.92Å; F232-F236 VanDerWaalsContact O-CB 3.28Å; F232-F236 WeakPolarHBondContact O-CB 3.12Å; F232-F236 PolarHBondContact O-N 2.91Å; L233-F236 PolarHBondContact O-N 2.99Å; Y234-F236 VanDerWaalsContact C-N 3.26Å; Y234-F236 PolarHBondContact O-N 3.01Å; F236-T240 WeakPolarHBondContact O-CG2 3.16Å; F236-T240 PolarHBondContact O-OG1 3.13Å; F236-L311 HydrophobicContact CD1-CD2 3.82Å; F236-L311 HydrophobicContact CD2-CD2 3.85Å; F236-L311 HydrophobicContact CE1-CD2 3.49Å; F236-L311 VanDerWaalsContact CE1-CD2 3.49Å; F236-L311 HydrophobicContact CE2-CD1 4.1Å; F236-L311 HydrophobicContact CE2-CD2 3.54Å; F236-L311 HydrophobicContact CE2-CG 4.24Å; F236-L311 HydrophobicContact CG-CD2 4Å; F236-L311 HydrophobicContact CZ-CD1 4.1Å; F236-L311 HydrophobicContact CZ-CD2 3.36Å; F236-L311 HydrophobicContact CZ-CG 4.31Å
237	Y	85.2	Confident	70.4	Confident	10 Å²	10	53 Å²	53	4%	0.039	27%	0.271	C	S	.	.	I	π-helix	trans	-89.2	-23.7	-175.7	-84.6	-81.2	0	0	0	115.5	L45 P49 K52 L233 Y234 F241 Y270 M274	L45-Y237 HydrophobicContact CD2-CD1 3.52Å; L45-Y237 HydrophobicContact CD2-CE1 3.67Å; L45-Y237 HydrophobicContact CD2-CG 4.06Å; P49-Y237 WeakPolarHBondContact O-CE1 3.43Å; P49-Y237 PolarHBondContact O-OH 3.49Å; K52-Y237 PolarHBondContact O-OH 3.45Å; L233-Y237 HydrophobicContact CD1-CD2 3.45Å; L233-Y237 VanDerWaalsContact CD1-CD2 3.45Å; L233-Y237 HydrophobicContact CD1-CE2 3.47Å; L233-Y237 VanDerWaalsContact CD1-CE2 3.47Å; L233-Y237 HydrophobicContact CG-CD2 4.12Å; L233-Y237 PolarHBondContact O-N 3.08Å; Y234-Y237 PolarHBondContact O-N 2.96Å; Y237-F241 VanDerWaalsContact O-CD2 3.29Å; Y237-F241 WeakPolarHBondContact O-CD2 3.29Å; Y237-Y270 HydrophobicContact CG-CE1 4.37Å; Y237-M274 HydrophobicContact CD2-CE 4.09Å; Y237-M274 HydrophobicContact CD2-SD 4.06Å; Y237-M274 HydrophobicContact CE1-CE 4.01Å; Y237-M274 HydrophobicContact CE2-CE 3.42Å; Y237-M274 VanDerWaalsContact CE2-CE 3.42Å; Y237-M274 HydrophobicContact CE2-SD 3.96Å; Y237-M274 WeakPolarHBondContact OH-CE 3.41Å
238	Y	78.2	Confident	68.5	Low	79 Å²	79	52.6 Å²	52.6	31%	0.31	27%	0.274	S	S	.	.	I	π-helix	trans	-119.3	-48.2	-171.1	-74.7	-78	0	0	0	114	Y234 T240 F241 N242 Y270	Y234-Y238 HydrophobicContact CD1-CD2 4.34Å; Y234-Y238 AromaticContact CD2-CD2 3.59Å; Y234-Y238 HydrophobicContact CD2-CD2 3.59Å; Y234-Y238 HydrophobicContact CD2-CE2 4.04Å; Y234-Y238 HydrophobicContact CD2-CG 4.39Å; Y234-Y238 VanDerWaalsContact CE1-CB 3.46Å; Y234-Y238 HydrophobicContact CE1-CD2 4.11Å; Y234-Y238 AromaticContact CE1-CG 4Å; Y234-Y238 HydrophobicContact CE1-CG 4Å; Y234-Y238 AromaticContact CE2-CD2 3.39Å; Y234-Y238 HydrophobicContact CE2-CD2 3.39Å; Y234-Y238 AromaticContact CE2-CE2 3.76Å; Y234-Y238 HydrophobicContact CE2-CE2 3.76Å; Y234-Y238 AromaticContact CE2-CG 3.89Å; Y234-Y238 HydrophobicContact CE2-CG 3.89Å; Y234-Y238 HydrophobicContact CG-CD2 4.08Å; Y234-Y238 AromaticContact CZ-CD2 3.66Å; Y234-Y238 AromaticContact CZ-CG 3.65Å; Y234-Y238 WeakPolarHBondContact O-CB 3.48Å; Y234-Y238 PolarHBondContact O-N 3.24Å; Y238-T240 PolarHBondContact O-N 2.91Å; Y238-F241 PolarHBondContact O-N 3.42Å; Y238-N242 PolarHBondContact O-N 3.22Å; Y238-Y270 HydrophobicContact CD2-CD1 4.41Å; Y238-Y270 HydrophobicContact CD2-CE1 4.16Å; Y238-Y270 AromaticContact CE2-CD1 3.56Å; Y238-Y270 HydrophobicContact CE2-CD1 3.56Å; Y238-Y270 AromaticContact CE2-CD2 3.69Å; Y238-Y270 HydrophobicContact CE2-CD2 3.69Å; Y238-Y270 AromaticContact CE2-CE1 3.41Å; Y238-Y270 HydrophobicContact CE2-CE1 3.41Å; Y238-Y270 VanDerWaalsContact CE2-CE1 3.41Å; Y238-Y270 AromaticContact CE2-CE2 3.59Å; Y238-Y270 HydrophobicContact CE2-CE2 3.59Å; Y238-Y270 AromaticContact CE2-CG 3.66Å; Y238-Y270 HydrophobicContact CE2-CG 3.66Å; Y238-Y270 AromaticContact CE2-CZ 3.41Å; Y238-Y270 VanDerWaalsContact CE2-CZ 3.41Å; Y238-Y270 AromaticContact CZ-CD2 3.74Å; Y238-Y270 AromaticContact CZ-CE2 3.57Å; Y238-Y270 AromaticContact CZ-CZ 3.82Å; Y238-Y270 WeakPolarHBondContact OH-CD2 3.29Å; Y238-Y270 WeakPolarHBondContact OH-CE2 3.41Å
239	C	73.3	Confident	66.3	Low	11 Å²	11	56.8 Å²	56.8	7%	0.074	30%	0.299	C	S	.	.	I	π-helix	trans	-69.2	-26.4	-176	-62.6	0	0	0	0	112.5	W235	W235-C239 PolarHBondContact O-N 3.08Å
240	T	66.6	Low	64	Low	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-38.5	177.8	49.3	0	0	0	0	112.3	R38 A41 N42 L45 W235 F236 Y238	R38-T240 HydrophobicContact CG-CG2 4.37Å; A41-T240 HydrophobicContact CB-CG2 3.69Å; N42-T240 PolarHBondContact ND2-O 3.35Å; N42-T240 WeakPolarHBondContact OD1-CB 3.12Å; N42-T240 PolarHBondContact OD1-O 3.44Å; N42-T240 VanDerWaalsContact OD1-O 3.05Å; L45-T240 HydrophobicContact CD1-CG2 4.36Å; L45-T240 WeakPolarHBondContact CD1-OG1 3.5Å; W235-T240 WeakPolarHBondContact O-CG2 3.49Å; W235-T240 PolarHBondContact O-N 2.98Å; F236-T240 WeakPolarHBondContact O-CG2 3.16Å; F236-T240 PolarHBondContact O-OG1 3.13Å; Y238-T240 PolarHBondContact O-N 2.91Å
241	F	60.8	Low	61.4	Low	79 Å²	79	63.5 Å²	63.5	35%	0.346	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-36.9	-179.2	-78.4	-76.5	0	0	0	114.5	L45 Y237 Y238 T243	L45-F241 HydrophobicContact CB-CE2 3.76Å; L45-F241 HydrophobicContact CB-CZ 3.67Å; L45-F241 HydrophobicContact CD1-CD2 3.85Å; L45-F241 HydrophobicContact CD1-CE2 3.36Å; L45-F241 HydrophobicContact CD1-CZ 4.01Å; L45-F241 HydrophobicContact CD2-CE2 4.22Å; L45-F241 HydrophobicContact CG-CE2 3.99Å; L45-F241 HydrophobicContact CG-CZ 4.39Å; Y237-F241 VanDerWaalsContact O-CD2 3.29Å; Y237-F241 WeakPolarHBondContact O-CD2 3.29Å; Y238-F241 PolarHBondContact O-N 3.42Å; F241-T243 VanDerWaalsContact C-N 3.32Å; F241-T243 PolarHBondContact O-N 2.94Å
242	N	55.2	Low	58.8	Low	93 Å²	93	67.8 Å²	67.8	50%	0.497	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.8	-164	-82.8	-0.5	0	0	0	116.6	Y238 T245	Y238-N242 PolarHBondContact O-N 3.22Å; N242-T245 PolarHBondContact O-OG1 2.93Å
243	T	51.7	Low	56.1	Low	39 Å²	39	73.9 Å²	73.9	24%	0.239	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-2.9	-171.7	40.7	0	0	0	0	115.1	R38 F241 T246	R38-T243 PolarHBondContact NH1-OG1 3.38Å; F241-T243 VanDerWaalsContact C-N 3.32Å; F241-T243 PolarHBondContact O-N 2.94Å; T243-T246 PolarHBondContact O-OG1 2.89Å
244	N	43.9	Very low	53.5	Low	125 Å²	125	83.5 Å²	83.5	67%	0.668	46%	0.458	S	S	*	.	S	Bend	trans	-86.6	-6.5	177.4	-72.6	-18.3	0	0	0	113.8
245	T	36.9	Very low	51.1	Low	120 Å²	120	88.2 Å²	88.2	74%	0.736	49%	0.485	S	S	*	.	S	Bend	trans	-89.2	-9.1	-179.3	26.1	0	0	0	0	114.7	N242	N242-T245 PolarHBondContact O-OG1 2.93Å
246	T	37.5	Very low	48.5	Very low	78 Å²	78	92.9 Å²	92.9	48%	0.479	51%	0.51	S	S	.	.	S	Bend	trans	-99.7	-2.5	-170.8	24.3	0	0	0	0	116.3	T243	T243-T246 PolarHBondContact O-OG1 2.89Å
247	N	35.8	Very low	46.2	Very low	144 Å²	144	101 Å²	101	77%	0.77	55%	0.554	S	S	*	*	S	Bend	trans	-105.3	2.5	-173.4	-81.4	-8.9	0	0	0	116.7
248	N	34	Very low	44.1	Very low	143 Å²	143	108.5 Å²	108.5	77%	0.765	59%	0.586	S	S	*	*	S	Bend	trans	-136.6	85.2	174.6	-72.1	-29.4	0	0	0	109.4
249	N	36.2	Very low	42.6	Very low	149 Å²	149	110.6 Å²	110.6	80%	0.797	60%	0.599	S	S	*	*			trans	151.5	119.2	145.8	-74.7	-22	0	0	0	111.9
250	V	36.6	Very low	41.7	Very low	124 Å²	124	114 Å²	114	75%	0.752	62%	0.616	S	S	*	*				66	101.2	127.4	-175.7	0	0	0	0	117.2
251	S	30.5	Very low	41.2	Very low	96 Å²	96	118.3 Å²	118.3	67%	0.671	64%	0.638	S	S	*	*			trans	46.1	130.6	136.9	64.3	0	0	0	0	120.9
252	S	30.6	Very low	41.3	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	63%	0.629	S	S	*	*			trans	60	89.5	150.3	60.9	0	0	0	0	117.2
253	N	32	Very low	42	Very low	131 Å²	131	114.7 Å²	114.7	70%	0.701	63%	0.625	S	S	*	*			trans	-168.1	117.3	131.6	-108.7	-25.5	0	0	0	110.7	N255	N253-N255 PolarHBondContact O-N 3.3Å
254	E	35	Very low	43	Very low	204 Å²	204	116.9 Å²	116.9	95%	0.953	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	32.2	176.3	-70.3	-179.3	135.9	0	0	113.9
255	N	35.7	Very low	44.6	Very low	123 Å²	123	117.8 Å²	117.8	66%	0.658	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	7	-174.3	-84.5	-34	0	0	0	115.6	N253 N257	N253-N255 PolarHBondContact O-N 3.3Å; N255-N257 VanDerWaalsContact C-N 3.34Å; N255-N257 PolarHBondContact O-N 2.77Å
256	N	34.8	Very low	46.5	Very low	99 Å²	99	117 Å²	117	53%	0.529	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-84.3	6.4	-174	-70.9	-3.6	0	0	0	115.9	K258	N256-K258 PolarHBondContact O-N 2.83Å
257	N	40	Very low	48.5	Very low	172 Å²	172	113.6 Å²	113.6	92%	0.92	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-76.7	7.4	174.2	-82.8	-13.6	0	0	0	114.6	N255	N255-N257 VanDerWaalsContact C-N 3.34Å; N255-N257 PolarHBondContact O-N 2.77Å
258	K	42	Very low	50.6	Low	166 Å²	166	109 Å²	109	72%	0.722	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-94.6	-3.1	176.1	-79.9	-177.6	176.8	175.4	0	114.8	N256 N260 I261	N256-K258 PolarHBondContact O-N 2.83Å; K258-N260 PolarHBondContact O-N 2.83Å; K258-N260 VanDerWaalsContact O-N 3.17Å; K258-I261 HydrophobicContact CG-CD1 4.43Å
259	E	45.4	Very low	53	Low	124 Å²	124	108.8 Å²	108.8	58%	0.579	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	9.9	-163.2	-74.6	-167.9	145.8	0	0	118
260	N	53.9	Low	55.2	Low	81 Å²	81	103.5 Å²	103.5	43%	0.433	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	29.2	171.9	-85.8	-41.4	0	0	0	113.1	K258 I262	K258-N260 PolarHBondContact O-N 2.83Å; K258-N260 VanDerWaalsContact O-N 3.17Å; N260-I262 PolarHBondContact O-N 2.91Å
261	I	55.9	Low	57.4	Low	92 Å²	92	99 Å²	99	47%	0.472	51%	0.51	S	S	.	.			trans	-87.6	96.3	176.7	-52.5	-179.1	0	0	0	108.7	M1 K258	M1-I261 HydrophobicContact CE-CD1 4.22Å; M1-I261 HydrophobicContact CE-CG1 3.87Å; M1-I261 HydrophobicContact CE-CG2 4.46Å; M1-I261 HydrophobicContact CG-CG2 4.41Å; M1-I261 HydrophobicContact SD-CG2 4.17Å; K258-I261 HydrophobicContact CG-CD1 4.43Å
262	I	63.3	Low	60	Low	28 Å²	28	98.7 Å²	98.7	14%	0.144	50%	0.5	C	S	.	.			trans	-109.9	131.7	175.5	-59.3	122.6	0	0	0	109.2	Y234 N260 M266 M267	Y234-I262 HydrophobicContact CD1-CD1 3.97Å; Y234-I262 HydrophobicContact CD2-CG2 4.44Å; Y234-I262 HydrophobicContact CE1-CB 4.44Å; Y234-I262 HydrophobicContact CE1-CD1 3.06Å; Y234-I262 HydrophobicContact CE1-CG1 3.79Å; Y234-I262 HydrophobicContact CE1-CG2 4.41Å; Y234-I262 HydrophobicContact CE2-CG1 4.4Å; Y234-I262 HydrophobicContact CE2-CG2 3.81Å; Y234-I262 WeakPolarHBondContact OH-CD1 3.17Å; Y234-I262 VanDerWaalsContact OH-CG1 3.24Å; Y234-I262 WeakPolarHBondContact OH-CG1 3.34Å; N260-I262 PolarHBondContact O-N 2.91Å; I262-M266 HydrophobicContact CG2-CB 3.89Å; I262-M267 HydrophobicContact CG2-CG 3.59Å; I262-M267 HydrophobicContact CG2-SD 4.48Å
263	T	70.7	Confident	62.7	Low	67 Å²	67	100.3 Å²	100.3	41%	0.411	50%	0.495	S	S	.	.			trans	-75.4	150.5	175.1	65.2	0	0	0	0	110	E265 M266 M267	T263-E265 PolarHBondContact O-N 2.97Å; T263-E265 VanDerWaalsContact O-N 3.17Å; T263-M266 PolarHBondContact O-N 2.87Å; T263-M266 WeakPolarHBondContact OG1-CG 3.39Å; T263-M266 PolarHBondContact OG1-N 3.26Å; T263-M267 PolarHBondContact O-N 3.03Å
264	M	71.9	Confident	65.2	Low	86 Å²	86	94.2 Å²	94.2	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-56.8	-30.9	174.6	-167.9	70.2	-168.6	0	0	111.6	I2 K230 M267 N268	I2-M264 HydrophobicContact CD1-SD 4.21Å; K230-M264 HydrophobicContact CD-CE 4.29Å; M264-M267 PolarHBondContact O-N 3.22Å; M264-M267 HydrophobicContact SD-CE 3.69Å; M264-N268 WeakPolarHBondContact O-CB 3.25Å; M264-N268 PolarHBondContact O-N 3.2Å; M264-N268 PolarHBondContact O-ND2 3.44Å
265	E	77	Confident	67.6	Low	143 Å²	143	86 Å²	86	67%	0.668	42%	0.424	S	S	*	.	H	α-helix	trans	-63	-50.7	176.6	-67.2	172.6	173.9	0	0	112.1	T263 M267 N268 E269	T263-E265 PolarHBondContact O-N 2.97Å; T263-E265 VanDerWaalsContact O-N 3.17Å; E265-M267 VanDerWaalsContact C-N 3.3Å; E265-M267 PolarHBondContact O-N 3.21Å; E265-N268 WeakPolarHBondContact O-CB 3.48Å; E265-N268 PolarHBondContact O-N 3.36Å; E265-E269 PolarHBondContact O-N 3.02Å
266	M	77.4	Confident	69.9	Low	104 Å²	104	84.7 Å²	84.7	51%	0.512	42%	0.418	S	S	.	.	H	α-helix	trans	-59.1	-41.3	177.2	-70.6	173.9	73.3	0	0	112.1	I262 T263 N268 Y270	I262-M266 HydrophobicContact CG2-CB 3.89Å; T263-M266 PolarHBondContact O-N 2.87Å; T263-M266 WeakPolarHBondContact OG1-CG 3.39Å; T263-M266 PolarHBondContact OG1-N 3.26Å; M266-N268 VanDerWaalsContact C-N 3.33Å; M266-N268 PolarHBondContact O-N 2.93Å; M266-Y270 WeakPolarHBondContact O-CB 3.31Å; M266-Y270 PolarHBondContact O-N 3.37Å; M266-Y270 VanDerWaalsContact O-N 3.1Å
267	M	79.1	Confident	72.2	Confident	7 Å²	7	82.8 Å²	82.8	3%	0.034	41%	0.407	C	S	.	.	H	α-helix	trans	-64.1	-39.4	175.6	-66.2	-168.7	-75.5	0	0	111.9	I2 Y234 I262 T263 M264 E265 Y271	I2-M267 HydrophobicContact CD1-CE 4.2Å; Y234-M267 HydrophobicContact CD2-CB 4.32Å; Y234-M267 HydrophobicContact CD2-CG 3.56Å; Y234-M267 HydrophobicContact CD2-SD 4.37Å; Y234-M267 HydrophobicContact CE2-CG 4.15Å; Y234-M267 HydrophobicContact CG-CG 3.85Å; Y234-M267 HydrophobicContact CG-SD 4.03Å; I262-M267 HydrophobicContact CG2-CG 3.59Å; I262-M267 HydrophobicContact CG2-SD 4.48Å; T263-M267 PolarHBondContact O-N 3.03Å; M264-M267 PolarHBondContact O-N 3.22Å; M264-M267 HydrophobicContact SD-CE 3.69Å; E265-M267 VanDerWaalsContact C-N 3.3Å; E265-M267 PolarHBondContact O-N 3.21Å; M267-Y271 VanDerWaalsContact O-CB 3.27Å; M267-Y271 WeakPolarHBondContact O-CB 3.39Å; M267-Y271 PolarHBondContact O-N 2.87Å
268	N	80.5	Confident	74.2	Confident	46 Å²	46	75.6 Å²	75.6	25%	0.246	37%	0.371	C	S	.	.	H	α-helix	trans	-66.1	-46.9	178.8	-75.5	-24.9	0	0	0	111.9	K230 M264 E265 M266 Y270 Y271 L272	K230-N268 WeakPolarHBondContact CD-OD1 3.43Å; K230-N268 WeakPolarHBondContact CE-OD1 3.32Å; K230-N268 PolarHBondContact NZ-OD1 3.2Å; M264-N268 WeakPolarHBondContact O-CB 3.25Å; M264-N268 PolarHBondContact O-N 3.2Å; M264-N268 PolarHBondContact O-ND2 3.44Å; E265-N268 WeakPolarHBondContact O-CB 3.48Å; E265-N268 PolarHBondContact O-N 3.36Å; M266-N268 VanDerWaalsContact C-N 3.33Å; M266-N268 PolarHBondContact O-N 2.93Å; N268-Y270 PolarHBondContact O-N 3.47Å; N268-Y271 PolarHBondContact O-N 2.98Å; N268-L272 WeakPolarHBondContact O-CG 3.22Å; N268-L272 PolarHBondContact O-N 2.91Å
269	E	83.7	Confident	75.6	Confident	140 Å²	140	70.9 Å²	70.9	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-61.1	-45.1	178.4	-72	-174.3	167.5	0	0	111.5	E265 Y271 L272 K273	E265-E269 PolarHBondContact O-N 3.02Å; E269-Y271 PolarHBondContact O-N 3.33Å; E269-L272 PolarHBondContact O-N 3.41Å; E269-K273 WeakPolarHBondContact O-CB 3.35Å; E269-K273 PolarHBondContact O-N 3.34Å
270	Y	82.4	Confident	76.4	Confident	37 Å²	37	68 Å²	68	15%	0.145	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-46.6	177.1	-178.1	-106.1	0	0	0	112.1	L233 Y237 Y238 M266 N268 L272 K273 M274	L233-Y270 HydrophobicContact CD2-CD1 4.34Å; L233-Y270 HydrophobicContact CD2-CE1 4.42Å; L233-Y270 HydrophobicContact CG-CE1 4.48Å; Y237-Y270 HydrophobicContact CG-CE1 4.37Å; Y238-Y270 HydrophobicContact CD2-CD1 4.41Å; Y238-Y270 HydrophobicContact CD2-CE1 4.16Å; Y238-Y270 AromaticContact CE2-CD1 3.56Å; Y238-Y270 HydrophobicContact CE2-CD1 3.56Å; Y238-Y270 AromaticContact CE2-CD2 3.69Å; Y238-Y270 HydrophobicContact CE2-CD2 3.69Å; Y238-Y270 AromaticContact CE2-CE1 3.41Å; Y238-Y270 HydrophobicContact CE2-CE1 3.41Å; Y238-Y270 VanDerWaalsContact CE2-CE1 3.41Å; Y238-Y270 AromaticContact CE2-CE2 3.59Å; Y238-Y270 HydrophobicContact CE2-CE2 3.59Å; Y238-Y270 AromaticContact CE2-CG 3.66Å; Y238-Y270 HydrophobicContact CE2-CG 3.66Å; Y238-Y270 AromaticContact CE2-CZ 3.41Å; Y238-Y270 VanDerWaalsContact CE2-CZ 3.41Å; Y238-Y270 AromaticContact CZ-CD2 3.74Å; Y238-Y270 AromaticContact CZ-CE2 3.57Å; Y238-Y270 AromaticContact CZ-CZ 3.82Å; Y238-Y270 WeakPolarHBondContact OH-CD2 3.29Å; Y238-Y270 WeakPolarHBondContact OH-CE2 3.41Å; M266-Y270 WeakPolarHBondContact O-CB 3.31Å; M266-Y270 PolarHBondContact O-N 3.37Å; M266-Y270 VanDerWaalsContact O-N 3.1Å; N268-Y270 PolarHBondContact O-N 3.47Å; Y270-L272 VanDerWaalsContact C-N 3.35Å; Y270-L272 PolarHBondContact O-N 3.08Å; Y270-K273 PolarHBondContact O-N 3.39Å; Y270-M274 HydrophobicContact CD1-CG 4.33Å; Y270-M274 HydrophobicContact CD1-SD 4.01Å; Y270-M274 HydrophobicContact CE1-CG 3.9Å; Y270-M274 HydrophobicContact CE1-SD 3.2Å; Y270-M274 WeakPolarHBondContact CE1-SD 3.32Å; Y270-M274 HydrophobicContact CE2-CG 4.21Å; Y270-M274 HydrophobicContact CE2-SD 4.37Å; Y270-M274 PolarHBondContact O-N 3.43Å; Y270-M274 PolarHBondContact OH-SD 3.41Å
271	Y	83.7	Confident	76.3	Confident	30 Å²	30	67.3 Å²	67.3	12%	0.118	35%	0.351	C	S	.	.	H	α-helix	trans	-57.3	-47.1	176.2	169.6	-95	0	0	0	111.8	L229 K230 L233 M267 N268 E269 K273 M274 L275 H305	L229-Y271 HydrophobicContact CD2-CE2 4.12Å; K230-Y271 HydrophobicContact CD-CD1 4.45Å; K230-Y271 HydrophobicContact CD-CG 4.37Å; K230-Y271 HydrophobicContact CG-CD1 4.44Å; K230-Y271 HydrophobicContact CG-CD2 4.04Å; K230-Y271 HydrophobicContact CG-CG 3.99Å; L233-Y271 HydrophobicContact CD2-CD2 3.73Å; L233-Y271 HydrophobicContact CD2-CG 4.45Å; M267-Y271 VanDerWaalsContact O-CB 3.27Å; M267-Y271 WeakPolarHBondContact O-CB 3.39Å; M267-Y271 PolarHBondContact O-N 2.87Å; N268-Y271 PolarHBondContact O-N 2.98Å; E269-Y271 PolarHBondContact O-N 3.33Å; Y271-K273 VanDerWaalsContact C-N 3.35Å; Y271-K273 PolarHBondContact O-N 2.89Å; Y271-M274 PolarHBondContact O-N 3.18Å; Y271-L275 HydrophobicContact CE1-CD2 4.14Å; Y271-L275 WeakPolarHBondContact O-CB 3.45Å; Y271-L275 PolarHBondContact O-N 3.45Å; Y271-H305 AromaticContact CE2-CE1 3.66Å; Y271-H305 AromaticContact CZ-CE1 3.71Å; Y271-H305 PolarHBondContact OH-CE1 3.16Å; Y271-H305 PolarHBondContact OH-NE2 3.12Å
272	L	85.2	Confident	76.1	Confident	89 Å²	89	67.1 Å²	67.1	47%	0.466	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-40.4	178.6	-71.7	173.6	0	0	0	111.8	N268 E269 Y270 L275 N276	N268-L272 WeakPolarHBondContact O-CG 3.22Å; N268-L272 PolarHBondContact O-N 2.91Å; E269-L272 PolarHBondContact O-N 3.41Å; Y270-L272 VanDerWaalsContact C-N 3.35Å; Y270-L272 PolarHBondContact O-N 3.08Å; L272-L275 PolarHBondContact O-N 2.84Å; L272-N276 WeakPolarHBondContact O-CB 3.31Å; L272-N276 PolarHBondContact O-N 3.21Å; L272-N276 PolarHBondContact O-ND2 3.34Å
273	K	86.2	Confident	75.1	Confident	137 Å²	137	70.1 Å²	70.1	60%	0.596	38%	0.381	S	S	*	.	H	α-helix	trans	-60.5	-47.8	175.6	-174.6	176.9	-178.3	176.1	0	111.7	E269 Y270 Y271 L275 N276 N277	E269-K273 WeakPolarHBondContact O-CB 3.35Å; E269-K273 PolarHBondContact O-N 3.34Å; Y270-K273 PolarHBondContact O-N 3.39Å; Y271-K273 VanDerWaalsContact C-N 3.35Å; Y271-K273 PolarHBondContact O-N 2.89Å; K273-L275 VanDerWaalsContact C-N 3.35Å; K273-L275 PolarHBondContact O-N 3.2Å; K273-N276 PolarHBondContact O-N 2.84Å; K273-N277 WeakPolarHBondContact O-CB 3.38Å; K273-N277 VanDerWaalsContact O-CG 3.22Å; K273-N277 PolarHBondContact O-N 3.44Å; K273-N277 VanDerWaalsContact O-N 3.07Å; K273-N277 PolarHBondContact O-ND2 3.21Å
274	M	85.2	Confident	73.5	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.015	40%	0.396	C	S	.	.	H	α-helix	trans	-63.2	-41	176.7	-73.8	-165.2	78.7	0	0	112.4	K52 L53 L233 Y237 Y270 Y271 N277 S278	K52-M274 WeakPolarHBondContact O-CE 3.4Å; L53-M274 HydrophobicContact CD2-CB 3.94Å; L53-M274 HydrophobicContact CD2-CE 3.93Å; L53-M274 HydrophobicContact CD2-SD 4.19Å; L53-M274 HydrophobicContact CG-CB 4.22Å; L233-M274 HydrophobicContact CD1-CE 4.36Å; L233-M274 HydrophobicContact CD1-SD 3.88Å; L233-M274 HydrophobicContact CD2-SD 3.9Å; L233-M274 HydrophobicContact CG-SD 4.2Å; Y237-M274 HydrophobicContact CD2-CE 4.09Å; Y237-M274 HydrophobicContact CD2-SD 4.06Å; Y237-M274 HydrophobicContact CE1-CE 4.01Å; Y237-M274 HydrophobicContact CE2-CE 3.42Å; Y237-M274 VanDerWaalsContact CE2-CE 3.42Å; Y237-M274 HydrophobicContact CE2-SD 3.96Å; Y237-M274 WeakPolarHBondContact OH-CE 3.41Å; Y270-M274 HydrophobicContact CD1-CG 4.33Å; Y270-M274 HydrophobicContact CD1-SD 4.01Å; Y270-M274 HydrophobicContact CE1-CG 3.9Å; Y270-M274 HydrophobicContact CE1-SD 3.2Å; Y270-M274 WeakPolarHBondContact CE1-SD 3.32Å; Y270-M274 HydrophobicContact CE2-CG 4.21Å; Y270-M274 HydrophobicContact CE2-SD 4.37Å; Y270-M274 PolarHBondContact O-N 3.43Å; Y270-M274 PolarHBondContact OH-SD 3.41Å; Y271-M274 PolarHBondContact O-N 3.18Å; M274-N277 PolarHBondContact O-N 3.24Å; M274-S278 PolarHBondContact O-N 3.46Å; M274-S278 PolarHBondContact O-OG 3.38Å
275	L	85.3	Confident	71.8	Confident	32 Å²	32	72.6 Å²	72.6	17%	0.168	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-47.5	179	-174	65.5	0	0	0	111.1	L53 Y271 L272 K273 N277 S278 T279 P304	L53-L275 HydrophobicContact CD1-CD1 3.89Å; Y271-L275 HydrophobicContact CE1-CD2 4.14Å; Y271-L275 WeakPolarHBondContact O-CB 3.45Å; Y271-L275 PolarHBondContact O-N 3.45Å; L272-L275 PolarHBondContact O-N 2.84Å; K273-L275 VanDerWaalsContact C-N 3.35Å; K273-L275 PolarHBondContact O-N 3.2Å; L275-N277 VanDerWaalsContact C-N 3.33Å; L275-N277 PolarHBondContact O-N 2.88Å; L275-S278 WeakPolarHBondContact O-CA 3.33Å; L275-S278 WeakPolarHBondContact O-CB 3.29Å; L275-S278 PolarHBondContact O-N 3.08Å; L275-T279 PolarHBondContact O-N 3.37Å; L275-T279 PolarHBondContact O-OG1 2.88Å; L275-P304 HydrophobicContact CD1-CB 3.74Å; L275-P304 HydrophobicContact CD1-CG 3.98Å
276	N	84.9	Confident	69.6	Low	96 Å²	96	71.2 Å²	71.2	51%	0.513	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-39.6	178.1	-71.6	-12.8	0	0	0	112.3	L272 K273 S278 T279 S280	L272-N276 WeakPolarHBondContact O-CB 3.31Å; L272-N276 PolarHBondContact O-N 3.21Å; L272-N276 PolarHBondContact O-ND2 3.34Å; K273-N276 PolarHBondContact O-N 2.84Å; N276-S278 VanDerWaalsContact C-N 3.25Å; N276-S278 PolarHBondContact O-N 2.9Å; N276-T279 PolarHBondContact O-N 3.15Å; N276-T279 PolarHBondContact O-OG1 2.9Å; N276-S280 WeakPolarHBondContact O-CB 3.47Å; N276-S280 PolarHBondContact O-N 2.79Å; N276-S280 PolarHBondContact O-OG 2.65Å
277	N	82.9	Confident	67.4	Low	59 Å²	59	71.2 Å²	71.2	32%	0.316	43%	0.432	S	S	.	.	H	α-helix	trans	-67.6	-27.5	174.7	-70.2	-13.2	0	0	0	112.6	S51 K52 K273 M274 L275 S280	S51-N277 VanDerWaalsContact O-CB 3.24Å; S51-N277 WeakPolarHBondContact O-CB 3.49Å; S51-N277 PolarHBondContact O-ND2 3.37Å; K52-N277 HydrophobicContact CB-CB 4.16Å; K273-N277 WeakPolarHBondContact O-CB 3.38Å; K273-N277 VanDerWaalsContact O-CG 3.22Å; K273-N277 PolarHBondContact O-N 3.44Å; K273-N277 VanDerWaalsContact O-N 3.07Å; K273-N277 PolarHBondContact O-ND2 3.21Å; M274-N277 PolarHBondContact O-N 3.24Å; L275-N277 VanDerWaalsContact C-N 3.33Å; L275-N277 PolarHBondContact O-N 2.88Å; N277-S280 WeakPolarHBondContact CA-OG 3.37Å; N277-S280 PolarHBondContact O-OG 2.8Å
278	S	80.8	Confident	65.3	Low	21 Å²	21	76.1 Å²	76.1	15%	0.147	47%	0.467	C	S	.	.	H	α-helix	trans	-76.2	-42.3	177.1	-51.6	0	0	0	0	111.1	L53 M274 L275 N276 S281	L53-S278 WeakPolarHBondContact CB-OG 3.39Å; L53-S278 WeakPolarHBondContact CG-OG 3.28Å; L53-S278 PolarHBondContact N-OG 2.8Å; M274-S278 PolarHBondContact O-N 3.46Å; M274-S278 PolarHBondContact O-OG 3.38Å; L275-S278 WeakPolarHBondContact O-CA 3.33Å; L275-S278 WeakPolarHBondContact O-CB 3.29Å; L275-S278 PolarHBondContact O-N 3.08Å; N276-S278 VanDerWaalsContact C-N 3.25Å; N276-S278 PolarHBondContact O-N 2.9Å; S278-S281 PolarHBondContact O-OG 3.2Å
279	T	73.1	Confident	63	Low	67 Å²	67	79.5 Å²	79.5	41%	0.411	49%	0.494	S	S	.	.	H	α-helix	trans	-75.7	-38.8	-178.8	53.9	0	0	0	0	113.1	L275 N276 S281 S282	L275-T279 PolarHBondContact O-N 3.37Å; L275-T279 PolarHBondContact O-OG1 2.88Å; N276-T279 PolarHBondContact O-N 3.15Å; N276-T279 PolarHBondContact O-OG1 2.9Å; T279-S281 PolarHBondContact O-N 2.76Å; T279-S282 PolarHBondContact O-N 3.29Å; T279-S282 PolarHBondContact O-OG 2.83Å
280	S	60.5	Low	60.6	Low	63 Å²	63	78.6 Å²	78.6	44%	0.441	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-28.2	177.3	50.9	0	0	0	0	113.6	N276 N277 S282 S283	N276-S280 WeakPolarHBondContact O-CB 3.47Å; N276-S280 PolarHBondContact O-N 2.79Å; N276-S280 PolarHBondContact O-OG 2.65Å; N277-S280 WeakPolarHBondContact CA-OG 3.37Å; N277-S280 PolarHBondContact O-OG 2.8Å; S280-S282 VanDerWaalsContact C-N 3.26Å; S280-S282 PolarHBondContact O-N 3.14Å; S280-S283 PolarHBondContact O-OG 3.41Å
281	S	53.4	Low	58	Low	66 Å²	66	82.6 Å²	82.6	46%	0.462	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.8	174.8	70	0	0	0	0	113.9	S278 T279	S278-S281 PolarHBondContact O-OG 3.2Å; T279-S281 PolarHBondContact O-N 2.76Å
282	S	50.4	Low	55.4	Low	88 Å²	88	85.8 Å²	85.8	62%	0.615	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-14.6	178.9	59	0	0	0	0	114.7	T279 S280	T279-S282 PolarHBondContact O-N 3.29Å; T279-S282 PolarHBondContact O-OG 2.83Å; S280-S282 VanDerWaalsContact C-N 3.26Å; S280-S282 PolarHBondContact O-N 3.14Å
283	S	42.3	Very low	52.7	Low	92 Å²	92	88.4 Å²	88.4	64%	0.643	58%	0.583	S	S	*	*	S	Bend	trans	-99.4	0.7	-173.1	50.2	0	0	0	0	115.3	S280	S280-S283 PolarHBondContact O-OG 3.41Å
284	S	37.8	Very low	50.1	Low	102 Å²	102	89.1 Å²	89.1	71%	0.713	59%	0.592	S	S	*	*	S	Bend	trans	-97.3	8.8	-174.8	43.9	0	0	0	0	115.3
285	S	35.8	Very low	47.4	Very low	102 Å²	102	95.4 Å²	95.4	71%	0.713	63%	0.626	S	S	*	*			trans	-127.4	68.9	-178.5	61.5	0	0	0	0	113.3
286	S	31.4	Very low	44.6	Very low	115 Å²	115	100.1 Å²	100.1	80%	0.804	66%	0.661	S	S	*	*			trans	-165.9	77	161.2	58.9	0	0	0	0	111.6
287	A	30.6	Very low	41.8	Very low	103 Å²	103	101.2 Å²	101.2	85%	0.851	67%	0.672	S	S	*	*			trans	-146	68.6	166	0	0	0	0	0	109.8
288	S	36	Very low	39.2	Very low	110 Å²	110	103.8 Å²	103.8	77%	0.769	70%	0.695	S	S	*	*			trans	-161.9	93.5	164.5	53.5	0	0	0	0	110.7
289	S	30.7	Very low	36.7	Very low	117 Å²	117	109.3 Å²	109.3	82%	0.818	73%	0.727	S	S	*	*			trans	21.8	111.3	139.8	56.8	0	0	0	0	119.2
290	S	33.4	Very low	34.8	Very low	122 Å²	122	109.3 Å²	109.3	85%	0.853	73%	0.73	S	S	*	*				176.2	133.3	121.1	53.2	0	0	0	0	111.2
291	S	28.1	Very low	33.9	Very low	120 Å²	120	109.7 Å²	109.7	84%	0.839	74%	0.744	S	S	*	*			trans	-59.8	127.7	178.5	54.9	0	0	0	0	114
292	S	29.7	Very low	34.2	Very low	98 Å²	98	109.7 Å²	109.7	69%	0.685	74%	0.744	S	S	*	*			trans	-171.8	126.6	139.3	52.8	0	0	0	0	110.2	I294	S292-I294 PolarHBondContact O-N 2.8Å
293	T	27.4	Very low	35.2	Very low	143 Å²	143	108.1 Å²	108.1	88%	0.877	73%	0.733	S	S	*	*			trans	-33.6	109.7	172.3	-34.9	0	0	0	0	113.8
294	I	33.1	Very low	36.6	Very low	152 Å²	152	107 Å²	107	78%	0.779	72%	0.724	S	S	*	*			trans	-131.5	121.8	167.3	-62.6	178.3	0	0	0	108.7	S292 S296	S292-I294 PolarHBondContact O-N 2.8Å; I294-S296 PolarHBondContact O-N 2.73Å
295	N	28.3	Very low	38.8	Very low	136 Å²	136	103.4 Å²	103.4	73%	0.727	70%	0.696	S	S	*	*			trans	-47.1	128.8	177.1	-77	-25.8	0	0	0	112.4	T297	N295-T297 VanDerWaalsContact C-N 3.34Å; N295-T297 PolarHBondContact O-N 3.39Å
296	S	25.5	Very low	41.3	Very low	130 Å²	130	100 Å²	100	91%	0.909	67%	0.668	S	S	*	*			trans	-54.5	88	166.3	30.6	0	0	0	0	111.4	I294	I294-S296 PolarHBondContact O-N 2.73Å
297	T	27.2	Very low	44.1	Very low	120 Å²	120	94.6 Å²	94.6	74%	0.736	63%	0.631	S	S	*	*			trans	-103.8	108.1	159.8	-31.2	0	0	0	0	106	N295 T299	N295-T297 VanDerWaalsContact C-N 3.34Å; N295-T297 PolarHBondContact O-N 3.39Å; T297-T299 PolarHBondContact O-N 2.71Å
298	S	26.7	Very low	46.9	Very low	113 Å²	113	89.7 Å²	89.7	79%	0.79	59%	0.591	S	S	*	*			trans	-45.3	103.9	-179.9	37.8	0	0	0	0	112	S300	S298-S300 VanDerWaalsContact C-N 3.35Å; S298-S300 PolarHBondContact O-N 2.84Å
299	T	28.3	Very low	49.5	Very low	136 Å²	136	86.1 Å²	86.1	83%	0.834	56%	0.562	S	S	*	*			trans	-60.8	99.5	163.1	43.1	0	0	0	0	107.5	T297 G301	T297-T299 PolarHBondContact O-N 2.71Å; T299-G301 VanDerWaalsContact C-N 3.33Å; T299-G301 PolarHBondContact O-N 2.9Å
300	S	34.9	Very low	52.5	Low	67 Å²	67	80.6 Å²	80.6	47%	0.469	52%	0.523	S	S	.	.			trans	-57.2	95.9	168.8	54	0	0	0	0	108.4	S139 S298 S302	S139-S300 PolarHBondContact OG-OG 3.37Å; S298-S300 VanDerWaalsContact C-N 3.35Å; S298-S300 PolarHBondContact O-N 2.84Å; S300-S302 PolarHBondContact O-N 3.43Å
301	G	41.2	Very low	55.4	Low	71 Å²	71	74.8 Å²	74.8	73%	0.732	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-55.7	123.4	-179.7	0	0	0	0	0	110.1	T299 S303	T299-G301 VanDerWaalsContact C-N 3.33Å; T299-G301 PolarHBondContact O-N 2.9Å; G301-S303 PolarHBondContact O-N 2.99Å
302	S	59.4	Low	58.5	Low	67 Å²	67	69 Å²	69	47%	0.469	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-56.5	132.7	171.5	50.5	0	0	0	0	109.1	S300 E306	S300-S302 PolarHBondContact O-N 3.43Å; S302-E306 WeakPolarHBondContact CB-OE2 3.08Å
303	S	72.3	Confident	61.6	Low	55 Å²	55	67.1 Å²	67.1	39%	0.385	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-55.2	141.3	172.6	77.6	0	0	0	0	109.4	G301 H305 E306	G301-S303 PolarHBondContact O-N 2.99Å; S303-H305 PolarHBondContact O-N 3.32Å; S303-E306 WeakPolarHBondContact O-CB 3.42Å; S303-E306 PolarHBondContact O-N 3.09Å; S303-E306 PolarHBondContact OG-N 2.83Å
304	P	71.9	Confident	64.9	Low	68 Å²	68	60.3 Å²	60.3	44%	0.442	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-9.9	179.4	24.4	-34	0	0	0	113.3	L53 L275	L53-P304 WeakPolarHBondContact CD1-O 3.48Å; L275-P304 HydrophobicContact CD1-CB 3.74Å; L275-P304 HydrophobicContact CD1-CG 3.98Å
305	H	83.6	Confident	67.8	Low	27 Å²	27	53.1 Å²	53.1	13%	0.125	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	6.8	-179	-51.8	-54.6	0	0	0	113.8	Y271 S303 G307 L308 H309	Y271-H305 AromaticContact CE2-CE1 3.66Å; Y271-H305 AromaticContact CZ-CE1 3.71Å; Y271-H305 PolarHBondContact OH-CE1 3.16Å; Y271-H305 PolarHBondContact OH-NE2 3.12Å; S303-H305 PolarHBondContact O-N 3.32Å; H305-G307 VanDerWaalsContact C-N 3.31Å; H305-G307 PolarHBondContact O-N 3.25Å; H305-L308 WeakPolarHBondContact O-CA 3.32Å; H305-L308 WeakPolarHBondContact O-CB 2.88Å; H305-L308 PolarHBondContact O-N 2.82Å; H305-H309 PolarHBondContact O-CD2 3.48Å; H305-H309 PolarHBondContact O-N 2.94Å
306	E	87.2	Confident	71	Confident	29 Å²	29	47.2 Å²	47.2	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-54.2	-46	-175.9	177.1	175.6	-130.1	0	0	112.4	R143 S302 S303 L308 H309 I310	R143-E306 IonicContact CZ-OE1 2.7Å; R143-E306 IonicContact CZ-OE2 3.73Å; R143-E306 IonicContact NH1-OE1 2.86Å; R143-E306 IonicContact NH1-OE2 3.4Å; R143-E306 IonicContact NH2-OE1 3.58Å; R143-E306 PolarHBondContact NH2-OE1 3.04Å; R143-E306 IonicContact NH2-OE2 2.66Å; R143-E306 PolarHBondContact NH2-OE2 3.47Å; S302-E306 WeakPolarHBondContact CB-OE2 3.08Å; S303-E306 WeakPolarHBondContact O-CB 3.42Å; S303-E306 PolarHBondContact O-N 3.09Å; S303-E306 PolarHBondContact OG-N 2.83Å; E306-L308 VanDerWaalsContact C-N 3.31Å; E306-L308 PolarHBondContact O-N 2.9Å; E306-H309 WeakPolarHBondContact O-CB 3.22Å; E306-H309 PolarHBondContact O-N 3.42Å; E306-H309 VanDerWaalsContact O-N 3.14Å; E306-I310 HydrophobicContact CG-CD1 3.91Å; E306-I310 HydrophobicContact CG-CG1 4.48Å; E306-I310 WeakPolarHBondContact O-CG1 3.45Å; E306-I310 PolarHBondContact O-N 2.83Å
307	G	89.9	Confident	74.3	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-35.4	177.7	0	0	0	0	0	112.6	P54 L59 H305 H309 I310 L311	P54-G307 VanDerWaalsContact O-CA 3.25Å; P54-G307 WeakPolarHBondContact O-CA 3.39Å; L59-G307 VanDerWaalsContact CD1-O 3.28Å; L59-G307 WeakPolarHBondContact CD1-O 3.36Å; H305-G307 VanDerWaalsContact C-N 3.31Å; H305-G307 PolarHBondContact O-N 3.25Å; G307-H309 VanDerWaalsContact C-N 3.32Å; G307-H309 PolarHBondContact O-N 3.05Å; G307-I310 PolarHBondContact O-N 3.39Å; G307-L311 WeakPolarHBondContact O-CB 3.46Å; G307-L311 PolarHBondContact O-N 3.2Å
308	L	90.6	Very high	77.6	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-37.8	173.3	-71.3	172.7	0	0	0	112.3	L53 P54 L229 L233 H305 E306 L311 A312	L53-L308 HydrophobicContact CD2-CD1 3.9Å; P54-L308 HydrophobicContact CG-CD2 3.91Å; P54-L308 HydrophobicContact CG-CG 4.14Å; L229-L308 HydrophobicContact CD1-CD1 4.04Å; L233-L308 HydrophobicContact CD1-CD1 3.96Å; L233-L308 HydrophobicContact CD1-CD2 3.93Å; H305-L308 WeakPolarHBondContact O-CA 3.32Å; H305-L308 WeakPolarHBondContact O-CB 2.88Å; H305-L308 PolarHBondContact O-N 2.82Å; E306-L308 VanDerWaalsContact C-N 3.31Å; E306-L308 PolarHBondContact O-N 2.9Å; L308-L311 HydrophobicContact CD2-CD2 4.33Å; L308-L311 PolarHBondContact O-N 2.96Å; L308-A312 WeakPolarHBondContact O-CB 3.41Å; L308-A312 PolarHBondContact O-N 3.48Å
309	H	91.2	Very high	80.9	Confident	35 Å²	35	30.4 Å²	30.4	16%	0.162	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-46	176.8	-67.8	-174	0	0	0	110.8	L221 T224 H305 E306 G307 A312 Y313	L221-H309 HydrophobicContact CD1-CB 3.89Å; L221-H309 WeakPolarHBondContact CD1-O 3.46Å; T224-H309 WeakPolarHBondContact CB-CD2 3.47Å; T224-H309 PolarHBondContact O-NE2 3.49Å; T224-H309 VanDerWaalsContact O-NE2 3.12Å; T224-H309 PolarHBondContact OG1-CD2 3.32Å; H305-H309 PolarHBondContact O-CD2 3.48Å; H305-H309 PolarHBondContact O-N 2.94Å; E306-H309 WeakPolarHBondContact O-CB 3.22Å; E306-H309 PolarHBondContact O-N 3.42Å; E306-H309 VanDerWaalsContact O-N 3.14Å; G307-H309 VanDerWaalsContact C-N 3.32Å; G307-H309 PolarHBondContact O-N 3.05Å; H309-A312 PolarHBondContact O-N 3.09Å; H309-Y313 WeakPolarHBondContact O-CB 3.41Å; H309-Y313 PolarHBondContact O-N 3.36Å
310	I	92.6	Very high	84.1	Confident	0 Å²	0	26 Å²	26	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.5	-43.3	177.2	-63.9	171.2	0	0	0	110.2	L56 L59 I73 Y76 F77 E306 G307 A312 Y313 L314	L56-I310 HydrophobicContact CD1-CD1 3.74Å; L59-I310 HydrophobicContact CD1-CB 3.69Å; L59-I310 HydrophobicContact CD1-CG2 3.7Å; I73-I310 HydrophobicContact CG1-CG2 4.07Å; Y76-I310 HydrophobicContact CD1-CD1 4.32Å; Y76-I310 HydrophobicContact CD1-CG1 3.84Å; Y76-I310 HydrophobicContact CE1-CD1 4.1Å; Y76-I310 HydrophobicContact CE1-CG1 3.51Å; Y76-I310 HydrophobicContact CG-CG1 4.49Å; F77-I310 HydrophobicContact CE2-CD1 3.82Å; F77-I310 HydrophobicContact CZ-CD1 3.85Å; E306-I310 HydrophobicContact CG-CD1 3.91Å; E306-I310 HydrophobicContact CG-CG1 4.48Å; E306-I310 WeakPolarHBondContact O-CG1 3.45Å; E306-I310 PolarHBondContact O-N 2.83Å; G307-I310 PolarHBondContact O-N 3.39Å; I310-A312 PolarHBondContact O-N 3.11Å; I310-Y313 CarbonylContact O-C 3.55Å; I310-Y313 WeakPolarHBondContact O-CA 3.29Å; I310-Y313 WeakPolarHBondContact O-CB 3.38Å; I310-Y313 PolarHBondContact O-N 3.08Å; I310-Y313 VanDerWaalsContact O-N 3.16Å; I310-L314 HydrophobicContact CG2-CD1 4.25Å; I310-L314 HydrophobicContact CG2-CG 4.27Å; I310-L314 VanDerWaalsContact O-CG 3.3Å; I310-L314 WeakPolarHBondContact O-CG 3.37Å; I310-L314 PolarHBondContact O-N 3.29Å
311	L	94.4	Very high	87	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-48.2	176.7	176.2	69.5	0	0	0	111.8	F44 L59 F236 G307 L308 Y313 L314 L315	F44-L311 HydrophobicContact CB-CD1 4.1Å; F44-L311 HydrophobicContact CD1-CD1 3.9Å; F44-L311 HydrophobicContact CD2-CD1 3.73Å; F44-L311 HydrophobicContact CE1-CD1 4.22Å; F44-L311 HydrophobicContact CE2-CD1 4.06Å; F44-L311 HydrophobicContact CG-CD1 3.65Å; F44-L311 HydrophobicContact CZ-CD1 4.29Å; L59-L311 HydrophobicContact CD2-CB 4.28Å; L59-L311 HydrophobicContact CD2-CD1 4.26Å; F236-L311 HydrophobicContact CD1-CD2 3.82Å; F236-L311 HydrophobicContact CD2-CD2 3.85Å; F236-L311 HydrophobicContact CE1-CD2 3.49Å; F236-L311 VanDerWaalsContact CE1-CD2 3.49Å; F236-L311 HydrophobicContact CE2-CD1 4.1Å; F236-L311 HydrophobicContact CE2-CD2 3.54Å; F236-L311 HydrophobicContact CE2-CG 4.24Å; F236-L311 HydrophobicContact CG-CD2 4Å; F236-L311 HydrophobicContact CZ-CD1 4.1Å; F236-L311 HydrophobicContact CZ-CD2 3.36Å; F236-L311 HydrophobicContact CZ-CG 4.31Å; G307-L311 WeakPolarHBondContact O-CB 3.46Å; G307-L311 PolarHBondContact O-N 3.2Å; L308-L311 HydrophobicContact CD2-CD2 4.33Å; L308-L311 PolarHBondContact O-N 2.96Å; L311-Y313 VanDerWaalsContact C-N 3.29Å; L311-Y313 PolarHBondContact O-N 3.44Å; L311-L314 WeakPolarHBondContact O-CB 3.44Å; L311-L314 PolarHBondContact O-N 3.18Å; L311-L315 HydrophobicContact CG-CD1 4.42Å; L311-L315 WeakPolarHBondContact O-CG 3.36Å; L311-L315 PolarHBondContact O-N 2.92Å
312	A	94	Very high	89.7	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.6	-39.2	175.6	0	0	0	0	0	111.7	L220 T224 F232 L308 H309 I310 N316	L220-A312 HydrophobicContact CB-CB 4.3Å; T224-A312 HydrophobicContact CG2-CB 3.48Å; T224-A312 VanDerWaalsContact CG2-CB 3.48Å; F232-A312 HydrophobicContact CE1-CB 4.02Å; F232-A312 HydrophobicContact CE2-CB 4.39Å; F232-A312 HydrophobicContact CZ-CB 3.75Å; L308-A312 WeakPolarHBondContact O-CB 3.41Å; L308-A312 PolarHBondContact O-N 3.48Å; H309-A312 PolarHBondContact O-N 3.09Å; I310-A312 PolarHBondContact O-N 3.11Å; A312-N316 VanDerWaalsContact O-CB 3.26Å; A312-N316 WeakPolarHBondContact O-CB 3.49Å; A312-N316 PolarHBondContact O-N 3.03Å
313	Y	94.1	Very high	91.4	Very high	58 Å²	58	17 Å²	17	23%	0.227	9%	0.094	C	C	.	.	H	α-helix	trans	-63.2	-39.4	174	-179	-104.4	0	0	0	112.6	R72 Y76 H309 I310 L311 G317	R72-Y313 HydrophobicContact CG-CD1 3.91Å; R72-Y313 HydrophobicContact CG-CE1 3.36Å; Y76-Y313 AromaticContact CD2-CD1 3.65Å; Y76-Y313 HydrophobicContact CD2-CD1 3.65Å; Y76-Y313 HydrophobicContact CD2-CD2 4.01Å; Y76-Y313 HydrophobicContact CD2-CE1 4.01Å; Y76-Y313 HydrophobicContact CD2-CE2 4.34Å; Y76-Y313 AromaticContact CD2-CG 3.65Å; Y76-Y313 HydrophobicContact CD2-CG 3.65Å; Y76-Y313 HydrophobicContact CE2-CG 4.25Å; Y76-Y313 HydrophobicContact CG-CD1 4.13Å; Y76-Y313 HydrophobicContact CG-CE1 4.3Å; H309-Y313 WeakPolarHBondContact O-CB 3.41Å; H309-Y313 PolarHBondContact O-N 3.36Å; I310-Y313 CarbonylContact O-C 3.55Å; I310-Y313 WeakPolarHBondContact O-CA 3.29Å; I310-Y313 WeakPolarHBondContact O-CB 3.38Å; I310-Y313 PolarHBondContact O-N 3.08Å; I310-Y313 VanDerWaalsContact O-N 3.16Å; L311-Y313 VanDerWaalsContact C-N 3.29Å; L311-Y313 PolarHBondContact O-N 3.44Å; Y313-G317 PolarHBondContact O-N 2.9Å
314	L	95.6	Very high	92.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.7	-48.9	176.2	-71.3	179.2	0	0	0	111.8	F44 R69 R72 I73 I310 L311 N316 G317 D318	F44-L314 HydrophobicContact CE1-CD1 4.16Å; F44-L314 HydrophobicContact CZ-CB 4.36Å; F44-L314 HydrophobicContact CZ-CD1 3.96Å; R69-L314 HydrophobicContact CB-CD2 4.12Å; R69-L314 HydrophobicContact CG-CD2 4.21Å; R72-L314 HydrophobicContact CB-CD2 4.02Å; R72-L314 HydrophobicContact CG-CD2 3.97Å; I73-L314 HydrophobicContact CD1-CD1 4.31Å; I73-L314 HydrophobicContact CG1-CD1 4.3Å; I73-L314 HydrophobicContact CG1-CD2 3.99Å; I310-L314 HydrophobicContact CG2-CD1 4.25Å; I310-L314 HydrophobicContact CG2-CG 4.27Å; I310-L314 VanDerWaalsContact O-CG 3.3Å; I310-L314 WeakPolarHBondContact O-CG 3.37Å; I310-L314 PolarHBondContact O-N 3.29Å; L311-L314 WeakPolarHBondContact O-CB 3.44Å; L311-L314 PolarHBondContact O-N 3.18Å; L314-N316 VanDerWaalsContact C-N 3.32Å; L314-N316 PolarHBondContact O-N 3.47Å; L314-G317 CarbonylContact O-C 3.55Å; L314-G317 WeakPolarHBondContact O-CA 3.34Å; L314-G317 PolarHBondContact O-N 2.87Å; L314-G317 VanDerWaalsContact O-N 3.13Å; L314-D318 PolarHBondContact O-N 3.09Å
315	L	95.2	Very high	93.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.8	-40.4	177.4	-69.6	175.2	0	0	0	111.7	L37 N40 F44 L220 F232 W235 L311 G317 D318 L319	L37-L315 HydrophobicContact CD2-CB 4.08Å; L37-L315 HydrophobicContact CD2-CD2 4.34Å; N40-L315 HydrophobicContact CB-CD2 4.07Å; F44-L315 HydrophobicContact CD2-CD2 4.22Å; F44-L315 HydrophobicContact CE2-CD2 4.05Å; L220-L315 HydrophobicContact CD1-CB 3.68Å; F232-L315 HydrophobicContact CZ-CD1 4.35Å; W235-L315 HydrophobicContact CH2-CD1 4.26Å; W235-L315 HydrophobicContact CZ3-CD1 4.15Å; L311-L315 HydrophobicContact CG-CD1 4.42Å; L311-L315 WeakPolarHBondContact O-CG 3.36Å; L311-L315 PolarHBondContact O-N 2.92Å; L315-G317 VanDerWaalsContact C-N 3.32Å; L315-D318 PolarHBondContact O-N 3.13Å; L315-L319 PolarHBondContact O-N 3.07Å
316	N	95.6	Very high	94.4	Very high	12 Å²	12	10.2 Å²	10.2	6%	0.064	5%	0.05	C	C	.	.	H	α-helix	trans	-64.3	-41.2	174.4	-166.7	82.9	0	0	0	111.2	S219 L220 A312 L314 D318 L319 L320	S219-N316 WeakPolarHBondContact CA-OD1 3.45Å; S219-N316 PolarHBondContact OG-OD1 3.02Å; L220-N316 HydrophobicContact CB-CB 4.19Å; L220-N316 HydrophobicContact CD1-CB 4.37Å; L220-N316 HydrophobicContact CG-CB 4.45Å; L220-N316 PolarHBondContact N-OD1 3Å; L220-N316 VanDerWaalsContact N-OD1 3.13Å; A312-N316 VanDerWaalsContact O-CB 3.26Å; A312-N316 WeakPolarHBondContact O-CB 3.49Å; A312-N316 PolarHBondContact O-N 3.03Å; L314-N316 VanDerWaalsContact C-N 3.32Å; L314-N316 PolarHBondContact O-N 3.47Å; N316-D318 VanDerWaalsContact C-N 3.31Å; N316-D318 PolarHBondContact O-N 3.38Å; N316-L319 WeakPolarHBondContact O-CB 3.41Å; N316-L319 PolarHBondContact O-N 3.3Å; N316-L320 WeakPolarHBondContact O-CG 3.44Å; N316-L320 PolarHBondContact O-N 2.93Å; N316-L320 VanDerWaalsContact O-N 3.07Å
317	G	95.3	Very high	94.8	Very high	7 Å²	7	8.9 Å²	8.9	7%	0.072	4%	0.044	C	C	.	.	H	α-helix	trans	-59.9	-39.1	174.6	0	0	0	0	0	112.8	Y313 L314 L315 L319 L320 D321	Y313-G317 PolarHBondContact O-N 2.9Å; L314-G317 CarbonylContact O-C 3.55Å; L314-G317 WeakPolarHBondContact O-CA 3.34Å; L314-G317 PolarHBondContact O-N 2.87Å; L314-G317 VanDerWaalsContact O-N 3.13Å; L315-G317 VanDerWaalsContact C-N 3.32Å; G317-L319 PolarHBondContact O-N 3.09Å; G317-L320 PolarHBondContact O-N 3.21Å; G317-D321 WeakPolarHBondContact O-CB 3.22Å; G317-D321 VanDerWaalsContact O-CG 3.25Å; G317-D321 PolarHBondContact O-N 2.81Å
318	D	95.2	Very high	95.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-66.1	-36.8	177.3	-69	-14.5	0	0	0	112.3	Y36 N40 R69 R72 L314 L315 N316 I322 Y358	Y36-D318 HydrophobicContact CE1-CB 4.11Å; N40-D318 PolarHBondContact ND2-OD2 3.29Å; R69-D318 IonicContact CZ-OD2 3.97Å; R69-D318 IonicContact NE-OD1 3.44Å; R69-D318 IonicContact NE-OD2 3.43Å; R69-D318 PolarHBondContact NE-OD2 3.34Å; R69-D318 IonicContact NH2-OD2 2.89Å; R69-D318 PolarHBondContact NH2-OD2 3.05Å; R72-D318 IonicContact CZ-OD1 3.62Å; R72-D318 IonicContact NH1-OD1 2.66Å; R72-D318 PolarHBondContact NH1-OD1 3.22Å; L314-D318 PolarHBondContact O-N 3.09Å; L315-D318 PolarHBondContact O-N 3.13Å; N316-D318 VanDerWaalsContact C-N 3.31Å; N316-D318 PolarHBondContact O-N 3.38Å; D318-I322 WeakPolarHBondContact O-CG1 3.43Å; D318-I322 PolarHBondContact O-N 3.5Å; D318-I322 VanDerWaalsContact O-N 3.15Å; D318-Y358 WeakPolarHBondContact OD1-CE2 3.38Å; D318-Y358 PolarHBondContact OD1-OH 2.8Å
319	L	95.9	Very high	95.4	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.016	6%	0.059	C	C	.	.	H	α-helix	trans	-62.2	-47	171.4	-68.7	174.4	0	0	0	111.5	I12 V15 L33 L37 L220 L315 N316 G317 D321 I322 I323	I12-L319 HydrophobicContact CG1-CD1 4.22Å; V15-L319 HydrophobicContact CG1-CB 4.41Å; V15-L319 HydrophobicContact CG1-CD1 4.46Å; L33-L319 HydrophobicContact CB-CD2 4.18Å; L33-L319 HydrophobicContact CD2-CD2 4.26Å; L37-L319 HydrophobicContact CD1-CD1 3.89Å; L37-L319 HydrophobicContact CD1-CD2 3.99Å; L37-L319 HydrophobicContact CD1-CG 4.17Å; L37-L319 HydrophobicContact CD2-CD1 4.27Å; L37-L319 HydrophobicContact CD2-CD2 3.93Å; L37-L319 HydrophobicContact CD2-CG 3.83Å; L37-L319 HydrophobicContact CG-CD1 4.41Å; L37-L319 HydrophobicContact CG-CD2 3.76Å; L37-L319 HydrophobicContact CG-CG 4.13Å; L220-L319 HydrophobicContact CD1-CD1 4.35Å; L315-L319 PolarHBondContact O-N 3.07Å; N316-L319 WeakPolarHBondContact O-CB 3.41Å; N316-L319 PolarHBondContact O-N 3.3Å; G317-L319 PolarHBondContact O-N 3.09Å; L319-D321 VanDerWaalsContact C-N 3.3Å; L319-D321 PolarHBondContact O-N 3.38Å; L319-I322 WeakPolarHBondContact O-CB 3.3Å; L319-I322 PolarHBondContact O-N 3.27Å; L319-I323 WeakPolarHBondContact O-CG1 3.47Å; L319-I323 PolarHBondContact O-N 3.31Å; L319-I323 VanDerWaalsContact O-N 3.15Å
320	L	96.5	Very high	95.6	Very high	43 Å²	43	11 Å²	11	23%	0.225	5%	0.053	C	C	.	.	H	α-helix	trans	-63.2	-39.6	-179.4	-72.1	178.5	0	0	0	111.2	V15 R192 N316 G317 I322 I323 D324	V15-L320 HydrophobicContact CG1-CD2 3.86Å; R192-L320 VanDerWaalsContact NH1-CA 3.29Å; R192-L320 PolarHBondContact NH1-O 2.88Å; N316-L320 WeakPolarHBondContact O-CG 3.44Å; N316-L320 PolarHBondContact O-N 2.93Å; N316-L320 VanDerWaalsContact O-N 3.07Å; G317-L320 PolarHBondContact O-N 3.21Å; L320-I322 VanDerWaalsContact C-N 3.33Å; L320-I322 PolarHBondContact O-N 2.85Å; L320-I323 PolarHBondContact O-N 3Å; L320-D324 WeakPolarHBondContact O-CB 3.49Å; L320-D324 PolarHBondContact O-N 3.05Å; L320-D324 VanDerWaalsContact O-OD2 3.12Å
321	D	96.1	Very high	95.7	Very high	15 Å²	15	15.5 Å²	15.5	8%	0.08	7%	0.074	C	C	.	.	H	α-helix	trans	-63.1	-38.5	175.7	-75.9	3.5	0	0	0	111.9	R72 L185 G317 L319 I323 D324 M325 F353	R72-D321 IonicContact CZ-OD1 2.71Å; R72-D321 IonicContact CZ-OD2 2.86Å; R72-D321 IonicContact NH2-OD1 3.35Å; R72-D321 PolarHBondContact NH2-OD1 2.98Å; R72-D321 IonicContact NH2-OD2 3.58Å; R72-D321 PolarHBondContact NH2-OD2 2.94Å; L185-D321 HydrophobicContact CD1-CB 4.24Å; L185-D321 HydrophobicContact CD2-CB 3.78Å; L185-D321 WeakPolarHBondContact CD2-O 3.36Å; G317-D321 WeakPolarHBondContact O-CB 3.22Å; G317-D321 VanDerWaalsContact O-CG 3.25Å; G317-D321 PolarHBondContact O-N 2.81Å; L319-D321 VanDerWaalsContact C-N 3.3Å; L319-D321 PolarHBondContact O-N 3.38Å; D321-I323 VanDerWaalsContact C-N 3.35Å; D321-D324 PolarHBondContact O-N 3.07Å; D321-M325 WeakPolarHBondContact O-CB 3.49Å; D321-M325 PolarHBondContact O-N 3.23Å; D321-F353 HydrophobicContact CB-CE1 3.61Å; D321-F353 HydrophobicContact CB-CZ 3.59Å
322	I	96.6	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.6	-47.9	175	-71	160.9	0	0	0	109.9	L33 Y36 D318 L319 L320 D324 M325 V326 I346 V349 L350 F353	L33-I322 HydrophobicContact CD2-CD1 4.03Å; L33-I322 HydrophobicContact CD2-CG2 4.12Å; Y36-I322 HydrophobicContact CD1-CD1 3.48Å; Y36-I322 VanDerWaalsContact CD1-CD1 3.48Å; Y36-I322 HydrophobicContact CE1-CD1 3.3Å; Y36-I322 HydrophobicContact CE1-CG1 4.43Å; Y36-I322 HydrophobicContact CE2-CD1 4.47Å; Y36-I322 HydrophobicContact CG-CD1 4.15Å; D318-I322 WeakPolarHBondContact O-CG1 3.43Å; D318-I322 PolarHBondContact O-N 3.5Å; D318-I322 VanDerWaalsContact O-N 3.15Å; L319-I322 WeakPolarHBondContact O-CB 3.3Å; L319-I322 PolarHBondContact O-N 3.27Å; L320-I322 VanDerWaalsContact C-N 3.33Å; L320-I322 PolarHBondContact O-N 2.85Å; I322-D324 VanDerWaalsContact C-N 3.32Å; I322-D324 PolarHBondContact O-N 3.09Å; I322-M325 PolarHBondContact O-N 2.87Å; I322-V326 WeakPolarHBondContact O-CG2 3.41Å; I322-V326 PolarHBondContact O-N 3.28Å; I322-I346 HydrophobicContact CG2-CD1 3.82Å; I322-V349 HydrophobicContact CB-CG1 4.3Å; I322-V349 HydrophobicContact CG1-CG1 4.33Å; I322-V349 HydrophobicContact CG2-CG1 3.98Å; I322-L350 HydrophobicContact CD1-CD2 3.45Å; I322-L350 VanDerWaalsContact CD1-CD2 3.45Å; I322-L350 HydrophobicContact CG1-CD2 4.07Å; I322-F353 HydrophobicContact CG1-CD1 4.15Å; I322-F353 HydrophobicContact CG1-CD2 4.46Å; I322-F353 HydrophobicContact CG1-CE1 3.99Å; I322-F353 HydrophobicContact CG1-CE2 4.34Å; I322-F353 HydrophobicContact CG1-CG 4.35Å; I322-F353 HydrophobicContact CG1-CZ 4.07Å
323	I	96.2	Very high	95.8	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-45.1	177.4	-62.5	167.3	0	0	0	110.2	V15 L16 S19 L319 L320 D321 M325 V326 L327 I341	V15-I323 HydrophobicContact CG1-CD1 4.2Å; L16-I323 HydrophobicContact CD2-CD1 3.79Å; L16-I323 HydrophobicContact CD2-CG1 4.06Å; S19-I323 WeakPolarHBondContact OG-CD1 3.39Å; L319-I323 WeakPolarHBondContact O-CG1 3.47Å; L319-I323 PolarHBondContact O-N 3.31Å; L319-I323 VanDerWaalsContact O-N 3.15Å; L320-I323 PolarHBondContact O-N 3Å; D321-I323 VanDerWaalsContact C-N 3.35Å; I323-M325 VanDerWaalsContact C-N 3.35Å; I323-M325 PolarHBondContact O-N 3.27Å; I323-V326 PolarHBondContact O-N 3.32Å; I323-L327 HydrophobicContact CG2-CD1 4.09Å; I323-L327 HydrophobicContact CG2-CG 4.47Å; I323-L327 WeakPolarHBondContact O-CG 3.28Å; I323-L327 PolarHBondContact O-N 2.77Å; I323-I341 HydrophobicContact CG2-CD1 4.19Å
324	D	96.9	Very high	95.8	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.027	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-43.5	-179.6	-69.7	-25.5	0	0	0	111.1	L185 G188 R189 R192 L320 D321 I322 L327 Y328	L185-D324 HydrophobicContact CD2-CB 4.36Å; G188-D324 WeakPolarHBondContact CA-O 3.2Å; R189-D324 VanDerWaalsContact CA-OD1 3.25Å; R189-D324 WeakPolarHBondContact CA-OD1 3.49Å; R189-D324 PolarHBondContact N-OD1 3.31Å; R192-D324 VanDerWaalsContact CZ-CG 3.44Å; R192-D324 IonicContact CZ-OD1 2.76Å; R192-D324 IonicContact CZ-OD2 2.73Å; R192-D324 VanDerWaalsContact CZ-OD2 3.27Å; R192-D324 IonicContact NE-OD1 3.2Å; R192-D324 PolarHBondContact NE-OD1 3.23Å; R192-D324 VanDerWaalsContact NH1-CG 3.28Å; R192-D324 IonicContact NH1-OD1 2.8Å; R192-D324 PolarHBondContact NH1-OD1 2.89Å; R192-D324 IonicContact NH1-OD2 3.09Å; R192-D324 PolarHBondContact NH1-OD2 3.47Å; R192-D324 VanDerWaalsContact NH2-CG 3.33Å; R192-D324 IonicContact NH2-OD1 3.2Å; R192-D324 PolarHBondContact NH2-OD1 3.43Å; R192-D324 VanDerWaalsContact NH2-OD1 3.08Å; R192-D324 IonicContact NH2-OD2 3.3Å; R192-D324 PolarHBondContact NH2-OD2 2.9Å; L320-D324 WeakPolarHBondContact O-CB 3.49Å; L320-D324 PolarHBondContact O-N 3.05Å; L320-D324 VanDerWaalsContact O-OD2 3.12Å; D321-D324 PolarHBondContact O-N 3.07Å; I322-D324 VanDerWaalsContact C-N 3.32Å; I322-D324 PolarHBondContact O-N 3.09Å; D324-L327 PolarHBondContact O-N 2.95Å; D324-Y328 WeakPolarHBondContact O-CB 3.39Å; D324-Y328 PolarHBondContact O-N 3.36Å
325	M	96.7	Very high	95.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-37.8	176.9	-171.9	61.1	70	0	0	112.3	V181 Q184 L185 D321 I322 I323 Y328 N329 V349 F353	V181-M325 HydrophobicContact CG1-CE 3.83Å; Q184-M325 HydrophobicContact CB-CE 3.98Å; Q184-M325 HydrophobicContact CB-SD 4.32Å; L185-M325 HydrophobicContact CD2-CB 3.99Å; L185-M325 HydrophobicContact CD2-CE 3.76Å; L185-M325 HydrophobicContact CG-CE 3.98Å; D321-M325 WeakPolarHBondContact O-CB 3.49Å; D321-M325 PolarHBondContact O-N 3.23Å; I322-M325 PolarHBondContact O-N 2.87Å; I323-M325 VanDerWaalsContact C-N 3.35Å; I323-M325 PolarHBondContact O-N 3.27Å; M325-Y328 PolarHBondContact O-N 2.85Å; M325-Y328 HydrophobicContact SD-CD1 4Å; M325-N329 WeakPolarHBondContact O-CB 3.37Å; M325-N329 VanDerWaalsContact O-CG 3.3Å; M325-N329 PolarHBondContact O-N 3.19Å; M325-N329 PolarHBondContact O-ND2 2.92Å; M325-V349 HydrophobicContact CB-CG1 3.75Å; M325-V349 HydrophobicContact CB-CG2 4.16Å; M325-V349 HydrophobicContact CG-CB 4.48Å; M325-V349 HydrophobicContact CG-CG1 3.87Å; M325-V349 HydrophobicContact CG-CG2 3.83Å; M325-F353 HydrophobicContact CB-CE2 4.05Å; M325-F353 HydrophobicContact CG-CE2 4.31Å
326	V	96.8	Very high	95.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-50.6	172.6	167.3	0	0	0	0	110.1	I322 I323 Y328 N329 R330 I341 E345 I346 V349	I322-V326 WeakPolarHBondContact O-CG2 3.41Å; I322-V326 PolarHBondContact O-N 3.28Å; I323-V326 PolarHBondContact O-N 3.32Å; V326-Y328 VanDerWaalsContact C-N 3.32Å; V326-Y328 PolarHBondContact O-N 3.47Å; V326-N329 PolarHBondContact O-N 3.04Å; V326-R330 HydrophobicContact CG1-CG 4.4Å; V326-R330 WeakPolarHBondContact O-CG 3.3Å; V326-R330 PolarHBondContact O-N 3.12Å; V326-I341 HydrophobicContact CG1-CD1 4.21Å; V326-I341 HydrophobicContact CG1-CG1 3.96Å; V326-I341 HydrophobicContact CG1-CG2 3.91Å; V326-E345 HydrophobicContact CG1-CB 4.02Å; V326-E345 HydrophobicContact CG2-CB 4.26Å; V326-I346 HydrophobicContact CG2-CD1 4.06Å; V326-V349 HydrophobicContact CB-CG2 4.49Å; V326-V349 HydrophobicContact CG2-CB 4.18Å; V326-V349 HydrophobicContact CG2-CG2 3.63Å
327	L	96.2	Very high	95.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-38.9	-178.9	-66.2	174.6	0	0	0	112.1	L191 R192 I323 D324 R330 Q331 L337	L191-L327 HydrophobicContact CB-CB 4.09Å; L191-L327 HydrophobicContact CD1-CB 4.24Å; L191-L327 VanDerWaalsContact CD1-O 3.29Å; L191-L327 WeakPolarHBondContact CD1-O 3.18Å; R192-L327 HydrophobicContact CB-CD1 3.61Å; R192-L327 HydrophobicContact CG-CD1 4.22Å; I323-L327 HydrophobicContact CG2-CD1 4.09Å; I323-L327 HydrophobicContact CG2-CG 4.47Å; I323-L327 WeakPolarHBondContact O-CG 3.28Å; I323-L327 PolarHBondContact O-N 2.77Å; D324-L327 PolarHBondContact O-N 2.95Å; L327-R330 PolarHBondContact O-N 3.3Å; L327-Q331 PolarHBondContact O-N 2.98Å; L327-L337 HydrophobicContact CD2-CD2 4.27Å
328	Y	96.5	Very high	94.7	Very high	37 Å²	37	44 Å²	44	15%	0.145	23%	0.225	C	C	.	.	H	α-helix	trans	-59.6	-47	173.1	174.1	-102.2	0	0	0	111.8	Q184 K187 D324 M325 V326 R330 Q331 K332	Q184-Y328 HydrophobicContact CB-CD1 3.88Å; Q184-Y328 HydrophobicContact CB-CD2 4.44Å; Q184-Y328 HydrophobicContact CB-CE1 3.84Å; Q184-Y328 HydrophobicContact CB-CE2 4.42Å; Q184-Y328 HydrophobicContact CB-CG 4.18Å; Q184-Y328 HydrophobicContact CG-CD1 4.08Å; Q184-Y328 HydrophobicContact CG-CE1 3.49Å; Q184-Y328 VanDerWaalsContact CG-CE1 3.49Å; Q184-Y328 HydrophobicContact CG-CE2 4.21Å; K187-Y328 HydrophobicContact CB-CD2 3.92Å; K187-Y328 HydrophobicContact CB-CE2 4.34Å; K187-Y328 HydrophobicContact CD-CD2 4.39Å; K187-Y328 HydrophobicContact CD-CE2 3.96Å; D324-Y328 WeakPolarHBondContact O-CB 3.39Å; D324-Y328 PolarHBondContact O-N 3.36Å; M325-Y328 PolarHBondContact O-N 2.85Å; M325-Y328 HydrophobicContact SD-CD1 4Å; V326-Y328 VanDerWaalsContact C-N 3.32Å; V326-Y328 PolarHBondContact O-N 3.47Å; Y328-R330 VanDerWaalsContact C-N 3.34Å; Y328-R330 PolarHBondContact O-N 3.23Å; Y328-Q331 PolarHBondContact O-N 3.5Å; Y328-K332 PolarHBondContact O-N 2.95Å
329	N	96	Very high	94.5	Very high	37 Å²	37	45.7 Å²	45.7	20%	0.198	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-39.8	177.4	-73.4	-17.9	0	0	0	111.9	M325 V326 K332 L333	M325-N329 WeakPolarHBondContact O-CB 3.37Å; M325-N329 VanDerWaalsContact O-CG 3.3Å; M325-N329 PolarHBondContact O-N 3.19Å; M325-N329 PolarHBondContact O-ND2 2.92Å; V326-N329 PolarHBondContact O-N 3.04Å; N329-K332 WeakPolarHBondContact O-CB 3.4Å; N329-K332 PolarHBondContact O-N 2.92Å; N329-L333 WeakPolarHBondContact O-CB 3.35Å; N329-L333 VanDerWaalsContact O-CG 3.3Å; N329-L333 WeakPolarHBondContact O-CG 3.45Å; N329-L333 PolarHBondContact O-N 2.95Å
330	R	95.5	Very high	94.3	Very high	8 Å²	8	48.1 Å²	48.1	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-45.9	175.1	-72.5	-176.5	79.3	105.8	-3.6	112.4	V326 L327 Y328 K332 L333 N334 I335 N336 L337 S339 P340 E345	V326-R330 HydrophobicContact CG1-CG 4.4Å; V326-R330 WeakPolarHBondContact O-CG 3.3Å; V326-R330 PolarHBondContact O-N 3.12Å; L327-R330 PolarHBondContact O-N 3.3Å; Y328-R330 VanDerWaalsContact C-N 3.34Å; Y328-R330 PolarHBondContact O-N 3.23Å; R330-K332 VanDerWaalsContact C-N 3.29Å; R330-K332 PolarHBondContact O-N 3.44Å; R330-L333 CarbonylContact O-C 3.46Å; R330-L333 PolarHBondContact O-N 2.93Å; R330-N334 PolarHBondContact O-N 2.69Å; R330-I335 HydrophobicContact CB-CB 4.09Å; R330-I335 HydrophobicContact CG-CB 4.2Å; R330-I335 HydrophobicContact CG-CD1 4.37Å; R330-I335 VanDerWaalsContact CZ-CG2 3.42Å; R330-I335 PolarHBondContact O-N 2.95Å; R330-N336 PolarHBondContact NE-O 2.88Å; R330-N336 PolarHBondContact NH2-O 3.36Å; R330-L337 HydrophobicContact CB-CD2 3.85Å; R330-S339 PolarHBondContact NH2-OG 3.45Å; R330-P340 PolarHBondContact NH1-O 3.28Å; R330-E345 WeakPolarHBondContact CD-OE1 3.48Å; R330-E345 WeakPolarHBondContact CG-OE1 3.32Å; R330-E345 IonicContact CZ-OE1 2.87Å; R330-E345 IonicContact NE-OE1 2.9Å; R330-E345 IonicContact NH1-OE1 3.08Å; R330-E345 PolarHBondContact NH1-OE1 2.97Å; R330-E345 IonicContact NH1-OE2 3.38Å; R330-E345 PolarHBondContact NH1-OE2 3.36Å
331	Q	95.3	Very high	94.1	Very high	96 Å²	96	46.5 Å²	46.5	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-58.4	-45	174.4	-173.6	-171.6	14.8	0	0	110.7	L191 L327 Y328 L333 N334	L191-Q331 HydrophobicContact CD1-CB 3.73Å; L191-Q331 HydrophobicContact CD1-CG 4.42Å; L327-Q331 PolarHBondContact O-N 2.98Å; Y328-Q331 PolarHBondContact O-N 3.5Å; Q331-L333 VanDerWaalsContact C-N 3.27Å; Q331-L333 PolarHBondContact O-N 3.2Å; Q331-N334 PolarHBondContact O-N 2.87Å
332	K	94.4	Very high	94	Very high	146 Å²	146	48.5 Å²	48.5	64%	0.635	26%	0.258	S	S	*	.	H	α-helix	trans	-63	-33.3	179.1	-173.1	-178.5	176.2	-172.9	0	112.9	Y328 N329 R330	Y328-K332 PolarHBondContact O-N 2.95Å; N329-K332 WeakPolarHBondContact O-CB 3.4Å; N329-K332 PolarHBondContact O-N 2.92Å; R330-K332 VanDerWaalsContact C-N 3.29Å; R330-K332 PolarHBondContact O-N 3.44Å
333	L	94.5	Very high	93.9	Very high	110 Å²	110	50.9 Å²	50.9	58%	0.576	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	8.2	-179.7	-64.5	174	0	0	0	113.1	N329 R330 Q331 I335	N329-L333 WeakPolarHBondContact O-CB 3.35Å; N329-L333 VanDerWaalsContact O-CG 3.3Å; N329-L333 WeakPolarHBondContact O-CG 3.45Å; N329-L333 PolarHBondContact O-N 2.95Å; R330-L333 CarbonylContact O-C 3.46Å; R330-L333 PolarHBondContact O-N 2.93Å; Q331-L333 VanDerWaalsContact C-N 3.27Å; Q331-L333 PolarHBondContact O-N 3.2Å; L333-I335 HydrophobicContact CB-CD1 3.94Å; L333-I335 HydrophobicContact CB-CG1 3.81Å; L333-I335 HydrophobicContact CD1-CD1 4.19Å; L333-I335 PolarHBondContact O-N 2.66Å
334	N	94.2	Very high	93.8	Very high	154 Å²	154	55.7 Å²	55.7	82%	0.824	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	31.5	-176.3	-60.7	-40.2	0	0	0	114.1	R330 Q331	R330-N334 PolarHBondContact O-N 2.69Å; Q331-N334 PolarHBondContact O-N 2.87Å
335	I	92.5	Very high	93.7	Very high	65 Å²	65	56.4 Å²	56.4	33%	0.333	30%	0.298	S	S	.	.			trans	-86.1	133.6	175.3	-48.1	176	0	0	0	108.4	R330 L333 L337	R330-I335 HydrophobicContact CB-CB 4.09Å; R330-I335 HydrophobicContact CG-CB 4.2Å; R330-I335 HydrophobicContact CG-CD1 4.37Å; R330-I335 VanDerWaalsContact CZ-CG2 3.42Å; R330-I335 PolarHBondContact O-N 2.95Å; L333-I335 HydrophobicContact CB-CD1 3.94Å; L333-I335 HydrophobicContact CB-CG1 3.81Å; L333-I335 HydrophobicContact CD1-CD1 4.19Å; L333-I335 PolarHBondContact O-N 2.66Å; I335-L337 PolarHBondContact O-N 3.37Å
336	N	91	Very high	93.7	Very high	102 Å²	102	56.3 Å²	56.3	55%	0.545	30%	0.297	S	S	.	.			trans	-52.2	124.5	178.7	-174.2	-8.6	0	0	0	111.2	R330 S338 S339	R330-N336 PolarHBondContact NE-O 2.88Å; R330-N336 PolarHBondContact NH2-O 3.36Å; N336-S338 VanDerWaalsContact C-N 3.26Å; N336-S338 PolarHBondContact O-N 2.97Å; N336-S338 WeakPolarHBondContact OD1-CB 3.35Å; N336-S338 PolarHBondContact OD1-N 3.46Å; N336-S339 PolarHBondContact O-OG 3.44Å
337	L	89.4	Confident	93.6	Very high	36 Å²	36	61.6 Å²	61.6	19%	0.188	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-21.8	180	-62.2	174.6	0	0	0	112.4	L191 R195 L327 R330 I335	L191-L337 HydrophobicContact CB-CD1 4.49Å; L191-L337 HydrophobicContact CD2-CD1 3.86Å; R195-L337 PolarHBondContact NE-O 2.89Å; L327-L337 HydrophobicContact CD2-CD2 4.27Å; R330-L337 HydrophobicContact CB-CD2 3.85Å; I335-L337 PolarHBondContact O-N 3.37Å
338	S	87.1	Confident	93.5	Very high	62 Å²	62	66.5 Å²	66.5	43%	0.434	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.5	-180	-55	0	0	0	0	113.5	P22 N336	P22-S338 VanDerWaalsContact CG-O 3.31Å; P22-S338 WeakPolarHBondContact CG-O 3.4Å; N336-S338 VanDerWaalsContact C-N 3.26Å; N336-S338 PolarHBondContact O-N 2.97Å; N336-S338 WeakPolarHBondContact OD1-CB 3.35Å; N336-S338 PolarHBondContact OD1-N 3.46Å
339	S	89.8	Confident	93.4	Very high	36 Å²	36	64.8 Å²	64.8	25%	0.252	34%	0.336	S	S	.	.	S	Bend	trans	-82.3	161.6	173.5	46.5	0	0	0	0	111.8	R195 R330 N336	R195-S339 PolarHBondContact NH2-O 3.48Å; R330-S339 PolarHBondContact NH2-OG 3.45Å; N336-S339 PolarHBondContact O-OG 3.44Å
340	P	92.1	Very high	93.4	Very high	54 Å²	54	63.8 Å²	63.8	35%	0.351	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61.4	149.7	-175.5	-12.7	21	0	0	0	113.3	E21 P22 F23 R330	E21-P340 WeakPolarHBondContact OE1-CA 3.33Å; E21-P340 WeakPolarHBondContact OE1-CB 3.27Å; P22-P340 HydrophobicContact CG-CG 4.47Å; F23-P340 HydrophobicContact CD2-CG 3.67Å; F23-P340 HydrophobicContact CE2-CG 3.94Å; R330-P340 PolarHBondContact NH1-O 3.28Å
341	I	93.2	Very high	93.1	Very high	8 Å²	8	69.6 Å²	69.6	4%	0.041	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-72.7	131.8	167	-66.8	171.4	0	0	0	108.6	E21 I29 I323 V326 I346	E21-I341 PolarHBondContact OE1-N 3.16Å; E21-I341 WeakPolarHBondContact OE2-CG1 3.16Å; I29-I341 VanDerWaalsContact CD1-O 3.23Å; I29-I341 WeakPolarHBondContact CD1-O 3.42Å; I323-I341 HydrophobicContact CG2-CD1 4.19Å; V326-I341 HydrophobicContact CG1-CD1 4.21Å; V326-I341 HydrophobicContact CG1-CG1 3.96Å; V326-I341 HydrophobicContact CG1-CG2 3.91Å; I341-I346 HydrophobicContact CG2-CD1 3.83Å; I341-I346 HydrophobicContact CG2-CG1 3.75Å
342	T	93.2	Very high	92.8	Very high	58 Å²	58	67.1 Å²	67.1	36%	0.356	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-98.3	157.5	-177.3	67	0	0	0	0	112	I344 E345 I346	T342-I344 VanDerWaalsContact C-N 3.27Å; T342-I344 PolarHBondContact O-N 3.47Å; T342-I344 VanDerWaalsContact OG1-CG2 3.3Å; T342-I344 WeakPolarHBondContact OG1-CG2 3.25Å; T342-E345 WeakPolarHBondContact CB-OE2 3.31Å; T342-E345 PolarHBondContact N-OE2 3.23Å; T342-E345 PolarHBondContact O-N 2.94Å; T342-E345 VanDerWaalsContact OG1-CD 3.22Å; T342-E345 VanDerWaalsContact OG1-CG 3.23Å; T342-E345 WeakPolarHBondContact OG1-CG 3.45Å; T342-E345 PolarHBondContact OG1-OE2 2.91Å; T342-I346 PolarHBondContact O-N 3.47Å
343	L	93.8	Very high	92.7	Very high	49 Å²	49	60.2 Å²	60.2	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-36.9	177.4	-174.8	66.7	0	0	0	112.6	L28 I29 L32 I346 K347	L28-L343 HydrophobicContact CB-CD1 4.24Å; L28-L343 HydrophobicContact CB-CD2 4.21Å; L28-L343 HydrophobicContact CD1-CD2 4.28Å; I29-L343 HydrophobicContact CG1-CB 4.33Å; I29-L343 HydrophobicContact CG1-CD1 4.07Å; L32-L343 HydrophobicContact CB-CD1 4.31Å; L32-L343 HydrophobicContact CD2-CD1 3.56Å; L343-I346 PolarHBondContact O-N 2.95Å; L343-K347 HydrophobicContact CG-CD 4.47Å; L343-K347 WeakPolarHBondContact O-CG 3.43Å; L343-K347 PolarHBondContact O-N 3.11Å
344	I	94.2	Very high	92.4	Very high	104 Å²	104	56.3 Å²	56.3	53%	0.533	30%	0.299	S	S	.	.	H	α-helix	trans	-65.9	-38.7	-179.2	-169.4	71.7	0	0	0	111.3	T342 K347 Q348	T342-I344 VanDerWaalsContact C-N 3.27Å; T342-I344 PolarHBondContact O-N 3.47Å; T342-I344 VanDerWaalsContact OG1-CG2 3.3Å; T342-I344 WeakPolarHBondContact OG1-CG2 3.25Å; I344-K347 PolarHBondContact O-N 3.11Å; I344-Q348 VanDerWaalsContact O-CG 3.31Å; I344-Q348 WeakPolarHBondContact O-CG 3.13Å; I344-Q348 PolarHBondContact O-N 3.39Å
345	E	95.4	Very high	92	Very high	19 Å²	19	51.6 Å²	51.6	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-43.4	177.8	-69.7	166.8	122.3	0	0	111.6	V326 R330 T342 Q348 V349	V326-E345 HydrophobicContact CG1-CB 4.02Å; V326-E345 HydrophobicContact CG2-CB 4.26Å; R330-E345 WeakPolarHBondContact CD-OE1 3.48Å; R330-E345 WeakPolarHBondContact CG-OE1 3.32Å; R330-E345 IonicContact CZ-OE1 2.87Å; R330-E345 IonicContact NE-OE1 2.9Å; R330-E345 IonicContact NH1-OE1 3.08Å; R330-E345 PolarHBondContact NH1-OE1 2.97Å; R330-E345 IonicContact NH1-OE2 3.38Å; R330-E345 PolarHBondContact NH1-OE2 3.36Å; T342-E345 WeakPolarHBondContact CB-OE2 3.31Å; T342-E345 PolarHBondContact N-OE2 3.23Å; T342-E345 PolarHBondContact O-N 2.94Å; T342-E345 VanDerWaalsContact OG1-CD 3.22Å; T342-E345 VanDerWaalsContact OG1-CG 3.23Å; T342-E345 WeakPolarHBondContact OG1-CG 3.45Å; T342-E345 PolarHBondContact OG1-OE2 2.91Å; E345-Q348 PolarHBondContact O-N 3.24Å; E345-V349 WeakPolarHBondContact O-CG2 3.43Å; E345-V349 PolarHBondContact O-N 3.43Å
346	I	95.8	Very high	91.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-46.7	174.7	-62.3	-76.7	0	0	0	109.8	I29 L32 L33 I322 V326 I341 T342 L343 Q348 V349 L350	I29-I346 HydrophobicContact CG2-CG1 4.24Å; L32-I346 HydrophobicContact CD2-CB 4.13Å; L32-I346 HydrophobicContact CD2-CG2 3.56Å; L32-I346 HydrophobicContact CG-CG2 4.16Å; L33-I346 HydrophobicContact CD2-CD1 4.42Å; L33-I346 HydrophobicContact CD2-CG2 4Å; L33-I346 HydrophobicContact CG-CG2 4.48Å; I322-I346 HydrophobicContact CG2-CD1 3.82Å; V326-I346 HydrophobicContact CG2-CD1 4.06Å; I341-I346 HydrophobicContact CG2-CD1 3.83Å; I341-I346 HydrophobicContact CG2-CG1 3.75Å; T342-I346 PolarHBondContact O-N 3.47Å; L343-I346 PolarHBondContact O-N 2.95Å; I346-Q348 PolarHBondContact O-N 3.48Å; I346-V349 PolarHBondContact O-N 2.87Å; I346-L350 HydrophobicContact CG2-CD1 3.86Å; I346-L350 HydrophobicContact CG2-CG 4.04Å; I346-L350 WeakPolarHBondContact O-CB 2.98Å; I346-L350 VanDerWaalsContact O-CG 3.26Å; I346-L350 WeakPolarHBondContact O-CG 3.11Å; I346-L350 PolarHBondContact O-N 3.36Å
347	K	95.4	Very high	91.3	Very high	112 Å²	112	46.8 Å²	46.8	49%	0.487	25%	0.252	S	S	.	.	H	α-helix	trans	-58.8	-43.7	178.4	-76	-178	176.4	-177.1	0	112.7	L32 L343 I344 L350 H351	L32-K347 HydrophobicContact CD2-CG 3.63Å; L343-K347 HydrophobicContact CG-CD 4.47Å; L343-K347 WeakPolarHBondContact O-CG 3.43Å; L343-K347 PolarHBondContact O-N 3.11Å; I344-K347 PolarHBondContact O-N 3.11Å; K347-L350 PolarHBondContact O-N 3.18Å; K347-H351 PolarHBondContact O-N 3.07Å
348	Q	93.8	Very high	91.1	Very high	104 Å²	104	45.8 Å²	45.8	49%	0.486	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-44.5	177.3	-74.3	172.4	-11	0	0	111.8	I344 E345 I346 H351 I352	I344-Q348 VanDerWaalsContact O-CG 3.31Å; I344-Q348 WeakPolarHBondContact O-CG 3.13Å; I344-Q348 PolarHBondContact O-N 3.39Å; E345-Q348 PolarHBondContact O-N 3.24Å; I346-Q348 PolarHBondContact O-N 3.48Å; Q348-H351 WeakPolarHBondContact O-CB 3.39Å; Q348-H351 PolarHBondContact O-N 3.44Å; Q348-I352 PolarHBondContact O-N 2.95Å
349	V	95.7	Very high	90.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-42.9	177.2	170.6	0	0	0	0	111.3	I322 M325 V326 E345 I346 H351 I352 F353	I322-V349 HydrophobicContact CB-CG1 4.3Å; I322-V349 HydrophobicContact CG1-CG1 4.33Å; I322-V349 HydrophobicContact CG2-CG1 3.98Å; M325-V349 HydrophobicContact CB-CG1 3.75Å; M325-V349 HydrophobicContact CB-CG2 4.16Å; M325-V349 HydrophobicContact CG-CB 4.48Å; M325-V349 HydrophobicContact CG-CG1 3.87Å; M325-V349 HydrophobicContact CG-CG2 3.83Å; V326-V349 HydrophobicContact CB-CG2 4.49Å; V326-V349 HydrophobicContact CG2-CB 4.18Å; V326-V349 HydrophobicContact CG2-CG2 3.63Å; E345-V349 WeakPolarHBondContact O-CG2 3.43Å; E345-V349 PolarHBondContact O-N 3.43Å; I346-V349 PolarHBondContact O-N 2.87Å; V349-H351 PolarHBondContact O-N 3.21Å; V349-I352 WeakPolarHBondContact O-CA 3.47Å; V349-I352 WeakPolarHBondContact O-CB 3.39Å; V349-I352 PolarHBondContact O-N 2.9Å; V349-F353 HydrophobicContact CG1-CD2 3.62Å; V349-F353 HydrophobicContact CG1-CE2 3.44Å; V349-F353 VanDerWaalsContact CG1-CE2 3.44Å; V349-F353 HydrophobicContact CG1-CZ 4.42Å; V349-F353 VanDerWaalsContact O-CD2 3.27Å; V349-F353 WeakPolarHBondContact O-CD2 3.32Å; V349-F353 PolarHBondContact O-N 3.36Å
350	L	94.2	Very high	90	Very high	17 Å²	17	51 Å²	51	9%	0.089	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-33.5	176.9	-74	-176.3	0	0	0	112.6	L32 Y36 I322 I346 K347 F353 T354	L32-L350 HydrophobicContact CD1-CD1 3.83Å; L32-L350 HydrophobicContact CD2-CD1 3.97Å; L32-L350 HydrophobicContact CG-CD1 3.63Å; Y36-L350 HydrophobicContact CD1-CD2 4.14Å; Y36-L350 HydrophobicContact CD2-CD2 3.39Å; Y36-L350 HydrophobicContact CE2-CD2 3.82Å; Y36-L350 HydrophobicContact CG-CD2 3.54Å; I322-L350 HydrophobicContact CD1-CD2 3.45Å; I322-L350 VanDerWaalsContact CD1-CD2 3.45Å; I322-L350 HydrophobicContact CG1-CD2 4.07Å; I346-L350 HydrophobicContact CG2-CD1 3.86Å; I346-L350 HydrophobicContact CG2-CG 4.04Å; I346-L350 WeakPolarHBondContact O-CB 2.98Å; I346-L350 VanDerWaalsContact O-CG 3.26Å; I346-L350 WeakPolarHBondContact O-CG 3.11Å; I346-L350 PolarHBondContact O-N 3.36Å; K347-L350 PolarHBondContact O-N 3.18Å; L350-F353 PolarHBondContact O-N 2.7Å; L350-T354 WeakPolarHBondContact O-CB 3.48Å; L350-T354 WeakPolarHBondContact O-CG2 3.34Å; L350-T354 PolarHBondContact O-N 2.9Å; L350-T354 PolarHBondContact O-OG1 3.42Å
351	H	91	Very high	88.7	Confident	130 Å²	130	53.9 Å²	53.9	60%	0.602	27%	0.269	S	S	*	.	H	α-helix	trans	-61	-45.7	172.4	-174.8	69.8	0	0	0	111.5	K347 Q348 V349 F353 T354 S355	K347-H351 PolarHBondContact O-N 3.07Å; Q348-H351 WeakPolarHBondContact O-CB 3.39Å; Q348-H351 PolarHBondContact O-N 3.44Å; V349-H351 PolarHBondContact O-N 3.21Å; H351-F353 PolarHBondContact O-N 3.35Å; H351-T354 PolarHBondContact O-N 3.43Å; H351-T354 PolarHBondContact O-OG1 2.96Å; H351-S355 VanDerWaalsContact O-CB 3.32Å; H351-S355 WeakPolarHBondContact O-CB 3.02Å; H351-S355 PolarHBondContact O-N 3.38Å; H351-S355 PolarHBondContact O-OG 3.44Å
352	I	89.1	Confident	86.6	Confident	44 Å²	44	57.8 Å²	57.8	23%	0.226	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-46.7	174.3	-63.6	169.6	0	0	0	110.3	Q348 V349 T354 S355 I356 I357	Q348-I352 PolarHBondContact O-N 2.95Å; V349-I352 WeakPolarHBondContact O-CA 3.47Å; V349-I352 WeakPolarHBondContact O-CB 3.39Å; V349-I352 PolarHBondContact O-N 2.9Å; I352-T354 VanDerWaalsContact C-N 3.34Å; I352-T354 PolarHBondContact O-N 2.86Å; I352-S355 PolarHBondContact O-N 2.84Å; I352-I356 HydrophobicContact CG2-CB 4.31Å; I352-I356 HydrophobicContact CG2-CD1 4.26Å; I352-I356 WeakPolarHBondContact O-CA 3.46Å; I352-I356 WeakPolarHBondContact O-CB 3.44Å; I352-I356 PolarHBondContact O-N 2.97Å; I352-I357 HydrophobicContact CG2-CD1 4.49Å; I352-I357 PolarHBondContact O-N 3.5Å
353	F	91.4	Very high	83.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.317	C	S	.	.	I	π-helix	trans	-63.4	-41.6	-177.2	-84.5	-115.9	0	0	0	112.1	Y36 L185 D321 I322 M325 V349 L350 H351 I357 Y358	Y36-F353 HydrophobicContact CE2-CB 4.24Å; Y36-F353 VanDerWaalsContact OH-CD1 3.32Å; Y36-F353 WeakPolarHBondContact OH-CD1 3.47Å; L185-F353 HydrophobicContact CD2-CZ 4.13Å; D321-F353 HydrophobicContact CB-CE1 3.61Å; D321-F353 HydrophobicContact CB-CZ 3.59Å; I322-F353 HydrophobicContact CG1-CD1 4.15Å; I322-F353 HydrophobicContact CG1-CD2 4.46Å; I322-F353 HydrophobicContact CG1-CE1 3.99Å; I322-F353 HydrophobicContact CG1-CE2 4.34Å; I322-F353 HydrophobicContact CG1-CG 4.35Å; I322-F353 HydrophobicContact CG1-CZ 4.07Å; M325-F353 HydrophobicContact CB-CE2 4.05Å; M325-F353 HydrophobicContact CG-CE2 4.31Å; V349-F353 HydrophobicContact CG1-CD2 3.62Å; V349-F353 HydrophobicContact CG1-CE2 3.44Å; V349-F353 VanDerWaalsContact CG1-CE2 3.44Å; V349-F353 HydrophobicContact CG1-CZ 4.42Å; V349-F353 VanDerWaalsContact O-CD2 3.27Å; V349-F353 WeakPolarHBondContact O-CD2 3.32Å; V349-F353 PolarHBondContact O-N 3.36Å; L350-F353 PolarHBondContact O-N 2.7Å; H351-F353 PolarHBondContact O-N 3.35Å; F353-I357 HydrophobicContact CD1-CD1 3.92Å; F353-I357 HydrophobicContact CD2-CD1 3.7Å; F353-I357 HydrophobicContact CE1-CD1 3.92Å; F353-I357 HydrophobicContact CE2-CD1 3.67Å; F353-I357 HydrophobicContact CG-CD1 3.85Å; F353-I357 HydrophobicContact CZ-CD1 3.81Å; F353-I357 PolarHBondContact O-N 2.56Å; F353-Y358 HydrophobicContact CD1-CD2 4.3Å; F353-Y358 HydrophobicContact CD1-CE2 4.09Å; F353-Y358 PolarHBondContact O-N 3.12Å
354	T	88	Confident	81	Confident	29 Å²	29	65 Å²	65	18%	0.178	34%	0.337	C	S	.	.	I	π-helix	trans	-83.2	-17.3	-175.7	54.5	0	0	0	0	114.5	Y36 L350 H351 I352 P359	Y36-T354 HydrophobicContact CD2-CG2 4.42Å; Y36-T354 HydrophobicContact CE2-CG2 4.26Å; L350-T354 WeakPolarHBondContact O-CB 3.48Å; L350-T354 WeakPolarHBondContact O-CG2 3.34Å; L350-T354 PolarHBondContact O-N 2.9Å; L350-T354 PolarHBondContact O-OG1 3.42Å; H351-T354 PolarHBondContact O-N 3.43Å; H351-T354 PolarHBondContact O-OG1 2.96Å; I352-T354 VanDerWaalsContact C-N 3.34Å; I352-T354 PolarHBondContact O-N 2.86Å; T354-P359 WeakPolarHBondContact O-CA 3.24Å
355	S	85.3	Confident	77.8	Confident	54 Å²	54	65.3 Å²	65.3	38%	0.378	35%	0.348	S	S	.	.	I	π-helix	trans	-103.9	-32.2	177.9	60	0	0	0	0	113.6	H351 I352	H351-S355 VanDerWaalsContact O-CB 3.32Å; H351-S355 WeakPolarHBondContact O-CB 3.02Å; H351-S355 PolarHBondContact O-N 3.38Å; H351-S355 PolarHBondContact O-OG 3.44Å; I352-S355 PolarHBondContact O-N 2.84Å
356	I	83.4	Confident	74.6	Confident	59 Å²	59	69.6 Å²	69.6	30%	0.303	38%	0.38	S	S	.	.	I	π-helix	trans	-112.4	-49.9	-168.3	-65.8	-179.9	0	0	0	111.7	Y177 I352	Y177-I356 HydrophobicContact CD2-CG2 3.41Å; Y177-I356 VanDerWaalsContact CD2-CG2 3.41Å; Y177-I356 HydrophobicContact CE2-CB 4.26Å; Y177-I356 HydrophobicContact CE2-CG2 3.05Å; Y177-I356 HydrophobicContact CG-CG2 4.45Å; Y177-I356 PolarHBondContact OH-O 3.27Å; Y177-I356 VanDerWaalsContact OH-O 3.06Å; I352-I356 HydrophobicContact CG2-CB 4.31Å; I352-I356 HydrophobicContact CG2-CD1 4.26Å; I352-I356 WeakPolarHBondContact O-CA 3.46Å; I352-I356 WeakPolarHBondContact O-CB 3.44Å; I352-I356 PolarHBondContact O-N 2.97Å
357	I	85.1	Confident	71.4	Confident	8 Å²	8	78.5 Å²	78.5	4%	0.041	44%	0.442	C	S	.	.	I	π-helix	trans	-85.5	-51	-170.9	-57.6	179.3	0	0	0	111.7	I68 V181 I352 F353 P359	I68-I357 HydrophobicContact CD1-CG2 3.89Å; V181-I357 HydrophobicContact CG1-CD1 3.52Å; V181-I357 HydrophobicContact CG1-CG1 3.93Å; I352-I357 HydrophobicContact CG2-CD1 4.49Å; I352-I357 PolarHBondContact O-N 3.5Å; F353-I357 HydrophobicContact CD1-CD1 3.92Å; F353-I357 HydrophobicContact CD2-CD1 3.7Å; F353-I357 HydrophobicContact CE1-CD1 3.92Å; F353-I357 HydrophobicContact CE2-CD1 3.67Å; F353-I357 HydrophobicContact CG-CD1 3.85Å; F353-I357 HydrophobicContact CZ-CD1 3.81Å; F353-I357 PolarHBondContact O-N 2.56Å; I357-P359 VanDerWaalsContact C-CD 3.46Å; I357-P359 WeakPolarHBondContact O-CD 3.37Å
358	Y	86	Confident	70.2	Confident	15 Å²	15	76.8 Å²	76.8	6%	0.059	44%	0.44	C	S	.	.	S	Bend	trans	-126.3	68.7	179.5	-51.7	-53.9	0	0	0	108.2	Q66 R69 D318 F353 R360	Q66-Y358 HydrophobicContact CB-CD1 4.45Å; Q66-Y358 HydrophobicContact CB-CE1 4.23Å; Q66-Y358 HydrophobicContact CG-CD1 4.12Å; Q66-Y358 HydrophobicContact CG-CE1 4.38Å; R69-Y358 HydrophobicContact CG-CE1 3.89Å; R69-Y358 WeakPolarHBondContact CG-OH 3.44Å; D318-Y358 WeakPolarHBondContact OD1-CE2 3.38Å; D318-Y358 PolarHBondContact OD1-OH 2.8Å; F353-Y358 HydrophobicContact CD1-CD2 4.3Å; F353-Y358 HydrophobicContact CD1-CE2 4.09Å; F353-Y358 PolarHBondContact O-N 3.12Å; Y358-R360 PolarHBondContact O-N 2.59Å; Y358-R360 VanDerWaalsContact O-N 3.14Å
359	P	79.4	Confident	69	Low	76 Å²	76	75.4 Å²	75.4	49%	0.494	44%	0.438	S	S	.	.			trans	-56.1	124.6	177.9	25	-33.1	0	0	0	108.6	T354 I357 Q361	T354-P359 WeakPolarHBondContact O-CA 3.24Å; I357-P359 VanDerWaalsContact C-CD 3.46Å; I357-P359 WeakPolarHBondContact O-CD 3.37Å; P359-Q361 PolarHBondContact O-N 3.18Å
360	R	74.3	Confident	67.5	Low	132 Å²	132	79.6 Å²	79.6	50%	0.498	46%	0.462	S	S	.	.			trans	-62.8	125	177.1	-62.5	179.9	-175.3	174.2	1.5	107.7	Y358 S362	Y358-R360 PolarHBondContact O-N 2.59Å; Y358-R360 VanDerWaalsContact O-N 3.14Å; R360-S362 PolarHBondContact O-N 2.76Å; R360-S362 VanDerWaalsContact O-N 3.11Å
361	Q	64.3	Low	65.9	Low	114 Å²	114	83.2 Å²	83.2	53%	0.533	48%	0.484	S	S	.	.			trans	-64.6	115.9	165.7	-66.6	-179.8	4.5	0	0	105.9	P359 T363	P359-Q361 PolarHBondContact O-N 3.18Å; Q361-T363 PolarHBondContact O-N 2.78Å; Q361-T363 VanDerWaalsContact O-N 3.11Å
362	S	50.1	Low	64.4	Low	89 Å²	89	80.3 Å²	80.3	62%	0.622	48%	0.476	S	S	*	.			trans	-54.4	121.6	165	48.2	0	0	0	0	105.9	R360 I364	R360-S362 PolarHBondContact O-N 2.76Å; R360-S362 VanDerWaalsContact O-N 3.11Å; S362-I364 PolarHBondContact O-N 3.43Å
363	T	37.1	Very low	62.7	Low	127 Å²	127	82.7 Å²	82.7	78%	0.779	49%	0.493	S	S	*	.			trans	-62	81.2	167.2	45.1	0	0	0	0	107.2	Q361 S365	Q361-T363 PolarHBondContact O-N 2.78Å; Q361-T363 VanDerWaalsContact O-N 3.11Å; T363-S365 VanDerWaalsContact C-N 3.32Å; T363-S365 PolarHBondContact O-N 3.38Å
364	I	31.6	Very low	60.7	Low	133 Å²	133	88.6 Å²	88.6	68%	0.682	53%	0.528	S	S	*	.			trans	-75.4	102.1	161.4	-65.1	172.4	0	0	0	103	S362 S366	S362-I364 PolarHBondContact O-N 3.43Å; I364-S366 VanDerWaalsContact C-N 3.3Å; I364-S366 PolarHBondContact O-N 3.36Å
365	S	26.6	Very low	58.6	Low	110 Å²	110	93.2 Å²	93.2	77%	0.769	56%	0.555	S	S	*	*			trans	-43.6	96	155	45.5	0	0	0	0	109.4	T363	T363-S365 VanDerWaalsContact C-N 3.32Å; T363-S365 PolarHBondContact O-N 3.38Å
366	S	29.5	Very low	56.3	Low	108 Å²	108	96.5 Å²	96.5	76%	0.755	57%	0.57	S	S	*	*			trans	-88.7	107.5	147.5	55.5	0	0	0	0	106	I364	I364-S366 VanDerWaalsContact C-N 3.3Å; I364-S366 PolarHBondContact O-N 3.36Å
367	S	28.5	Very low	53.9	Low	187 Å²	187	99.9 Å²	99.9	100%	1.308	60%	0.595	S	S	*	*			trans	-30	0	161.5	49.8	0	0	0	0	114.9

Retrieved 367 of 367 residues in 301.1 ms (Link to these results)

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