A0A087XEE8_POEFO Loading...

G protein-coupled receptor 180

AlphaFold DB , UniProt , Accession A0A087XEE8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 436 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	44.1	Very low	43.6	Very low	217 Å²	217	102.6 Å²	102.6	100%	1.069	59%	0.585	S	S	*	*				0	-42.9	0	-64.9	-174	80.6	0	0	112.6	R3 S5	M1-R3 PolarHBondContact O-N 2.74Å; M1-S5 PolarHBondContact O-N 3.31Å; M1-S5 PolarHBondContact O-OG 3.48Å
2	S	48.4	Very low	43.7	Very low	94 Å²	94	98.3 Å²	98.3	66%	0.657	56%	0.558	S	S	*	*	H	α-helix	trans	-66.7	-30.8	-179	166.3	0	0	0	0	116.3	S5 A6	S2-S5 WeakPolarHBondContact CA-OG 3.48Å; S2-S5 PolarHBondContact O-OG 3.06Å; S2-A6 WeakPolarHBondContact O-CB 3.22Å; S2-A6 PolarHBondContact O-N 3.48Å
3	R	38.9	Very low	43.6	Very low	223 Å²	223	99.7 Å²	99.7	84%	0.842	56%	0.562	S	S	*	*	H	α-helix	trans	-78.2	-27.1	178.7	-65.5	-169.2	-179.6	-167.5	0.2	114.3	M1 T7	M1-R3 PolarHBondContact O-N 2.74Å; R3-T7 PolarHBondContact O-N 3.32Å; R3-T7 PolarHBondContact O-OG1 2.95Å
4	L	40.1	Very low	43.2	Very low	127 Å²	127	101.9 Å²	101.9	67%	0.665	57%	0.571	S	S	*	*	H	α-helix	trans	-77.9	-35.4	176.1	-121.1	121.2	0	0	0	111.1	T7 L8	L4-T7 WeakPolarHBondContact CA-OG1 3.45Å; L4-T7 PolarHBondContact O-OG1 3.41Å; L4-T7 VanDerWaalsContact O-OG1 3.1Å; L4-L8 WeakPolarHBondContact O-CB 2.92Å; L4-L8 PolarHBondContact O-N 3.41Å
5	S	42.5	Very low	42.9	Very low	70 Å²	70	96.9 Å²	96.9	49%	0.49	55%	0.546	S	S	.	.	H	α-helix	trans	-70.2	-34.1	172.7	56.9	0	0	0	0	112.5	M1 S2 A9	M1-S5 PolarHBondContact O-N 3.31Å; M1-S5 PolarHBondContact O-OG 3.48Å; S2-S5 WeakPolarHBondContact CA-OG 3.48Å; S2-S5 PolarHBondContact O-OG 3.06Å; S5-A9 VanDerWaalsContact O-CB 3.28Å; S5-A9 WeakPolarHBondContact O-CB 3.36Å; S5-A9 PolarHBondContact O-N 3.11Å
6	A	37.3	Very low	42.5	Very low	53 Å²	53	97.8 Å²	97.8	44%	0.438	55%	0.548	S	S	.	.	H	α-helix	trans	-70.7	-38.9	177.3	0	0	0	0	0	112.4	S2 A9 V10	S2-A6 WeakPolarHBondContact O-CB 3.22Å; S2-A6 PolarHBondContact O-N 3.48Å; A6-A9 PolarHBondContact O-N 3.17Å; A6-V10 VanDerWaalsContact O-CG2 3.23Å; A6-V10 WeakPolarHBondContact O-CG2 3.48Å; A6-V10 PolarHBondContact O-N 3.22Å
7	T	47.3	Very low	41.9	Very low	91 Å²	91	101.9 Å²	101.9	56%	0.558	56%	0.562	S	S	*	*	H	α-helix	trans	-70.2	-36.8	174.3	37.6	0	0	0	0	112.1	R3 L4 V10 A11	R3-T7 PolarHBondContact O-N 3.32Å; R3-T7 PolarHBondContact O-OG1 2.95Å; L4-T7 WeakPolarHBondContact CA-OG1 3.45Å; L4-T7 PolarHBondContact O-OG1 3.41Å; L4-T7 VanDerWaalsContact O-OG1 3.1Å; T7-V10 PolarHBondContact O-N 3.33Å; T7-A11 PolarHBondContact O-N 3.24Å
8	L	47.2	Very low	41.5	Very low	69 Å²	69	99.4 Å²	99.4	36%	0.361	56%	0.557	S	S	.	*	H	α-helix	trans	-64.4	-41.4	170.7	-113.3	115.1	0	0	0	112.7	L4 V10 A11 L12 F240	L4-L8 WeakPolarHBondContact O-CB 2.92Å; L4-L8 PolarHBondContact O-N 3.41Å; L8-V10 VanDerWaalsContact C-N 3.32Å; L8-A11 PolarHBondContact O-N 3.11Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 PolarHBondContact O-N 3.03Å; L8-F240 HydrophobicContact CD2-CE2 3.68Å; L8-F240 HydrophobicContact CD2-CZ 3.65Å
9	A	45.1	Very low	41.2	Very low	43 Å²	43	98.4 Å²	98.4	36%	0.355	56%	0.557	S	S	.	*	H	α-helix	trans	-65.8	-37.5	176.8	0	0	0	0	0	111.3	S5 A6 L12 L13	S5-A9 VanDerWaalsContact O-CB 3.28Å; S5-A9 WeakPolarHBondContact O-CB 3.36Å; S5-A9 PolarHBondContact O-N 3.11Å; A6-A9 PolarHBondContact O-N 3.17Å; A9-L12 PolarHBondContact O-N 2.91Å; A9-L13 VanDerWaalsContact O-CB 3.23Å; A9-L13 WeakPolarHBondContact O-CB 3.44Å; A9-L13 WeakPolarHBondContact O-CD1 3.34Å; A9-L13 WeakPolarHBondContact O-CG 3.09Å; A9-L13 PolarHBondContact O-N 3.14Å
10	V	43.8	Very low	41.2	Very low	78 Å²	78	93.9 Å²	93.9	47%	0.473	53%	0.534	S	S	.	.	H	α-helix	trans	-67.8	-39.6	175.2	170.5	0	0	0	0	111.4	A6 T7 L8 L12 L13 L14	A6-V10 VanDerWaalsContact O-CG2 3.23Å; A6-V10 WeakPolarHBondContact O-CG2 3.48Å; A6-V10 PolarHBondContact O-N 3.22Å; T7-V10 PolarHBondContact O-N 3.33Å; L8-V10 VanDerWaalsContact C-N 3.32Å; V10-L12 PolarHBondContact O-N 3.36Å; V10-L13 PolarHBondContact O-N 3.03Å; V10-L14 HydrophobicContact CG1-CD1 3.7Å; V10-L14 HydrophobicContact CG1-CG 4.21Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.23Å; V10-L14 WeakPolarHBondContact O-CG 3.07Å; V10-L14 PolarHBondContact O-N 3.26Å
11	A	45.3	Very low	42.4	Very low	64 Å²	64	90.1 Å²	90.1	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-38.5	173	0	0	0	0	0	112.7	T7 L8 L13	T7-A11 PolarHBondContact O-N 3.24Å; L8-A11 PolarHBondContact O-N 3.11Å; A11-L13 VanDerWaalsContact C-N 3.33Å
12	L	44.8	Very low	44	Very low	50 Å²	50	80.3 Å²	80.3	26%	0.262	46%	0.464	S	S	.	.	H	α-helix	trans	-70.6	-24.2	173	-93.9	150.2	0	0	0	114	L8 A9 V10 S15 L16 L237	L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 PolarHBondContact O-N 3.03Å; A9-L12 PolarHBondContact O-N 2.91Å; V10-L12 PolarHBondContact O-N 3.36Å; L12-S15 PolarHBondContact O-OG 2.86Å; L12-S15 VanDerWaalsContact O-OG 3.08Å; L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L12-L237 HydrophobicContact CD2-CD2 4.47Å
13	L	42.4	Very low	45.6	Very low	117 Å²	117	76.3 Å²	76.3	61%	0.613	44%	0.435	S	S	*	.	H	α-helix	trans	-91.3	-26.3	-179.2	-76.5	165.6	0	0	0	112.5	A9 V10 A11 S15 L16	A9-L13 VanDerWaalsContact O-CB 3.23Å; A9-L13 WeakPolarHBondContact O-CB 3.44Å; A9-L13 WeakPolarHBondContact O-CD1 3.34Å; A9-L13 WeakPolarHBondContact O-CG 3.09Å; A9-L13 PolarHBondContact O-N 3.14Å; V10-L13 PolarHBondContact O-N 3.03Å; A11-L13 VanDerWaalsContact C-N 3.33Å; L13-S15 VanDerWaalsContact C-N 3.26Å; L13-L16 HydrophobicContact CD2-CD1 4.16Å; L13-L16 WeakPolarHBondContact O-CD1 3.49Å
14	L	37.7	Very low	48	Very low	131 Å²	131	72.9 Å²	72.9	69%	0.686	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.8	174.4	-71.1	168.4	0	0	0	112.8	V10	V10-L14 HydrophobicContact CG1-CD1 3.7Å; V10-L14 HydrophobicContact CG1-CG 4.21Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.23Å; V10-L14 WeakPolarHBondContact O-CG 3.07Å; V10-L14 PolarHBondContact O-N 3.26Å
15	S	39	Very low	50.3	Low	27 Å²	27	68.4 Å²	68.4	19%	0.189	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	21.1	177.9	65.4	0	0	0	0	113.7	L12 L13	L12-S15 PolarHBondContact O-OG 2.86Å; L12-S15 VanDerWaalsContact O-OG 3.08Å; L13-S15 VanDerWaalsContact C-N 3.26Å
16	L	35.8	Very low	52.6	Low	111 Å²	111	69.8 Å²	69.8	58%	0.581	41%	0.412	S	S	*	.			trans	-87	-7.8	-176.3	-103.2	96.1	0	0	0	114.8	L12 L13 A18	L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L13-L16 HydrophobicContact CD2-CD1 4.16Å; L13-L16 WeakPolarHBondContact O-CD1 3.49Å; L16-A18 PolarHBondContact O-N 3.29Å
17	E	33.2	Very low	55.2	Low	167 Å²	167	67.3 Å²	67.3	78%	0.78	39%	0.391	S	S	*	.			trans	-84.7	99.6	171.4	-76.9	176.1	169.4	0	0	108.2
18	A	33.5	Very low	57.2	Low	58 Å²	58	63.3 Å²	63.3	48%	0.479	37%	0.368	S	S	.	.			trans	-120.4	105.6	177.3	0	0	0	0	0	108.6	L16 G20 P232	L16-A18 PolarHBondContact O-N 3.29Å; A18-G20 PolarHBondContact O-N 3.43Å; A18-P232 HydrophobicContact CB-CB 3.59Å; A18-P232 HydrophobicContact CB-CG 4.46Å
19	S	36.5	Very low	59.2	Low	79 Å²	79	60.1 Å²	60.1	55%	0.552	35%	0.352	S	S	*	.			trans	-76.8	114.8	169.8	-164.6	0	0	0	0	109.2
20	G	41.4	Very low	61.2	Low	9 Å²	9	61.2 Å²	61.2	9%	0.093	35%	0.35	C	S	.	.			trans	-85.1	169.5	171.4	0	0	0	0	0	111.5	A18 T22 V23 G228	A18-G20 PolarHBondContact O-N 3.43Å; G20-T22 CarbonylContact O-C 3.32Å; G20-T22 PolarHBondContact O-N 3.26Å; G20-V23 WeakPolarHBondContact O-CG2 3.41Å; G20-G228 CarbonylContact C-O 3.58Å; G20-G228 VanDerWaalsContact C-O 3.28Å; G20-G228 WeakPolarHBondContact CA-O 3.44Å
21	K	65.3	Low	63.2	Low	15 Å²	15	59.2 Å²	59.2	7%	0.065	34%	0.341	C	S	.	.	S	Bend	trans	-66.8	-12	166.9	-77	169.1	-170.4	152.6	0	113.5	F43 H156 S158 E161 Y224 G228	K21-F43 HydrophobicContact CB-CD2 4.33Å; K21-F43 HydrophobicContact CB-CE2 4.33Å; K21-F43 HydrophobicContact CD-CD2 3.68Å; K21-F43 HydrophobicContact CD-CE2 3.56Å; K21-F43 HydrophobicContact CG-CD2 3.87Å; K21-F43 HydrophobicContact CG-CE2 4.11Å; K21-H156 WeakPolarHBondContact CD-O 3.19Å; K21-S158 WeakPolarHBondContact CE-OG 3.22Å; K21-S158 VanDerWaalsContact NZ-CB 3.28Å; K21-S158 PolarHBondContact NZ-OG 2.97Å; K21-E161 WeakPolarHBondContact CE-OE1 3.42Å; K21-E161 IonicContact NZ-OE1 3.12Å; K21-E161 PolarHBondContact NZ-OE1 3.27Å; K21-E161 IonicContact NZ-OE2 2.84Å; K21-E161 PolarHBondContact NZ-OE2 3.18Å; K21-Y224 HydrophobicContact CD-CE1 4.02Å; K21-Y224 WeakPolarHBondContact CD-OH 3.47Å; K21-Y224 WeakPolarHBondContact CE-OH 3.5Å; K21-Y224 WeakPolarHBondContact CG-OH 3.19Å; K21-Y224 PolarHBondContact NZ-OH 2.04Å; K21-Y224 VanDerWaalsContact NZ-OH 3.13Å; K21-G228 PolarHBondContact N-O 3.48Å
22	T	77.8	Confident	65.2	Low	11 Å²	11	56.1 Å²	56.1	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	105	152.6	-61.5	0	0	0	0	108.1	G20 N141 L142 L143 D227 G228	G20-T22 CarbonylContact O-C 3.32Å; G20-T22 PolarHBondContact O-N 3.26Å; T22-N141 VanDerWaalsContact CG2-OD1 3.24Å; T22-N141 WeakPolarHBondContact CG2-OD1 3.31Å; T22-L142 CarbonylContact C-O 3.53Å; T22-L142 WeakPolarHBondContact CA-O 3.44Å; T22-L143 HydrophobicContact CG2-CD2 3.49Å; T22-L143 VanDerWaalsContact CG2-CD2 3.49Å; T22-L143 VanDerWaalsContact OG1-CD2 3.32Å; T22-L143 WeakPolarHBondContact OG1-CD2 3.34Å; T22-D227 WeakPolarHBondContact CB-O 3.28Å; T22-D227 PolarHBondContact OG1-O 3.34Å; T22-G228 PolarHBondContact N-O 3.46Å
23	V	83.6	Confident	67.3	Low	9 Å²	9	56.5 Å²	56.5	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.8	-177.7	-177.4	0	0	0	0	108.5	G20 I40 T41 F140 L142	G20-V23 WeakPolarHBondContact O-CG2 3.41Å; V23-I40 HydrophobicContact CG1-CG2 4.11Å; V23-T41 HydrophobicContact CG2-CG2 4.3Å; V23-F140 HydrophobicContact CB-CE2 4.4Å; V23-F140 HydrophobicContact CG1-CE2 3.95Å; V23-F140 HydrophobicContact CG1-CZ 4.11Å; V23-L142 HydrophobicContact CB-CB 4.4Å; V23-L142 PolarHBondContact N-O 2.86Å; V23-L142 PolarHBondContact O-N 3.45Å
24	K	87.6	Confident	69.3	Low	152 Å²	152	57.6 Å²	57.6	66%	0.661	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.7	172.5	-67.6	179.4	-176.6	178.4	0	108.4	F140 N141	K24-F140 WeakPolarHBondContact CA-O 3.18Å; K24-N141 WeakPolarHBondContact CE-OD1 3.27Å; K24-N141 HydrophobicContact CG-CB 4.18Å; K24-N141 VanDerWaalsContact CG-OD1 3.25Å; K24-N141 WeakPolarHBondContact CG-OD1 3.34Å
25	G	88.6	Confident	71.5	Confident	32 Å²	32	55.3 Å²	55.3	33%	0.33	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	-165.2	-178.8	0	0	0	0	0	112.6	F140	G25-F140 VanDerWaalsContact C-CD1 3.47Å; G25-F140 PolarHBondContact N-O 3.1Å; G25-F140 VanDerWaalsContact O-CD1 3.27Å; G25-F140 WeakPolarHBondContact O-CD1 3.33Å; G25-F140 PolarHBondContact O-N 3.4Å
26	L	91.2	Very high	73.7	Confident	100 Å²	100	57.3 Å²	57.3	52%	0.524	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.5	179.5	-69.2	172.6	0	0	0	108.4	G28 Q38 D137	L26-G28 PolarHBondContact O-N 2.74Å; L26-Q38 PolarHBondContact O-NE2 2.73Å; L26-D137 HydrophobicContact CB-CB 4.03Å; L26-D137 HydrophobicContact CD1-CB 4.37Å; L26-D137 HydrophobicContact CD2-CB 4.06Å; L26-D137 HydrophobicContact CG-CB 4.38Å
27	F	91.2	Very high	76.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	109	166.6	-66.8	-41.1	0	0	0	108.8	I40 L57 L70 L98 Y120 L138 F140	F27-I40 HydrophobicContact CD1-CD1 3.68Å; F27-I40 HydrophobicContact CD1-CG1 4.43Å; F27-I40 HydrophobicContact CE1-CD1 3.5Å; F27-I40 HydrophobicContact CE1-CG1 3.83Å; F27-L57 HydrophobicContact CD2-CD2 4.37Å; F27-L57 HydrophobicContact CE2-CD2 3.9Å; F27-L70 HydrophobicContact CE1-CD2 3.95Å; F27-L70 HydrophobicContact CZ-CD2 3.69Å; F27-L70 HydrophobicContact CZ-CG 4.47Å; F27-L98 HydrophobicContact CD2-CD1 4.09Å; F27-L98 HydrophobicContact CE2-CD1 3.58Å; F27-L98 HydrophobicContact CZ-CD1 4.26Å; F27-Y120 HydrophobicContact CB-CD1 3.85Å; F27-Y120 HydrophobicContact CB-CD2 3.71Å; F27-Y120 HydrophobicContact CB-CE1 3.77Å; F27-Y120 HydrophobicContact CB-CE2 3.57Å; F27-Y120 HydrophobicContact CB-CG 3.84Å; F27-Y120 VanDerWaalsContact CD1-CB 3.48Å; F27-Y120 HydrophobicContact CD1-CD1 4.1Å; F27-Y120 AromaticContact CD1-CD2 3.53Å; F27-Y120 HydrophobicContact CD1-CD2 3.53Å; F27-Y120 HydrophobicContact CD1-CE2 4.28Å; F27-Y120 AromaticContact CD1-CG 3.42Å; F27-Y120 HydrophobicContact CD1-CG 3.42Å; F27-Y120 VanDerWaalsContact CD1-CG 3.42Å; F27-Y120 AromaticContact CD2-CD2 3.76Å; F27-Y120 HydrophobicContact CD2-CD2 3.76Å; F27-Y120 AromaticContact CD2-CE2 3.91Å; F27-Y120 HydrophobicContact CD2-CE2 3.91Å; F27-Y120 HydrophobicContact CD2-CG 4.47Å; F27-Y120 HydrophobicContact CE1-CD2 4.04Å; F27-Y120 HydrophobicContact CE1-CG 4.07Å; F27-Y120 HydrophobicContact CE2-CD2 4.22Å; F27-Y120 HydrophobicContact CG-CD1 4.2Å; F27-Y120 AromaticContact CG-CD2 3.39Å; F27-Y120 HydrophobicContact CG-CD2 3.39Å; F27-Y120 HydrophobicContact CG-CE1 4.48Å; F27-Y120 AromaticContact CG-CE2 3.68Å; F27-Y120 HydrophobicContact CG-CE2 3.68Å; F27-Y120 AromaticContact CG-CG 3.67Å; F27-Y120 HydrophobicContact CG-CG 3.67Å; F27-Y120 HydrophobicContact CZ-CD2 4.37Å; F27-L138 HydrophobicContact CB-CB 4.14Å; F27-L138 WeakPolarHBondContact CB-O 3.47Å; F27-L138 HydrophobicContact CD2-CB 4.46Å; F27-L138 HydrophobicContact CD2-CD2 4.09Å; F27-L138 HydrophobicContact CD2-CG 4.15Å; F27-L138 PolarHBondContact N-O 2.86Å; F27-L138 PolarHBondContact O-N 3.13Å; F27-F140 HydrophobicContact CB-CD1 4.45Å; F27-F140 AromaticContact CD1-CD1 3.33Å; F27-F140 HydrophobicContact CD1-CD1 3.33Å; F27-F140 AromaticContact CD1-CE1 3.38Å; F27-F140 HydrophobicContact CD1-CE1 3.38Å; F27-F140 HydrophobicContact CD1-CG 4.08Å; F27-F140 HydrophobicContact CD1-CZ 4.17Å; F27-F140 HydrophobicContact CD2-CB 3.8Å; F27-F140 AromaticContact CD2-CD1 3.66Å; F27-F140 HydrophobicContact CD2-CD1 3.66Å; F27-F140 AromaticContact CD2-CG 3.95Å; F27-F140 HydrophobicContact CD2-CG 3.95Å; F27-F140 HydrophobicContact CE1-CB 4.31Å; F27-F140 AromaticContact CE1-CD1 3.23Å; F27-F140 HydrophobicContact CE1-CD1 3.23Å; F27-F140 AromaticContact CE1-CD2 3.87Å; F27-F140 HydrophobicContact CE1-CD2 3.87Å; F27-F140 AromaticContact CE1-CE1 3.29Å; F27-F140 HydrophobicContact CE1-CE1 3.29Å; F27-F140 AromaticContact CE1-CE2 3.94Å; F27-F140 HydrophobicContact CE1-CE2 3.94Å; F27-F140 AromaticContact CE1-CG 3.54Å; F27-F140 HydrophobicContact CE1-CG 3.54Å; F27-F140 AromaticContact CE1-CZ 3.68Å; F27-F140 HydrophobicContact CE1-CZ 3.68Å; F27-F140 HydrophobicContact CE2-CB 3.24Å; F27-F140 AromaticContact CE2-CD1 3.6Å; F27-F140 HydrophobicContact CE2-CD1 3.6Å; F27-F140 HydrophobicContact CE2-CD2 4.22Å; F27-F140 HydrophobicContact CE2-CE1 4.5Å; F27-F140 AromaticContact CE2-CG 3.43Å; F27-F140 HydrophobicContact CE2-CG 3.43Å; F27-F140 VanDerWaalsContact CE2-CG 3.43Å; F27-F140 AromaticContact CG-CD1 3.53Å; F27-F140 HydrophobicContact CG-CD1 3.53Å; F27-F140 HydrophobicContact CG-CE1 4.02Å; F27-F140 HydrophobicContact CG-CG 4.25Å; F27-F140 HydrophobicContact CZ-CB 3.53Å; F27-F140 AromaticContact CZ-CD1 3.37Å; F27-F140 HydrophobicContact CZ-CD1 3.37Å; F27-F140 AromaticContact CZ-CD2 3.55Å; F27-F140 HydrophobicContact CZ-CD2 3.55Å; F27-F140 AromaticContact CZ-CE1 3.9Å; F27-F140 HydrophobicContact CZ-CE1 3.9Å; F27-F140 HydrophobicContact CZ-CE2 4.08Å; F27-F140 AromaticContact CZ-CG 3.17Å; F27-F140 HydrophobicContact CZ-CG 3.17Å; F27-F140 HydrophobicContact CZ-CZ 4.24Å
28	G	89.3	Confident	78.7	Confident	8 Å²	8	45.8 Å²	45.8	8%	0.082	25%	0.254	C	S	.	.			trans	-104.3	121.5	-177.9	0	0	0	0	0	110.7	L26 E30 A31 A32 D137	L26-G28 PolarHBondContact O-N 2.74Å; G28-E30 PolarHBondContact O-N 3.48Å; G28-A31 PolarHBondContact O-N 3.39Å; G28-A32 WeakPolarHBondContact O-CB 3.48Å; G28-A32 PolarHBondContact O-N 3.43Å; G28-D137 WeakPolarHBondContact CA-OD1 3.33Å
29	S	89.3	Confident	81.3	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-32.8	176.7	-56.7	0	0	0	0	111.6	R33 K66 D122	S29-R33 WeakPolarHBondContact O-CB 3.45Å; S29-R33 PolarHBondContact O-N 3.41Å; S29-K66 PolarHBondContact OG-NZ 3.27Å; S29-D122 WeakPolarHBondContact CA-OD2 3.35Å; S29-D122 WeakPolarHBondContact CB-OD2 3.32Å; S29-D122 PolarHBondContact OG-OD2 2.87Å
30	E	87.6	Confident	83.7	Confident	66 Å²	66	42.2 Å²	42.2	31%	0.308	22%	0.218	S	C	.	.	H	α-helix	trans	-69.3	-47.2	177.4	-173.9	60	-153.9	0	0	112.1	G28 A32 R33 Q34	G28-E30 PolarHBondContact O-N 3.48Å; E30-A32 VanDerWaalsContact C-N 3.3Å; E30-A32 PolarHBondContact O-N 2.95Å; E30-R33 PolarHBondContact O-N 2.84Å; E30-R33 IonicContact OE1-CZ 3.34Å; E30-R33 IonicContact OE1-NE 3.55Å; E30-R33 IonicContact OE1-NH2 2.73Å; E30-R33 PolarHBondContact OE1-NH2 3.2Å; E30-R33 IonicContact OE2-CZ 3.29Å; E30-R33 IonicContact OE2-NE 2.97Å; E30-R33 IonicContact OE2-NH2 3.88Å; E30-R33 PolarHBondContact OE2-NH2 2.84Å; E30-Q34 WeakPolarHBondContact O-CG 3.47Å; E30-Q34 PolarHBondContact O-N 2.85Å; E30-Q34 PolarHBondContact OE1-NE2 3.13Å
31	A	86.1	Confident	85.8	Confident	35 Å²	35	42.6 Å²	42.6	29%	0.289	22%	0.219	S	C	.	.	H	α-helix	trans	-60.5	-43.4	176.1	0	0	0	0	0	110.7	G28 R33 Q34 E35 Q38	G28-A31 PolarHBondContact O-N 3.39Å; A31-R33 VanDerWaalsContact C-N 3.32Å; A31-R33 PolarHBondContact O-N 2.95Å; A31-Q34 PolarHBondContact O-N 3.19Å; A31-E35 PolarHBondContact O-N 3.2Å; A31-E35 VanDerWaalsContact O-N 3.15Å; A31-Q38 HydrophobicContact CB-CB 4.44Å; A31-Q38 HydrophobicContact CB-CG 4.07Å
32	A	88.3	Confident	86.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-41.6	175.5	0	0	0	0	0	112.1	G28 E30 N36 G37 Q38 Y120 T125	G28-A32 WeakPolarHBondContact O-CB 3.48Å; G28-A32 PolarHBondContact O-N 3.43Å; E30-A32 VanDerWaalsContact C-N 3.3Å; E30-A32 PolarHBondContact O-N 2.95Å; A32-N36 CarbonylContact O-C 3.58Å; A32-N36 WeakPolarHBondContact O-CA 3.4Å; A32-N36 PolarHBondContact O-N 3.49Å; A32-N36 VanDerWaalsContact O-N 3.11Å; A32-G37 PolarHBondContact O-N 3.29Å; A32-Q38 HydrophobicContact CB-CB 4.03Å; A32-Y120 HydrophobicContact CB-CD1 3.99Å; A32-Y120 HydrophobicContact CB-CE1 4.14Å; A32-T125 HydrophobicContact CB-CG2 4.17Å
33	R	87.9	Confident	87.1	Confident	58 Å²	58	43.6 Å²	43.6	22%	0.219	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-41.2	178.3	-171.5	177.6	65	166.8	4.6	113.1	S29 E30 A31 E35 T125 S129	S29-R33 WeakPolarHBondContact O-CB 3.45Å; S29-R33 PolarHBondContact O-N 3.41Å; E30-R33 PolarHBondContact O-N 2.84Å; E30-R33 IonicContact OE1-CZ 3.34Å; E30-R33 IonicContact OE1-NE 3.55Å; E30-R33 IonicContact OE1-NH2 2.73Å; E30-R33 PolarHBondContact OE1-NH2 3.2Å; E30-R33 IonicContact OE2-CZ 3.29Å; E30-R33 IonicContact OE2-NE 2.97Å; E30-R33 IonicContact OE2-NH2 3.88Å; E30-R33 PolarHBondContact OE2-NH2 2.84Å; A31-R33 VanDerWaalsContact C-N 3.32Å; A31-R33 PolarHBondContact O-N 2.95Å; R33-E35 VanDerWaalsContact C-N 3.34Å; R33-E35 PolarHBondContact O-N 3.02Å; R33-T125 WeakPolarHBondContact CA-O 3.25Å; R33-S129 PolarHBondContact NH1-O 3.45Å
34	Q	85	Confident	87.3	Confident	139 Å²	139	43.9 Å²	43.9	65%	0.65	22%	0.223	S	C	*	.	H	α-helix	trans	-66.4	-35.8	-179.1	-71.5	178.6	10.8	0	0	112.6	E30 A31	E30-Q34 WeakPolarHBondContact O-CG 3.47Å; E30-Q34 PolarHBondContact O-N 2.85Å; E30-Q34 PolarHBondContact OE1-NE2 3.13Å; A31-Q34 PolarHBondContact O-N 3.19Å
35	E	82.7	Confident	87.3	Confident	84 Å²	84	36.8 Å²	36.8	39%	0.393	19%	0.192	S	C	.	.	H	α-helix	trans	-101.4	4.7	-174.8	-61.1	-172	166.5	0	0	114.1	A31 R33 G37 R88	A31-E35 PolarHBondContact O-N 3.2Å; A31-E35 VanDerWaalsContact O-N 3.15Å; R33-E35 VanDerWaalsContact C-N 3.34Å; R33-E35 PolarHBondContact O-N 3.02Å; E35-G37 VanDerWaalsContact C-N 3.28Å; E35-G37 PolarHBondContact O-N 3.05Å; E35-R88 PolarHBondContact O-NH1 2.86Å; E35-R88 VanDerWaalsContact O-NH1 3.15Å
36	N	85.5	Confident	87.3	Confident	68 Å²	68	38.1 Å²	38.1	36%	0.364	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	41.5	-170.6	-59.8	-57.1	0	0	0	112.9	A32 C85	A32-N36 CarbonylContact O-C 3.58Å; A32-N36 WeakPolarHBondContact O-CA 3.4Å; A32-N36 PolarHBondContact O-N 3.49Å; A32-N36 VanDerWaalsContact O-N 3.11Å; N36-C85 HydrophobicContact CB-CB 4.36Å; N36-C85 WeakPolarHBondContact OD1-CB 3.41Å
37	G	86.9	Confident	87	Confident	3 Å²	3	35.7 Å²	35.7	3%	0.031	18%	0.184	C	C	.	.	S	Bend	trans	121.4	124.3	-173.6	0	0	0	0	0	110	A32 E35 F39 Y120	A32-G37 PolarHBondContact O-N 3.29Å; E35-G37 VanDerWaalsContact C-N 3.28Å; E35-G37 PolarHBondContact O-N 3.05Å; G37-F39 PolarHBondContact O-N 3.41Å; G37-Y120 CarbonylContact C-O 3.52Å; G37-Y120 WeakPolarHBondContact CA-O 3.5Å
38	Q	88.3	Confident	86.6	Confident	33 Å²	33	37 Å²	37	15%	0.154	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.9	-178.7	180	-174.8	-0.2	0	0	108.4	L26 A31 A32 I40 L119 Y120	L26-Q38 PolarHBondContact O-NE2 2.73Å; A31-Q38 HydrophobicContact CB-CB 4.44Å; A31-Q38 HydrophobicContact CB-CG 4.07Å; A32-Q38 HydrophobicContact CB-CB 4.03Å; Q38-I40 HydrophobicContact CG-CD1 4.01Å; Q38-I40 PolarHBondContact O-N 3.15Å; Q38-L119 CarbonylContact O-C 3.57Å; Q38-L119 VanDerWaalsContact O-CA 3.27Å; Q38-L119 WeakPolarHBondContact O-CA 3.47Å; Q38-Y120 HydrophobicContact CB-CD1 4.23Å; Q38-Y120 PolarHBondContact N-O 2.99Å; Q38-Y120 PolarHBondContact O-N 3.48Å
39	F	86.6	Confident	86.1	Confident	47 Å²	47	41.1 Å²	41.1	21%	0.206	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	129.7	173.2	178.6	-99.9	0	0	0	110.3	G37 T41 K42 L119	G37-F39 PolarHBondContact O-N 3.41Å; F39-T41 VanDerWaalsContact CZ-C 3.43Å; F39-K42 HydrophobicContact CE2-CB 4.3Å; F39-K42 HydrophobicContact CZ-CB 3.96Å; F39-L119 HydrophobicContact CD2-CD1 4.4Å
40	I	87	Confident	85.7	Confident	16 Å²	16	42.4 Å²	42.4	8%	0.082	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-55.2	179.7	-56	-56.1	0	0	0	110.3	V23 F27 Q38 V118 F140 L142	V23-I40 HydrophobicContact CG1-CG2 4.11Å; F27-I40 HydrophobicContact CD1-CD1 3.68Å; F27-I40 HydrophobicContact CD1-CG1 4.43Å; F27-I40 HydrophobicContact CE1-CD1 3.5Å; F27-I40 HydrophobicContact CE1-CG1 3.83Å; Q38-I40 HydrophobicContact CG-CD1 4.01Å; Q38-I40 PolarHBondContact O-N 3.15Å; I40-V118 HydrophobicContact CB-CG1 4.48Å; I40-V118 WeakPolarHBondContact CB-O 3.4Å; I40-V118 PolarHBondContact N-O 3.48Å; I40-F140 HydrophobicContact CD1-CE1 4.26Å; I40-F140 HydrophobicContact CD1-CZ 4.03Å; I40-F140 HydrophobicContact CG2-CE2 3.65Å; I40-F140 HydrophobicContact CG2-CZ 3.66Å; I40-L142 HydrophobicContact CG2-CD2 3.86Å
41	T	85.7	Confident	85.8	Confident	17 Å²	17	39.6 Å²	39.6	10%	0.104	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	165.7	-177.5	-166.5	0	0	0	0	112	V23 F39 V118 L142 L144	V23-T41 HydrophobicContact CG2-CG2 4.3Å; F39-T41 VanDerWaalsContact CZ-C 3.43Å; T41-V118 HydrophobicContact CG2-CB 4.18Å; T41-V118 HydrophobicContact CG2-CG2 4.26Å; T41-V118 PolarHBondContact N-O 3.06Å; T41-V118 PolarHBondContact O-N 3.06Å; T41-L142 HydrophobicContact CG2-CD2 3.63Å; T41-L144 HydrophobicContact CG2-CD1 3.59Å
42	K	84.3	Confident	86.1	Confident	43 Å²	43	39.5 Å²	39.5	19%	0.187	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.9	172	178.5	176	174.1	166.5	0	108.9	F39 D75 W116 Q117 S310	F39-K42 HydrophobicContact CE2-CB 4.3Å; F39-K42 HydrophobicContact CZ-CB 3.96Å; K42-D75 VanDerWaalsContact CE-CG 3.42Å; K42-D75 VanDerWaalsContact CE-OD1 3.32Å; K42-D75 WeakPolarHBondContact CE-OD1 3.48Å; K42-D75 WeakPolarHBondContact CE-OD2 3.27Å; K42-D75 IonicContact NZ-OD1 2.7Å; K42-D75 PolarHBondContact NZ-OD1 2.77Å; K42-D75 IonicContact NZ-OD2 3.42Å; K42-D75 PolarHBondContact NZ-OD2 3.05Å; K42-W116 CarbonylContact C-O 3.53Å; K42-W116 VanDerWaalsContact CA-O 3.3Å; K42-W116 WeakPolarHBondContact CA-O 3.19Å; K42-Q117 HydrophobicContact CD-CG 4.34Å; K42-Q117 HydrophobicContact CG-CG 4.3Å; K42-S310 VanDerWaalsContact CD-OG 3.24Å; K42-S310 WeakPolarHBondContact CD-OG 3.4Å; K42-S310 PolarHBondContact NZ-O 3.11Å
43	F	86.6	Confident	86.3	Confident	3 Å²	3	39.5 Å²	39.5	1%	0.013	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.6	-178.7	-175.2	-84.7	0	0	0	111	K21 Y45 W116 L144 N146	K21-F43 HydrophobicContact CB-CD2 4.33Å; K21-F43 HydrophobicContact CB-CE2 4.33Å; K21-F43 HydrophobicContact CD-CD2 3.68Å; K21-F43 HydrophobicContact CD-CE2 3.56Å; K21-F43 HydrophobicContact CG-CD2 3.87Å; K21-F43 HydrophobicContact CG-CE2 4.11Å; F43-Y45 AromaticContact CD1-CD1 3.86Å; F43-Y45 HydrophobicContact CD1-CD1 3.86Å; F43-Y45 AromaticContact CD1-CD2 3.76Å; F43-Y45 HydrophobicContact CD1-CD2 3.76Å; F43-Y45 AromaticContact CD1-CE1 3.74Å; F43-Y45 HydrophobicContact CD1-CE1 3.74Å; F43-Y45 AromaticContact CD1-CE2 3.65Å; F43-Y45 HydrophobicContact CD1-CE2 3.65Å; F43-Y45 AromaticContact CD1-CG 3.89Å; F43-Y45 HydrophobicContact CD1-CG 3.89Å; F43-Y45 AromaticContact CD1-CZ 3.64Å; F43-Y45 AromaticContact CE1-CD1 3.52Å; F43-Y45 HydrophobicContact CE1-CD1 3.52Å; F43-Y45 HydrophobicContact CE1-CD2 4.26Å; F43-Y45 AromaticContact CE1-CE1 3.52Å; F43-Y45 HydrophobicContact CE1-CE1 3.52Å; F43-Y45 HydrophobicContact CE1-CE2 4.29Å; F43-Y45 AromaticContact CE1-CG 3.92Å; F43-Y45 HydrophobicContact CE1-CG 3.92Å; F43-Y45 AromaticContact CE1-CZ 3.94Å; F43-W116 PolarHBondContact N-O 3.49Å; F43-W116 PolarHBondContact O-N 2.8Å; F43-L144 HydrophobicContact CB-CB 4.4Å; F43-L144 HydrophobicContact CB-CD1 3.7Å; F43-L144 HydrophobicContact CB-CD2 4.21Å; F43-L144 HydrophobicContact CB-CG 4.32Å; F43-L144 HydrophobicContact CD1-CB 4.29Å; F43-L144 HydrophobicContact CD2-CB 3.43Å; F43-L144 VanDerWaalsContact CD2-CB 3.43Å; F43-L144 HydrophobicContact CD2-CD1 3.82Å; F43-L144 HydrophobicContact CD2-CG 4.17Å; F43-L144 HydrophobicContact CE1-CB 4.44Å; F43-L144 HydrophobicContact CE2-CB 3.54Å; F43-L144 HydrophobicContact CG-CB 3.82Å; F43-L144 HydrophobicContact CG-CD1 4Å; F43-L144 HydrophobicContact CG-CD2 4.37Å; F43-L144 HydrophobicContact CG-CG 4.28Å; F43-L144 HydrophobicContact CZ-CB 4.09Å; F43-N146 VanDerWaalsContact CE1-ND2 3.34Å; F43-N146 WeakPolarHBondContact CE1-ND2 3.39Å; F43-N146 HydrophobicContact CZ-CB 4.5Å; F43-N146 WeakPolarHBondContact CZ-ND2 3.38Å
44	M	86.9	Confident	86.6	Confident	15 Å²	15	37.1 Å²	37.1	7%	0.074	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	114.1	176.4	-165.3	179.2	-70.6	0	0	111.9	P113 A115 N146 S158 A159 E160 H380	M44-P113 HydrophobicContact CG-CB 4.4Å; M44-P113 HydrophobicContact SD-CB 4.11Å; M44-A115 HydrophobicContact CB-CB 4.45Å; M44-A115 HydrophobicContact CE-CB 3.95Å; M44-A115 HydrophobicContact CG-CB 4.41Å; M44-N146 PolarHBondContact O-ND2 2.95Å; M44-S158 WeakPolarHBondContact O-CA 3.27Å; M44-A159 HydrophobicContact CB-CB 4.33Å; M44-A159 HydrophobicContact CG-CB 3.92Å; M44-A159 PolarHBondContact O-N 3.11Å; M44-A159 HydrophobicContact SD-CB 3.97Å; M44-E160 HydrophobicContact CB-CG 4.38Å; M44-E160 HydrophobicContact CE-CG 3.82Å; M44-E160 WeakPolarHBondContact CE-OE1 3.33Å; M44-E160 HydrophobicContact SD-CG 3.71Å; M44-H380 HydrophobicContact CE-CB 3.71Å; M44-H380 HydrophobicContact SD-CB 3.17Å; M44-H380 WeakPolarHBondContact SD-CB 2.99Å
45	Y	89.2	Confident	87	Confident	3 Å²	3	30.5 Å²	30.5	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	143.9	174.6	-69.7	-81.4	0	0	0	111	F43 L52 I107 P113 T114 W116 L144 F145 N146	F43-Y45 AromaticContact CD1-CD1 3.86Å; F43-Y45 HydrophobicContact CD1-CD1 3.86Å; F43-Y45 AromaticContact CD1-CD2 3.76Å; F43-Y45 HydrophobicContact CD1-CD2 3.76Å; F43-Y45 AromaticContact CD1-CE1 3.74Å; F43-Y45 HydrophobicContact CD1-CE1 3.74Å; F43-Y45 AromaticContact CD1-CE2 3.65Å; F43-Y45 HydrophobicContact CD1-CE2 3.65Å; F43-Y45 AromaticContact CD1-CG 3.89Å; F43-Y45 HydrophobicContact CD1-CG 3.89Å; F43-Y45 AromaticContact CD1-CZ 3.64Å; F43-Y45 AromaticContact CE1-CD1 3.52Å; F43-Y45 HydrophobicContact CE1-CD1 3.52Å; F43-Y45 HydrophobicContact CE1-CD2 4.26Å; F43-Y45 AromaticContact CE1-CE1 3.52Å; F43-Y45 HydrophobicContact CE1-CE1 3.52Å; F43-Y45 HydrophobicContact CE1-CE2 4.29Å; F43-Y45 AromaticContact CE1-CG 3.92Å; F43-Y45 HydrophobicContact CE1-CG 3.92Å; F43-Y45 AromaticContact CE1-CZ 3.94Å; Y45-L52 PolarHBondContact OH-O 3.08Å; Y45-I107 HydrophobicContact CD1-CB 4.49Å; Y45-I107 HydrophobicContact CD1-CG1 3.88Å; Y45-I107 HydrophobicContact CD2-CD1 4.47Å; Y45-I107 HydrophobicContact CD2-CG1 4.01Å; Y45-I107 HydrophobicContact CD2-CG2 4.26Å; Y45-I107 HydrophobicContact CE1-CD1 4.44Å; Y45-I107 HydrophobicContact CE1-CG1 3.59Å; Y45-I107 HydrophobicContact CE2-CD1 3.88Å; Y45-I107 HydrophobicContact CE2-CG1 3.73Å; Y45-I107 HydrophobicContact CG-CG1 4.08Å; Y45-I107 HydrophobicContact CG-CG2 4.24Å; Y45-I107 VanDerWaalsContact CZ-CG1 3.5Å; Y45-P113 VanDerWaalsContact O-CA 3.23Å; Y45-P113 WeakPolarHBondContact O-CA 3.3Å; Y45-T114 PolarHBondContact N-O 3.15Å; Y45-T114 PolarHBondContact O-N 3.25Å; Y45-T114 VanDerWaalsContact O-N 3.13Å; Y45-W116 HydrophobicContact CD2-CB 4.27Å; Y45-W116 AromaticContact CD2-CD1 3.47Å; Y45-W116 VanDerWaalsContact CD2-CD1 3.47Å; Y45-W116 AromaticContact CD2-CG 3.97Å; Y45-W116 HydrophobicContact CD2-CG 3.97Å; Y45-W116 HydrophobicContact CE2-CB 4.21Å; Y45-W116 HydrophobicContact CE2-CG 4.23Å; Y45-L144 WeakPolarHBondContact OH-CD2 3.01Å; Y45-F145 WeakPolarHBondContact CE1-O 3.18Å; Y45-N146 VanDerWaalsContact CA-OD1 3.27Å; Y45-N146 WeakPolarHBondContact CA-OD1 2.97Å; Y45-N146 WeakPolarHBondContact CD1-OD1 3.5Å
46	Q	87.1	Confident	87.6	Confident	61 Å²	61	31.4 Å²	31.4	29%	0.285	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-69.3	159.8	176.9	-66.9	-178.9	20.1	0	0	111.6	N146 A159	Q46-N146 HydrophobicContact CG-CB 4.29Å; Q46-N146 PolarHBondContact N-OD1 3.04Å; Q46-A159 HydrophobicContact CG-CB 3.9Å
47	A	84.8	Confident	87.9	Confident	49 Å²	49	28.5 Å²	28.5	41%	0.405	16%	0.16	S	C	.	.	S	Bend	trans	-67	146	173	0	0	0	0	0	110.9	P113	A47-P113 HydrophobicContact CB-CG 4.28Å
48	G	83.1	Confident	88.2	Confident	26 Å²	26	34.5 Å²	34.5	27%	0.268	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	99.8	-154	-177.1	0	0	0	0	0	112.9	R109 Q110	G48-R109 WeakPolarHBondContact O-CA 3.46Å; G48-Q110 PolarHBondContact N-O 3.42Å; G48-Q110 PolarHBondContact O-N 3.01Å
49	D	78.9	Confident	88.3	Confident	95 Å²	95	36.3 Å²	36.3	51%	0.508	20%	0.202	S	C	.	.	S	Bend	trans	-103.8	160	-177.7	-64.5	-50	0	0	0	110.2	R109	D49-R109 WeakPolarHBondContact OD1-CA 3.41Å; D49-R109 WeakPolarHBondContact OD1-CB 3.12Å; D49-R109 WeakPolarHBondContact OD1-CG 3.36Å; D49-R109 WeakPolarHBondContact OD2-CD 3.24Å; D49-R109 IonicContact OD2-CZ 3.92Å; D49-R109 IonicContact OD2-NE 3.35Å; D49-R109 IonicContact OD2-NH1 3.99Å; D49-R109 PolarHBondContact OD2-NH1 3.39Å
50	G	81.1	Confident	88.4	Confident	29 Å²	29	36.1 Å²	36.1	30%	0.299	21%	0.205	S	C	.	.			trans	102.7	14.1	170.2	0	0	0	0	0	116.1	P153	G50-P153 WeakPolarHBondContact O-CB 3.38Å
51	G	89.4	Confident	88.6	Confident	8 Å²	8	39.1 Å²	39.1	8%	0.082	23%	0.228	C	C	.	.			trans	-73.3	137.5	163.2	0	0	0	0	0	110.9	I107 F145	G51-I107 PolarHBondContact O-N 3.15Å; G51-F145 WeakPolarHBondContact CA-O 3.32Å
52	L	92.6	Very high	88.8	Confident	32 Å²	32	39.4 Å²	39.4	17%	0.168	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.5	178.3	-177.2	70.7	0	0	0	110.5	Y45 V54 N104 T106 F145 P153	Y45-L52 PolarHBondContact OH-O 3.08Å; L52-V54 HydrophobicContact CD1-CG2 4.48Å; L52-V54 HydrophobicContact CD2-CG2 3.73Å; L52-V54 HydrophobicContact CG-CG2 3.84Å; L52-N104 HydrophobicContact CD1-CB 4.45Å; L52-T106 HydrophobicContact CD1-CG2 3.93Å; L52-F145 HydrophobicContact CB-CB 4.28Å; L52-F145 HydrophobicContact CB-CD2 4.43Å; L52-F145 HydrophobicContact CD2-CD2 4.23Å; L52-F145 HydrophobicContact CG-CD2 4.47Å; L52-F145 PolarHBondContact N-O 2.99Å; L52-F145 PolarHBondContact O-N 2.92Å; L52-P153 HydrophobicContact CB-CB 3.76Å; L52-P153 HydrophobicContact CB-CG 4.45Å; L52-P153 HydrophobicContact CD2-CB 4.23Å; L52-P153 HydrophobicContact CD2-CG 4.2Å
53	L	93.1	Very high	89	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.6	167.9	-178.1	152.9	0	0	0	108	C55 M72 I96 N104 Q105 V118 L142 L144	L53-C55 HydrophobicContact CD2-CB 4.39Å; L53-M72 HydrophobicContact CD1-CE 3.66Å; L53-M72 HydrophobicContact CD1-SD 3.84Å; L53-I96 HydrophobicContact CD2-CD1 4Å; L53-N104 WeakPolarHBondContact O-CA 3.4Å; L53-Q105 HydrophobicContact CB-CB 4.39Å; L53-Q105 HydrophobicContact CD2-CB 4.5Å; L53-Q105 PolarHBondContact N-O 3.48Å; L53-Q105 PolarHBondContact O-N 2.94Å; L53-V118 HydrophobicContact CD1-CG2 3.99Å; L53-L142 HydrophobicContact CD1-CD1 4.16Å; L53-L142 HydrophobicContact CD2-CD1 3.68Å; L53-L142 HydrophobicContact CG-CD1 3.82Å; L53-L144 HydrophobicContact CB-CD2 4.3Å; L53-L144 HydrophobicContact CD1-CD2 3.7Å; L53-L144 HydrophobicContact CG-CD2 3.93Å
54	V	93.5	Very high	89.2	Confident	8 Å²	8	41 Å²	41	5%	0.048	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.3	175.7	175.6	0	0	0	0	108.3	L52 R56 E102 H103 N104 L143 F145	L52-V54 HydrophobicContact CD1-CG2 4.48Å; L52-V54 HydrophobicContact CD2-CG2 3.73Å; L52-V54 HydrophobicContact CG-CG2 3.84Å; V54-R56 HydrophobicContact CG1-CG 4.35Å; V54-E102 HydrophobicContact CG1-CG 3.83Å; V54-H103 CarbonylContact C-O 3.59Å; V54-H103 WeakPolarHBondContact CA-O 3.49Å; V54-N104 WeakPolarHBondContact CG1-OD1 3.38Å; V54-N104 WeakPolarHBondContact CG2-OD1 3.45Å; V54-L143 HydrophobicContact CB-CB 4.18Å; V54-L143 HydrophobicContact CB-CD1 4.35Å; V54-L143 HydrophobicContact CG1-CD1 4.19Å; V54-L143 PolarHBondContact N-O 2.64Å; V54-L143 PolarHBondContact O-N 3.08Å; V54-F145 HydrophobicContact CB-CE2 4.45Å; V54-F145 HydrophobicContact CG2-CD2 4.42Å; V54-F145 HydrophobicContact CG2-CE2 4.08Å
55	C	93.9	Very high	89.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.2	173.6	-176.4	0	0	0	0	109.4	L53 L70 L98 E102 H103 L142	L53-C55 HydrophobicContact CD2-CB 4.39Å; C55-L70 HydrophobicContact CB-CD1 3.87Å; C55-L98 HydrophobicContact CB-CD2 4.31Å; C55-E102 CarbonylContact O-C 3.56Å; C55-E102 WeakPolarHBondContact O-CA 3.27Å; C55-H103 PolarHBondContact N-O 2.86Å; C55-H103 PolarHBondContact O-N 3.07Å; C55-L142 HydrophobicContact CB-CD1 3.91Å
56	R	94.4	Very high	89.4	Confident	103 Å²	103	46.6 Å²	46.6	39%	0.389	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.7	172.1	-66.8	178.5	179	142.6	7	110.7	V54 E101 E102 F140 N141	V54-R56 HydrophobicContact CG1-CG 4.35Å; R56-E101 CarbonylContact C-O 3.37Å; R56-E101 VanDerWaalsContact CA-O 3.22Å; R56-E101 WeakPolarHBondContact CA-O 3.27Å; R56-E102 HydrophobicContact CG-CB 4.32Å; R56-E102 HydrophobicContact CG-CG 4.04Å; R56-E102 IonicContact CZ-OE2 2.75Å; R56-E102 VanDerWaalsContact CZ-OE2 3.29Å; R56-E102 IonicContact NE-OE2 2.69Å; R56-E102 PolarHBondContact NE-OE2 3.3Å; R56-E102 IonicContact NH2-OE2 3.29Å; R56-E102 PolarHBondContact NH2-OE2 2.88Å; R56-F140 CarbonylContact O-C 3.58Å; R56-F140 VanDerWaalsContact O-CA 3.31Å; R56-F140 WeakPolarHBondContact O-CA 3.4Å; R56-N141 HydrophobicContact CB-CB 4.31Å; R56-N141 PolarHBondContact N-O 2.78Å; R56-N141 PolarHBondContact O-N 2.84Å
57	L	93.2	Very high	89.7	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.4	-179.1	-61.9	174.8	0	0	0	110.6	F27 N59 L98 Q100 E101 L138 F140	F27-L57 HydrophobicContact CD2-CD2 4.37Å; F27-L57 HydrophobicContact CE2-CD2 3.9Å; L57-N59 VanDerWaalsContact C-N 3.35Å; L57-L98 HydrophobicContact CD1-CB 3.63Å; L57-L98 HydrophobicContact CD1-CD2 4.15Å; L57-L98 HydrophobicContact CD1-CG 4.38Å; L57-L98 HydrophobicContact CD2-CB 4.47Å; L57-L98 HydrophobicContact CD2-CD1 4.16Å; L57-L98 HydrophobicContact CD2-CD2 4.2Å; L57-L98 HydrophobicContact CG-CD2 4.41Å; L57-Q100 VanDerWaalsContact CD1-O 3.3Å; L57-Q100 WeakPolarHBondContact CD1-O 3.49Å; L57-E101 PolarHBondContact N-O 3.17Å; L57-L138 HydrophobicContact CD2-CD2 4.05Å; L57-L138 HydrophobicContact CD2-CG 4.27Å; L57-F140 HydrophobicContact CD2-CB 4.23Å
58	D	91.9	Very high	90	Very high	130 Å²	130	46.5 Å²	46.5	70%	0.695	26%	0.26	S	S	*	.	S	Bend	trans	-73.9	-30.6	175.4	-65.4	-23.4	0	0	0	111.7	G139	D58-G139 PolarHBondContact N-O 2.73Å; D58-G139 WeakPolarHBondContact OD2-CA 3.22Å
59	N	90.4	Very high	90.6	Very high	71 Å²	71	49.5 Å²	49.5	38%	0.38	26%	0.263	S	S	.	.			trans	-140.2	87.5	-178.2	-167.5	-5.2	0	0	0	112.8	L57 S61 L62 G63 L138	L57-N59 VanDerWaalsContact C-N 3.35Å; N59-S61 VanDerWaalsContact C-N 3.27Å; N59-S61 PolarHBondContact O-N 2.97Å; N59-S61 PolarHBondContact OD1-N 3.25Å; N59-S61 PolarHBondContact OD1-OG 3.16Å; N59-L62 HydrophobicContact CB-CB 4.23Å; N59-L62 PolarHBondContact O-N 3.35Å; N59-G63 PolarHBondContact O-N 3.31Å; N59-L138 HydrophobicContact CB-CD1 4.1Å; N59-L138 WeakPolarHBondContact O-CD1 3.42Å
60	P	90.1	Very high	91.3	Very high	42 Å²	42	45 Å²	45	27%	0.273	24%	0.239	S	C	.	.	H	α-helix	trans	-68.2	-22.8	-175.7	26.8	-34.6	0	0	0	113.9	G63 T64	P60-G63 PolarHBondContact O-N 2.88Å; P60-T64 PolarHBondContact O-N 3.28Å; P60-T64 PolarHBondContact O-OG1 2.64Å
61	S	90.6	Very high	91.8	Very high	80 Å²	80	43.9 Å²	43.9	56%	0.559	23%	0.226	S	C	*	.	H	α-helix	trans	-69.6	-40.6	176.8	65.6	0	0	0	0	111.2	N59 G63 T64 E65	N59-S61 VanDerWaalsContact C-N 3.27Å; N59-S61 PolarHBondContact O-N 2.97Å; N59-S61 PolarHBondContact OD1-N 3.25Å; N59-S61 PolarHBondContact OD1-OG 3.16Å; S61-G63 VanDerWaalsContact C-N 3.34Å; S61-T64 WeakPolarHBondContact O-CB 3.32Å; S61-T64 PolarHBondContact O-N 2.81Å; S61-E65 PolarHBondContact O-N 2.75Å
62	L	89.6	Confident	91.9	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.12	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-38.5	172.9	-176.3	65.2	0	0	0	111.5	N59 T64 E65 K66 A136 L138	N59-L62 HydrophobicContact CB-CB 4.23Å; N59-L62 PolarHBondContact O-N 3.35Å; L62-T64 VanDerWaalsContact C-N 3.29Å; L62-T64 PolarHBondContact O-N 2.96Å; L62-E65 PolarHBondContact O-N 2.94Å; L62-K66 HydrophobicContact CD1-CG 4.44Å; L62-K66 HydrophobicContact CG-CD 4.48Å; L62-K66 WeakPolarHBondContact O-CB 3.16Å; L62-K66 WeakPolarHBondContact O-CG 3.18Å; L62-K66 PolarHBondContact O-N 2.74Å; L62-A136 HydrophobicContact CD2-CB 4.16Å; L62-L138 HydrophobicContact CB-CD1 4.42Å; L62-L138 HydrophobicContact CD2-CB 4.26Å; L62-L138 HydrophobicContact CD2-CD1 4.37Å
63	G	88.6	Confident	91.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.1	-40.6	172.4	0	0	0	0	0	112.7	N59 P60 S61 E67 A68 L98	N59-G63 PolarHBondContact O-N 3.31Å; P60-G63 PolarHBondContact O-N 2.88Å; S61-G63 VanDerWaalsContact C-N 3.34Å; G63-E67 PolarHBondContact O-N 2.86Å; G63-A68 WeakPolarHBondContact O-CB 3.41Å; G63-A68 PolarHBondContact O-N 2.87Å; G63-L98 CarbonylContact C-O 3.55Å; G63-L98 WeakPolarHBondContact CA-O 3.34Å
64	T	91.3	Very high	91.4	Very high	78 Å²	78	44 Å²	44	48%	0.479	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-43.5	176.7	-54.2	0	0	0	0	112.1	P60 S61 L62 K66 E67	P60-T64 PolarHBondContact O-N 3.28Å; P60-T64 PolarHBondContact O-OG1 2.64Å; S61-T64 WeakPolarHBondContact O-CB 3.32Å; S61-T64 PolarHBondContact O-N 2.81Å; L62-T64 VanDerWaalsContact C-N 3.29Å; L62-T64 PolarHBondContact O-N 2.96Å; T64-K66 VanDerWaalsContact C-N 3.3Å; T64-K66 PolarHBondContact O-N 3.19Å; T64-E67 PolarHBondContact O-N 2.79Å; T64-E67 VanDerWaalsContact O-N 3.13Å
65	E	90.3	Very high	90.2	Very high	130 Å²	130	45.4 Å²	45.4	61%	0.607	23%	0.231	S	C	*	.	H	α-helix	trans	-60.5	-39.8	177.9	-175.5	-175.9	168.8	0	0	112.4	S61 L62 E67	S61-E65 PolarHBondContact O-N 2.75Å; L62-E65 PolarHBondContact O-N 2.94Å; E65-E67 VanDerWaalsContact C-N 3.29Å; E65-E67 PolarHBondContact O-N 2.87Å
66	K	89.4	Confident	88.3	Confident	6 Å²	6	53 Å²	53	3%	0.026	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.1	178	-68.4	-169.6	173.4	-163	0	113.9	S29 L62 T64 A68 D122 R123 Y124 A136	S29-K66 PolarHBondContact OG-NZ 3.27Å; L62-K66 HydrophobicContact CD1-CG 4.44Å; L62-K66 HydrophobicContact CG-CD 4.48Å; L62-K66 WeakPolarHBondContact O-CB 3.16Å; L62-K66 WeakPolarHBondContact O-CG 3.18Å; L62-K66 PolarHBondContact O-N 2.74Å; T64-K66 VanDerWaalsContact C-N 3.3Å; T64-K66 PolarHBondContact O-N 3.19Å; K66-A68 HydrophobicContact CB-CB 4.44Å; K66-A68 PolarHBondContact O-N 2.94Å; K66-D122 HydrophobicContact CB-CB 4.23Å; K66-D122 WeakPolarHBondContact O-CB 3.33Å; K66-R123 WeakPolarHBondContact O-CG 3.49Å; K66-R123 PolarHBondContact O-N 2.82Å; K66-Y124 HydrophobicContact CG-CE2 4.31Å; K66-A136 WeakPolarHBondContact CE-O 3.42Å; K66-A136 PolarHBondContact NZ-O 2.86Å
67	E	92.4	Very high	86.7	Confident	106 Å²	106	50 Å²	50	50%	0.495	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	43.3	-166	-56.8	-177.2	179.5	0	0	111.9	G63 T64 E65 R69 R123	G63-E67 PolarHBondContact O-N 2.86Å; T64-E67 PolarHBondContact O-N 2.79Å; T64-E67 VanDerWaalsContact O-N 3.13Å; E65-E67 VanDerWaalsContact C-N 3.29Å; E65-E67 PolarHBondContact O-N 2.87Å; E67-R69 PolarHBondContact O-NE 2.95Å; E67-R69 IonicContact OE2-NH2 3.41Å; E67-R69 PolarHBondContact OE2-NH2 3.43Å; E67-R123 HydrophobicContact CB-CB 4.4Å
68	A	92.5	Very high	85	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.017	29%	0.292	C	S	.	.			trans	-60.1	136	-176.8	0	0	0	0	0	111.1	G63 K66 L98 Y120 L138	G63-A68 WeakPolarHBondContact O-CB 3.41Å; G63-A68 PolarHBondContact O-N 2.87Å; K66-A68 HydrophobicContact CB-CB 4.44Å; K66-A68 PolarHBondContact O-N 2.94Å; A68-L98 HydrophobicContact CB-CB 3.8Å; A68-L98 HydrophobicContact CB-CD1 4.05Å; A68-L98 HydrophobicContact CB-CG 4.47Å; A68-L98 WeakPolarHBondContact O-CB 3.23Å; A68-L98 PolarHBondContact O-N 3.42Å; A68-Y120 HydrophobicContact CB-CE2 3.82Å; A68-L138 HydrophobicContact CB-CD2 4.23Å
69	R	94.4	Very high	83.6	Confident	90 Å²	90	52.3 Å²	52.3	34%	0.34	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	138.7	-175.1	-73.3	173.1	-107.6	-175.3	-8.2	110.6	E67 L71 T95 I96 A121	E67-R69 PolarHBondContact O-NE 2.95Å; E67-R69 IonicContact OE2-NH2 3.41Å; E67-R69 PolarHBondContact OE2-NH2 3.43Å; R69-L71 HydrophobicContact CB-CD2 4.5Å; R69-T95 HydrophobicContact CB-CG2 4.18Å; R69-T95 HydrophobicContact CG-CG2 4Å; R69-I96 CarbonylContact C-O 3.52Å; R69-I96 VanDerWaalsContact CA-O 3.23Å; R69-I96 WeakPolarHBondContact CA-O 3.28Å; R69-A121 PolarHBondContact N-O 2.8Å; R69-A121 PolarHBondContact O-N 3.07Å; R69-A121 VanDerWaalsContact O-O 3.06Å
70	L	94.1	Very high	82.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.7	162.2	-68.2	175.3	0	0	0	109.3	F27 C55 T95 I96 L98 V118 L119 L142	F27-L70 HydrophobicContact CE1-CD2 3.95Å; F27-L70 HydrophobicContact CZ-CD2 3.69Å; F27-L70 HydrophobicContact CZ-CG 4.47Å; C55-L70 HydrophobicContact CB-CD1 3.87Å; L70-T95 WeakPolarHBondContact O-CA 3.43Å; L70-I96 HydrophobicContact CB-CB 4.15Å; L70-I96 PolarHBondContact N-O 2.84Å; L70-I96 PolarHBondContact O-N 2.77Å; L70-L98 HydrophobicContact CD1-CD2 3.96Å; L70-L98 HydrophobicContact CD2-CD1 4.37Å; L70-L98 HydrophobicContact CG-CD1 3.92Å; L70-L98 HydrophobicContact CG-CD2 4.04Å; L70-L98 HydrophobicContact CG-CG 4.18Å; L70-V118 HydrophobicContact CB-CG1 4.41Å; L70-V118 HydrophobicContact CD1-CG1 4.49Å; L70-V118 HydrophobicContact CD2-CG1 4.01Å; L70-L119 CarbonylContact C-O 3.55Å; L70-L119 WeakPolarHBondContact CA-O 3.23Å; L70-L142 HydrophobicContact CD1-CD1 4.22Å
71	L	92.8	Very high	81.5	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.2	-179.8	-57.8	178	0	0	0	108.2	R69 Y73 L89 A92 F94 T95 V118 L119 A121	R69-L71 HydrophobicContact CB-CD2 4.5Å; L71-Y73 HydrophobicContact CB-CE2 3.64Å; L71-L89 HydrophobicContact CD1-CB 4.01Å; L71-L89 HydrophobicContact CD1-CD2 4.07Å; L71-L89 HydrophobicContact CD1-CG 3.63Å; L71-A92 HydrophobicContact CB-CB 3.9Å; L71-A92 HydrophobicContact CD2-CB 3.89Å; L71-A92 HydrophobicContact CG-CB 4.37Å; L71-F94 WeakPolarHBondContact CA-O 3.07Å; L71-T95 HydrophobicContact CD2-CG2 3.77Å; L71-T95 WeakPolarHBondContact CD2-OG1 3.47Å; L71-V118 WeakPolarHBondContact O-CA 3.31Å; L71-L119 HydrophobicContact CB-CB 4.5Å; L71-L119 PolarHBondContact N-O 2.93Å; L71-L119 PolarHBondContact O-N 2.92Å; L71-A121 HydrophobicContact CD1-CB 3.73Å; L71-A121 HydrophobicContact CG-CB 4.34Å
72	M	91.3	Very high	80.8	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.1	177.6	-52.3	-177.3	67.2	0	0	110.6	L53 Q93 F94 I96 I107 W116 Q117 V118	L53-M72 HydrophobicContact CD1-CE 3.66Å; L53-M72 HydrophobicContact CD1-SD 3.84Å; M72-Q93 PolarHBondContact O-N 3.19Å; M72-F94 HydrophobicContact CB-CB 4.12Å; M72-F94 HydrophobicContact CG-CB 4.32Å; M72-F94 PolarHBondContact N-O 2.88Å; M72-F94 PolarHBondContact O-N 3.14Å; M72-F94 HydrophobicContact SD-CB 4.3Å; M72-I96 HydrophobicContact SD-CD1 4.01Å; M72-I107 HydrophobicContact CE-CD1 3.72Å; M72-I107 HydrophobicContact SD-CD1 4.41Å; M72-W116 HydrophobicContact CB-CE3 3.84Å; M72-W116 HydrophobicContact CB-CZ3 4.11Å; M72-W116 HydrophobicContact CE-CB 4.29Å; M72-W116 HydrophobicContact CE-CD2 4.35Å; M72-W116 HydrophobicContact CE-CE3 4.09Å; M72-W116 HydrophobicContact CE-CG 4.5Å; M72-Q117 WeakPolarHBondContact CA-O 3.48Å; M72-V118 HydrophobicContact CE-CG2 4.27Å; M72-V118 HydrophobicContact CG-CG2 4.43Å
73	Y	88	Confident	80.4	Confident	3 Å²	3	57.9 Å²	57.9	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.8	176.6	-56.7	-95.4	0	0	0	109.1	L71 L80 R88 A92 W116 Q117 L119	L71-Y73 HydrophobicContact CB-CE2 3.64Å; Y73-L80 HydrophobicContact CD1-CD1 3.75Å; Y73-L80 HydrophobicContact CD1-CD2 3.87Å; Y73-L80 HydrophobicContact CD1-CG 4.47Å; Y73-L80 HydrophobicContact CD2-CD2 4.36Å; Y73-L80 HydrophobicContact CE1-CD1 3.87Å; Y73-L80 HydrophobicContact CE1-CD2 3.92Å; Y73-L80 HydrophobicContact CE1-CG 4.42Å; Y73-L80 HydrophobicContact CE2-CD2 4.42Å; Y73-L80 HydrophobicContact CG-CD2 4.08Å; Y73-R88 WeakPolarHBondContact CE1-O 3.41Å; Y73-R88 PolarHBondContact OH-O 2.99Å; Y73-A92 HydrophobicContact CD1-CB 4.45Å; Y73-A92 VanDerWaalsContact CE1-CA 3.41Å; Y73-A92 HydrophobicContact CE1-CB 3.82Å; Y73-A92 HydrophobicContact CE2-CB 4.25Å; Y73-W116 CarbonylContact O-C 3.58Å; Y73-W116 VanDerWaalsContact O-CA 3.27Å; Y73-W116 WeakPolarHBondContact O-CA 3.45Å; Y73-Q117 PolarHBondContact N-O 3.36Å; Y73-Q117 PolarHBondContact O-N 3.06Å; Y73-L119 HydrophobicContact CD2-CD1 3.93Å; Y73-L119 HydrophobicContact CE2-CB 4.36Å; Y73-L119 HydrophobicContact CE2-CD1 4.14Å; Y73-L119 HydrophobicContact CE2-CD2 4.23Å; Y73-L119 HydrophobicContact CE2-CG 4.48Å
74	Q	86.3	Confident	80.3	Confident	39 Å²	39	60.4 Å²	60.4	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.4	164.9	-73.6	174.1	-3	0	0	108.3	M76 D77 Q93 T114 W116	Q74-M76 PolarHBondContact O-N 3.44Å; Q74-D77 PolarHBondContact O-N 3.36Å; Q74-Q93 VanDerWaalsContact CD-NE2 3.25Å; Q74-T114 HydrophobicContact CB-CG2 4.28Å; Q74-T114 HydrophobicContact CG-CG2 3.89Å; Q74-W116 HydrophobicContact CG-CD2 3.9Å; Q74-W116 HydrophobicContact CG-CE3 3.93Å; Q74-W116 HydrophobicContact CG-CH2 3.71Å; Q74-W116 HydrophobicContact CG-CZ2 3.69Å; Q74-W116 HydrophobicContact CG-CZ3 3.83Å; Q74-W116 VanDerWaalsContact NE2-CH2 3.35Å
75	D	67.8	Low	80.1	Confident	39 Å²	39	57.6 Å²	57.6	21%	0.209	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-8.5	-173.7	-164.1	50.1	0	0	0	115	K42 D77 A115 Q117	K42-D75 VanDerWaalsContact CE-CG 3.42Å; K42-D75 VanDerWaalsContact CE-OD1 3.32Å; K42-D75 WeakPolarHBondContact CE-OD1 3.48Å; K42-D75 WeakPolarHBondContact CE-OD2 3.27Å; K42-D75 IonicContact NZ-OD1 2.7Å; K42-D75 PolarHBondContact NZ-OD1 2.77Å; K42-D75 IonicContact NZ-OD2 3.42Å; K42-D75 PolarHBondContact NZ-OD2 3.05Å; D75-D77 VanDerWaalsContact C-N 3.34Å; D75-A115 HydrophobicContact CB-CB 3.65Å; D75-A115 WeakPolarHBondContact CB-O 3.38Å; D75-A115 PolarHBondContact N-O 3.29Å; D75-Q117 PolarHBondContact OD1-NE2 2.9Å
76	M	55.7	Low	80	Confident	161 Å²	161	55.2 Å²	55.2	79%	0.793	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-8.2	178	-64	-60.4	-60.5	0	0	114.4	Q74 S78	Q74-M76 PolarHBondContact O-N 3.44Å; M76-S78 VanDerWaalsContact C-N 3.29Å; M76-S78 PolarHBondContact O-N 3.2Å
77	D	59.6	Low	79.9	Confident	39 Å²	39	59.9 Å²	59.9	21%	0.209	32%	0.322	C	S	.	.			trans	-81.7	69.1	177.4	-84.9	-52.9	0	0	0	111.3	Q74 D75 D79 L80 R91	Q74-D77 PolarHBondContact O-N 3.36Å; D75-D77 VanDerWaalsContact C-N 3.34Å; D77-D79 PolarHBondContact O-N 3.38Å; D77-L80 HydrophobicContact CB-CD1 3.92Å; D77-L80 WeakPolarHBondContact O-CB 3.49Å; D77-L80 PolarHBondContact O-N 3.37Å; D77-R91 IonicContact OD1-CZ 3.59Å; D77-R91 IonicContact OD1-NE 3.92Å; D77-R91 PolarHBondContact OD1-NE 2.96Å; D77-R91 IonicContact OD1-NH2 2.95Å; D77-R91 PolarHBondContact OD1-NH2 2.81Å
78	S	57.8	Low	79.6	Confident	101 Å²	101	56.4 Å²	56.4	71%	0.706	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-4.7	174.5	54.3	0	0	0	0	114.6	M76	M76-S78 VanDerWaalsContact C-N 3.29Å; M76-S78 PolarHBondContact O-N 3.2Å
79	D	62.3	Low	79.4	Confident	84 Å²	84	57.8 Å²	57.8	45%	0.449	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.4	178.2	-62.6	-30	0	0	0	112.9	D77 D81 N82 R91	D77-D79 PolarHBondContact O-N 3.38Å; D79-D81 VanDerWaalsContact C-N 3.29Å; D79-D81 PolarHBondContact O-N 2.99Å; D79-N82 PolarHBondContact O-N 3.45Å; D79-R91 IonicContact OD2-NH2 3.76Å
80	L	67.4	Low	79.1	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.047	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-64.2	-33.1	-171.8	-133.1	76.2	0	0	0	113.4	Y73 D77 N82 L83 R88	Y73-L80 HydrophobicContact CD1-CD1 3.75Å; Y73-L80 HydrophobicContact CD1-CD2 3.87Å; Y73-L80 HydrophobicContact CD1-CG 4.47Å; Y73-L80 HydrophobicContact CD2-CD2 4.36Å; Y73-L80 HydrophobicContact CE1-CD1 3.87Å; Y73-L80 HydrophobicContact CE1-CD2 3.92Å; Y73-L80 HydrophobicContact CE1-CG 4.42Å; Y73-L80 HydrophobicContact CE2-CD2 4.42Å; Y73-L80 HydrophobicContact CG-CD2 4.08Å; D77-L80 HydrophobicContact CB-CD1 3.92Å; D77-L80 WeakPolarHBondContact O-CB 3.49Å; D77-L80 PolarHBondContact O-N 3.37Å; L80-N82 VanDerWaalsContact C-N 3.3Å; L80-N82 PolarHBondContact O-N 3.34Å; L80-L83 HydrophobicContact CD1-CD1 4.36Å; L80-L83 PolarHBondContact O-N 2.86Å; L80-R88 HydrophobicContact CD2-CG 4.08Å; L80-R88 HydrophobicContact CG-CG 3.95Å
81	D	68.2	Low	78.8	Confident	132 Å²	132	62.9 Å²	62.9	71%	0.706	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-75.6	-18	-175.4	-61.7	-29.8	0	0	0	113.4	D79	D79-D81 VanDerWaalsContact C-N 3.29Å; D79-D81 PolarHBondContact O-N 2.99Å
82	N	75.9	Confident	78.6	Confident	149 Å²	149	63.4 Å²	63.4	80%	0.797	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-94.8	-3	180	-72	-33	0	0	0	113.4	D79 L80	D79-N82 PolarHBondContact O-N 3.45Å; L80-N82 VanDerWaalsContact C-N 3.3Å; L80-N82 PolarHBondContact O-N 3.34Å
83	L	81.1	Confident	78.5	Confident	42 Å²	42	67.1 Å²	67.1	22%	0.22	37%	0.368	C	S	.	.	S	Bend	trans	-87.4	151.1	-177.6	-67.7	165.8	0	0	0	111.1	L80 Q87 R88	L80-L83 HydrophobicContact CD1-CD1 4.36Å; L80-L83 PolarHBondContact O-N 2.86Å; L83-Q87 HydrophobicContact CB-CB 4.13Å; L83-Q87 HydrophobicContact CD2-CB 4.17Å; L83-R88 HydrophobicContact CB-CB 4.26Å
84	S	86.7	Confident	78.6	Confident	53 Å²	53	69.7 Å²	69.7	37%	0.371	38%	0.379	S	S	.	.			trans	-64.5	156	166.9	71.8	0	0	0	0	110.3	S86 Q87 R88	S84-S86 VanDerWaalsContact C-N 3.34Å; S84-S86 PolarHBondContact O-N 2.94Å; S84-Q87 WeakPolarHBondContact O-CB 3.46Å; S84-Q87 PolarHBondContact O-N 2.64Å; S84-Q87 WeakPolarHBondContact OG-CB 3.22Å; S84-Q87 VanDerWaalsContact OG-CG 3.22Å; S84-Q87 WeakPolarHBondContact OG-CG 3.5Å; S84-Q87 PolarHBondContact OG-N 3.15Å; S84-Q87 PolarHBondContact OG-OE1 2.96Å; S84-R88 PolarHBondContact O-N 3.39Å
85	C	87.5	Confident	78.8	Confident	19 Å²	19	71.6 Å²	71.6	13%	0.128	39%	0.393	C	S	.	.	H	α-helix	trans	-49.2	-53.4	-179.2	-176.4	0	0	0	0	111.8	N36 Q87 R88 L89 C126	N36-C85 HydrophobicContact CB-CB 4.36Å; N36-C85 WeakPolarHBondContact OD1-CB 3.41Å; C85-Q87 VanDerWaalsContact C-N 3.33Å; C85-Q87 PolarHBondContact O-N 3.34Å; C85-R88 WeakPolarHBondContact O-CB 3.38Å; C85-R88 PolarHBondContact O-N 3.17Å; C85-R88 VanDerWaalsContact O-N 3.14Å; C85-L89 WeakPolarHBondContact O-CD1 3.18Å; C85-L89 PolarHBondContact O-N 2.93Å; C85-C126 HydrophobicContact CB-CB 3.82Å; C85-C126 WeakPolarHBondContact CB-SG 3.35Å; C85-C126 WeakPolarHBondContact SG-CA 3.4Å; C85-C126 WeakPolarHBondContact SG-CB 3.48Å; C85-C126 CovalentContact SG-SG 2.04Å; C85-C126 PolarHBondContact SG-SG 2.55Å
86	S	87.9	Confident	80	Confident	81 Å²	81	69.9 Å²	69.9	57%	0.566	38%	0.384	S	S	*	.	H	α-helix	trans	-61.6	-38.1	-179.8	57.5	0	0	0	0	113.6	S84 S90	S84-S86 VanDerWaalsContact C-N 3.34Å; S84-S86 PolarHBondContact O-N 2.94Å; S86-S90 WeakPolarHBondContact O-CB 3.41Å; S86-S90 PolarHBondContact O-N 3.49Å; S86-S90 VanDerWaalsContact O-N 3.11Å; S86-S90 PolarHBondContact O-OG 3.13Å
87	Q	87.4	Confident	81.8	Confident	103 Å²	103	65.4 Å²	65.4	48%	0.481	37%	0.369	S	S	.	.	H	α-helix	trans	-66.3	-42.4	175.9	-73.9	174.9	-18.7	0	0	111.4	L83 S84 C85 S90 R91	L83-Q87 HydrophobicContact CB-CB 4.13Å; L83-Q87 HydrophobicContact CD2-CB 4.17Å; S84-Q87 WeakPolarHBondContact O-CB 3.46Å; S84-Q87 PolarHBondContact O-N 2.64Å; S84-Q87 WeakPolarHBondContact OG-CB 3.22Å; S84-Q87 VanDerWaalsContact OG-CG 3.22Å; S84-Q87 WeakPolarHBondContact OG-CG 3.5Å; S84-Q87 PolarHBondContact OG-N 3.15Å; S84-Q87 PolarHBondContact OG-OE1 2.96Å; C85-Q87 VanDerWaalsContact C-N 3.33Å; C85-Q87 PolarHBondContact O-N 3.34Å; Q87-S90 PolarHBondContact O-N 2.89Å; Q87-S90 PolarHBondContact O-OG 2.94Å; Q87-R91 PolarHBondContact O-N 3.03Å
88	R	86.9	Confident	83.3	Confident	34 Å²	34	63.7 Å²	63.7	13%	0.128	36%	0.359	C	S	.	.	H	α-helix	trans	-56.8	-53.7	175.8	176.4	165	-174.9	-171.9	0.9	110.6	E35 Y73 L80 L83 S84 C85 S90 R91	E35-R88 PolarHBondContact O-NH1 2.86Å; E35-R88 VanDerWaalsContact O-NH1 3.15Å; Y73-R88 WeakPolarHBondContact CE1-O 3.41Å; Y73-R88 PolarHBondContact OH-O 2.99Å; L80-R88 HydrophobicContact CD2-CG 4.08Å; L80-R88 HydrophobicContact CG-CG 3.95Å; L83-R88 HydrophobicContact CB-CB 4.26Å; S84-R88 PolarHBondContact O-N 3.39Å; C85-R88 WeakPolarHBondContact O-CB 3.38Å; C85-R88 PolarHBondContact O-N 3.17Å; C85-R88 VanDerWaalsContact O-N 3.14Å; R88-S90 VanDerWaalsContact C-N 3.26Å; R88-S90 PolarHBondContact O-N 2.9Å; R88-R91 PolarHBondContact O-N 2.85Å; R88-R91 VanDerWaalsContact O-N 3.11Å
89	L	88.6	Confident	84.8	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.157	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-36.9	178.7	-77.9	83.5	0	0	0	112.8	L71 C85 R91 A121 T125 C126	L71-L89 HydrophobicContact CD1-CB 4.01Å; L71-L89 HydrophobicContact CD1-CD2 4.07Å; L71-L89 HydrophobicContact CD1-CG 3.63Å; C85-L89 WeakPolarHBondContact O-CD1 3.18Å; C85-L89 PolarHBondContact O-N 2.93Å; L89-R91 VanDerWaalsContact C-N 3.28Å; L89-R91 PolarHBondContact O-N 2.95Å; L89-A121 HydrophobicContact CD2-CB 3.63Å; L89-A121 HydrophobicContact CG-CB 4.29Å; L89-T125 HydrophobicContact CD1-CG2 4.39Å; L89-C126 WeakPolarHBondContact CD1-SG 3.4Å
90	S	87.4	Confident	86.1	Confident	97 Å²	97	63.1 Å²	63.1	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-71.7	-20.1	-179.3	73.4	0	0	0	0	114.3	S86 Q87 R88 A92	S86-S90 WeakPolarHBondContact O-CB 3.41Å; S86-S90 PolarHBondContact O-N 3.49Å; S86-S90 VanDerWaalsContact O-N 3.11Å; S86-S90 PolarHBondContact O-OG 3.13Å; Q87-S90 PolarHBondContact O-N 2.89Å; Q87-S90 PolarHBondContact O-OG 2.94Å; R88-S90 VanDerWaalsContact C-N 3.26Å; R88-S90 PolarHBondContact O-N 2.9Å; S90-A92 VanDerWaalsContact C-N 3.33Å
91	R	88.7	Confident	87.2	Confident	100 Å²	100	69.6 Å²	69.6	38%	0.377	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.6	-177.1	-166.1	162.5	171.1	170.1	-9.2	112.9	D77 D79 Q87 R88 L89 Q93	D77-R91 IonicContact OD1-CZ 3.59Å; D77-R91 IonicContact OD1-NE 3.92Å; D77-R91 PolarHBondContact OD1-NE 2.96Å; D77-R91 IonicContact OD1-NH2 2.95Å; D77-R91 PolarHBondContact OD1-NH2 2.81Å; D79-R91 IonicContact OD2-NH2 3.76Å; Q87-R91 PolarHBondContact O-N 3.03Å; R88-R91 PolarHBondContact O-N 2.85Å; R88-R91 VanDerWaalsContact O-N 3.11Å; L89-R91 VanDerWaalsContact C-N 3.28Å; L89-R91 PolarHBondContact O-N 2.95Å; R91-Q93 PolarHBondContact O-N 3.1Å
92	A	88.9	Confident	88.4	Confident	16 Å²	16	66.9 Å²	66.9	13%	0.132	36%	0.362	C	S	.	.			trans	-56.8	132.8	174.4	0	0	0	0	0	110.8	L71 Y73 S90	L71-A92 HydrophobicContact CB-CB 3.9Å; L71-A92 HydrophobicContact CD2-CB 3.89Å; L71-A92 HydrophobicContact CG-CB 4.37Å; Y73-A92 HydrophobicContact CD1-CB 4.45Å; Y73-A92 VanDerWaalsContact CE1-CA 3.41Å; Y73-A92 HydrophobicContact CE1-CB 3.82Å; Y73-A92 HydrophobicContact CE2-CB 4.25Å; S90-A92 VanDerWaalsContact C-N 3.33Å
93	Q	88.9	Confident	89.1	Confident	79 Å²	79	61.9 Å²	61.9	37%	0.369	33%	0.334	S	S	.	.	S	Bend	trans	-74	-34	179.1	-66.2	-174.4	-0.1	0	0	111.5	M72 Q74 R91 W116	M72-Q93 PolarHBondContact O-N 3.19Å; Q74-Q93 VanDerWaalsContact CD-NE2 3.25Å; R91-Q93 PolarHBondContact O-N 3.1Å; Q93-W116 HydrophobicContact CB-CH2 4.35Å; Q93-W116 HydrophobicContact CB-CZ3 4.04Å; Q93-W116 VanDerWaalsContact OE1-CZ3 3.3Å
94	F	88.6	Confident	89.7	Confident	56 Å²	56	63.9 Å²	63.9	25%	0.246	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.8	171	-66.5	-72.6	0	0	0	110.7	L71 M72 P108 W116	L71-F94 WeakPolarHBondContact CA-O 3.07Å; M72-F94 HydrophobicContact CB-CB 4.12Å; M72-F94 HydrophobicContact CG-CB 4.32Å; M72-F94 PolarHBondContact N-O 2.88Å; M72-F94 PolarHBondContact O-N 3.14Å; M72-F94 HydrophobicContact SD-CB 4.3Å; F94-P108 HydrophobicContact CE2-CG 3.66Å; F94-P108 HydrophobicContact CZ-CB 4.41Å; F94-P108 HydrophobicContact CZ-CG 3.57Å; F94-W116 AromaticContact CD2-CH2 3.67Å; F94-W116 HydrophobicContact CD2-CH2 3.67Å; F94-W116 AromaticContact CD2-CZ3 3.62Å; F94-W116 HydrophobicContact CD2-CZ3 3.62Å; F94-W116 AromaticContact CE2-CH2 3.47Å; F94-W116 HydrophobicContact CE2-CH2 3.47Å; F94-W116 VanDerWaalsContact CE2-CH2 3.47Å; F94-W116 HydrophobicContact CE2-CZ2 4.32Å; F94-W116 AromaticContact CE2-CZ3 3.95Å; F94-W116 HydrophobicContact CE2-CZ3 3.95Å
95	T	92.1	Very high	89.9	Confident	79 Å²	79	63.5 Å²	63.5	49%	0.485	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.7	171.3	-60.7	0	0	0	0	108.2	R69 L70 L71	R69-T95 HydrophobicContact CB-CG2 4.18Å; R69-T95 HydrophobicContact CG-CG2 4Å; L70-T95 WeakPolarHBondContact O-CA 3.43Å; L71-T95 HydrophobicContact CD2-CG2 3.77Å; L71-T95 WeakPolarHBondContact CD2-OG1 3.47Å
96	I	92.3	Very high	90.1	Very high	3 Å²	3	67.2 Å²	67.2	2%	0.015	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.1	180	-66.4	164.2	0	0	0	107.8	L53 R69 L70 M72 L98 H103 Q105	L53-I96 HydrophobicContact CD2-CD1 4Å; R69-I96 CarbonylContact C-O 3.52Å; R69-I96 VanDerWaalsContact CA-O 3.23Å; R69-I96 WeakPolarHBondContact CA-O 3.28Å; L70-I96 HydrophobicContact CB-CB 4.15Å; L70-I96 PolarHBondContact N-O 2.84Å; L70-I96 PolarHBondContact O-N 2.77Å; M72-I96 HydrophobicContact SD-CD1 4.01Å; I96-L98 HydrophobicContact CG2-CD2 4.36Å; I96-H103 HydrophobicContact CG2-CB 4.33Å; I96-H103 WeakPolarHBondContact CG2-CD2 3.39Å; I96-H103 WeakPolarHBondContact CG2-NE2 3.46Å; I96-Q105 HydrophobicContact CD1-CB 3.71Å; I96-Q105 HydrophobicContact CD1-CG 3.93Å; I96-Q105 HydrophobicContact CG1-CB 4.34Å; I96-Q105 HydrophobicContact CG1-CG 4.38Å
97	S	92.6	Very high	90.3	Very high	68 Å²	68	63.9 Å²	63.9	48%	0.476	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	125.1	174.5	58.2	0	0	0	0	111.2	S99	S97-S99 PolarHBondContact O-N 3.2Å
98	L	91.7	Very high	90.3	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.01	33%	0.328	C	S	.	.			trans	-90.4	67.7	-177.6	-68	-179.3	0	0	0	111.6	F27 C55 L57 G63 A68 L70 I96 Y120	F27-L98 HydrophobicContact CD2-CD1 4.09Å; F27-L98 HydrophobicContact CE2-CD1 3.58Å; F27-L98 HydrophobicContact CZ-CD1 4.26Å; C55-L98 HydrophobicContact CB-CD2 4.31Å; L57-L98 HydrophobicContact CD1-CB 3.63Å; L57-L98 HydrophobicContact CD1-CD2 4.15Å; L57-L98 HydrophobicContact CD1-CG 4.38Å; L57-L98 HydrophobicContact CD2-CB 4.47Å; L57-L98 HydrophobicContact CD2-CD1 4.16Å; L57-L98 HydrophobicContact CD2-CD2 4.2Å; L57-L98 HydrophobicContact CG-CD2 4.41Å; G63-L98 CarbonylContact C-O 3.55Å; G63-L98 WeakPolarHBondContact CA-O 3.34Å; A68-L98 HydrophobicContact CB-CB 3.8Å; A68-L98 HydrophobicContact CB-CD1 4.05Å; A68-L98 HydrophobicContact CB-CG 4.47Å; A68-L98 WeakPolarHBondContact O-CB 3.23Å; A68-L98 PolarHBondContact O-N 3.42Å; L70-L98 HydrophobicContact CD1-CD2 3.96Å; L70-L98 HydrophobicContact CD2-CD1 4.37Å; L70-L98 HydrophobicContact CG-CD1 3.92Å; L70-L98 HydrophobicContact CG-CD2 4.04Å; L70-L98 HydrophobicContact CG-CG 4.18Å; I96-L98 HydrophobicContact CG2-CD2 4.36Å; L98-Y120 HydrophobicContact CD1-CD2 4.21Å; L98-Y120 HydrophobicContact CD1-CE2 4.33Å
99	S	89.3	Confident	90.3	Very high	53 Å²	53	68.4 Å²	68.4	37%	0.371	35%	0.354	S	S	.	.			trans	-110.7	-8	-178.7	57.8	0	0	0	0	114.6	S97	S97-S99 PolarHBondContact O-N 3.2Å
100	Q	90.6	Very high	90.1	Very high	120 Å²	120	68.6 Å²	68.6	56%	0.561	35%	0.354	S	S	*	.	S	Bend	trans	-120.5	158	-177.2	-62.9	-178.1	5.7	0	0	110.6	L57 E102	L57-Q100 VanDerWaalsContact CD1-O 3.3Å; L57-Q100 WeakPolarHBondContact CD1-O 3.49Å; Q100-E102 VanDerWaalsContact C-N 3.32Å; Q100-E102 PolarHBondContact O-N 2.7Å
101	E	90.7	Very high	89.9	Confident	145 Å²	145	69.8 Å²	69.8	68%	0.678	36%	0.362	S	S	*	.	S	Bend	trans	-61.1	-40.2	178.9	-174	-178.8	171.3	0	0	112.2	R56 L57	R56-E101 CarbonylContact C-O 3.37Å; R56-E101 VanDerWaalsContact CA-O 3.22Å; R56-E101 WeakPolarHBondContact CA-O 3.27Å; L57-E101 PolarHBondContact N-O 3.17Å
102	E	92.5	Very high	89.7	Confident	76 Å²	76	67.8 Å²	67.8	36%	0.355	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.6	175.2	-173.7	175.1	110.9	0	0	109.9	V54 C55 R56 Q100 N104	V54-E102 HydrophobicContact CG1-CG 3.83Å; C55-E102 CarbonylContact O-C 3.56Å; C55-E102 WeakPolarHBondContact O-CA 3.27Å; R56-E102 HydrophobicContact CG-CB 4.32Å; R56-E102 HydrophobicContact CG-CG 4.04Å; R56-E102 IonicContact CZ-OE2 2.75Å; R56-E102 VanDerWaalsContact CZ-OE2 3.29Å; R56-E102 IonicContact NE-OE2 2.69Å; R56-E102 PolarHBondContact NE-OE2 3.3Å; R56-E102 IonicContact NH2-OE2 3.29Å; R56-E102 PolarHBondContact NH2-OE2 2.88Å; Q100-E102 VanDerWaalsContact C-N 3.32Å; Q100-E102 PolarHBondContact O-N 2.7Å; E102-N104 WeakPolarHBondContact CG-OD1 3.17Å; E102-N104 PolarHBondContact OE1-ND2 2.87Å; E102-N104 PolarHBondContact OE1-OD1 2.83Å
103	H	91.6	Very high	89.6	Confident	43 Å²	43	68.8 Å²	68.8	20%	0.199	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.9	173.9	-171.2	89.1	0	0	0	110.7	V54 C55 I96	V54-H103 CarbonylContact C-O 3.59Å; V54-H103 WeakPolarHBondContact CA-O 3.49Å; C55-H103 PolarHBondContact N-O 2.86Å; C55-H103 PolarHBondContact O-N 3.07Å; I96-H103 HydrophobicContact CG2-CB 4.33Å; I96-H103 WeakPolarHBondContact CG2-CD2 3.39Å; I96-H103 WeakPolarHBondContact CG2-NE2 3.46Å
104	N	93.1	Very high	89.5	Confident	85 Å²	85	66 Å²	66	46%	0.455	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.2	-176.3	-64	-16.8	0	0	0	109.6	L52 L53 V54 E102	L52-N104 HydrophobicContact CD1-CB 4.45Å; L53-N104 WeakPolarHBondContact O-CA 3.4Å; V54-N104 WeakPolarHBondContact CG1-OD1 3.38Å; V54-N104 WeakPolarHBondContact CG2-OD1 3.45Å; E102-N104 WeakPolarHBondContact CG-OD1 3.17Å; E102-N104 PolarHBondContact OE1-ND2 2.87Å; E102-N104 PolarHBondContact OE1-OD1 2.83Å
105	Q	91.8	Very high	89.4	Confident	44 Å²	44	63.7 Å²	63.7	21%	0.206	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.2	177.5	179.7	61.7	55.1	0	0	109.9	L53 I96	L53-Q105 HydrophobicContact CB-CB 4.39Å; L53-Q105 HydrophobicContact CD2-CB 4.5Å; L53-Q105 PolarHBondContact N-O 3.48Å; L53-Q105 PolarHBondContact O-N 2.94Å; I96-Q105 HydrophobicContact CD1-CB 3.71Å; I96-Q105 HydrophobicContact CD1-CG 3.93Å; I96-Q105 HydrophobicContact CG1-CB 4.34Å; I96-Q105 HydrophobicContact CG1-CG 4.38Å
106	T	91.4	Very high	89.1	Confident	97 Å²	97	60 Å²	60	60%	0.595	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	135.6	171	48.7	0	0	0	0	109.9	L52	L52-T106 HydrophobicContact CD1-CG2 3.93Å
107	I	90.5	Very high	88.9	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.062	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-81.4	131.1	-180	-55.1	-55.5	0	0	0	108.6	Y45 G51 M72 W116	Y45-I107 HydrophobicContact CD1-CB 4.49Å; Y45-I107 HydrophobicContact CD1-CG1 3.88Å; Y45-I107 HydrophobicContact CD2-CD1 4.47Å; Y45-I107 HydrophobicContact CD2-CG1 4.01Å; Y45-I107 HydrophobicContact CD2-CG2 4.26Å; Y45-I107 HydrophobicContact CE1-CD1 4.44Å; Y45-I107 HydrophobicContact CE1-CG1 3.59Å; Y45-I107 HydrophobicContact CE2-CD1 3.88Å; Y45-I107 HydrophobicContact CE2-CG1 3.73Å; Y45-I107 HydrophobicContact CG-CG1 4.08Å; Y45-I107 HydrophobicContact CG-CG2 4.24Å; Y45-I107 VanDerWaalsContact CZ-CG1 3.5Å; G51-I107 PolarHBondContact O-N 3.15Å; M72-I107 HydrophobicContact CE-CD1 3.72Å; M72-I107 HydrophobicContact SD-CD1 4.41Å; I107-W116 HydrophobicContact CG2-CZ2 4.28Å
108	P	87.3	Confident	88.8	Confident	51 Å²	51	58.6 Å²	58.6	33%	0.331	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-64.3	151.3	178.9	30.8	-40.4	0	0	0	111.1	F94 Q110	F94-P108 HydrophobicContact CE2-CG 3.66Å; F94-P108 HydrophobicContact CZ-CB 4.41Å; F94-P108 HydrophobicContact CZ-CG 3.57Å; P108-Q110 PolarHBondContact O-N 3.03Å; P108-Q110 PolarHBondContact O-NE2 2.9Å; P108-Q110 VanDerWaalsContact O-NE2 3.16Å
109	R	86.9	Confident	88.7	Confident	180 Å²	180	58.6 Å²	58.6	68%	0.679	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-48.2	126.4	177.6	-163.2	169.8	168.9	149	-9	112.5	G48 D49	G48-R109 WeakPolarHBondContact O-CA 3.46Å; D49-R109 WeakPolarHBondContact OD1-CA 3.41Å; D49-R109 WeakPolarHBondContact OD1-CB 3.12Å; D49-R109 WeakPolarHBondContact OD1-CG 3.36Å; D49-R109 WeakPolarHBondContact OD2-CD 3.24Å; D49-R109 IonicContact OD2-CZ 3.92Å; D49-R109 IonicContact OD2-NE 3.35Å; D49-R109 IonicContact OD2-NH1 3.99Å; D49-R109 PolarHBondContact OD2-NH1 3.39Å
110	Q	84.8	Confident	88.9	Confident	35 Å²	35	56.1 Å²	56.1	16%	0.164	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-111.4	143.1	172.8	-59.8	-56.8	-39.3	0	0	111.5	G48 P108 S112	G48-Q110 PolarHBondContact N-O 3.42Å; G48-Q110 PolarHBondContact O-N 3.01Å; P108-Q110 PolarHBondContact O-N 3.03Å; P108-Q110 PolarHBondContact O-NE2 2.9Å; P108-Q110 VanDerWaalsContact O-NE2 3.16Å; Q110-S112 VanDerWaalsContact C-N 3.3Å; Q110-S112 VanDerWaalsContact CB-O 3.32Å; Q110-S112 WeakPolarHBondContact CB-O 3.3Å
111	S	84.6	Confident	89	Confident	121 Å²	121	50.4 Å²	50.4	85%	0.846	27%	0.268	S	S	*	.	S	Bend	trans	-73.4	-23.3	173.5	50.7	0	0	0	0	113.1
112	S	84.4	Confident	89.1	Confident	58 Å²	58	43.8 Å²	43.8	41%	0.406	24%	0.237	S	C	.	.	S	Bend	trans	-143.3	156.8	-178.5	50	0	0	0	0	110.5	Q110 T114	Q110-S112 VanDerWaalsContact C-N 3.3Å; Q110-S112 VanDerWaalsContact CB-O 3.32Å; Q110-S112 WeakPolarHBondContact CB-O 3.3Å; S112-T114 PolarHBondContact O-N 2.97Å; S112-T114 PolarHBondContact O-OG1 3.3Å
113	P	86.5	Confident	89.1	Confident	38 Å²	38	46.1 Å²	46.1	25%	0.247	24%	0.243	C	C	.	.			trans	-57.3	131.6	172.8	-23.2	36.9	0	0	0	109.9	M44 Y45 A47 A159	M44-P113 HydrophobicContact CG-CB 4.4Å; M44-P113 HydrophobicContact SD-CB 4.11Å; Y45-P113 VanDerWaalsContact O-CA 3.23Å; Y45-P113 WeakPolarHBondContact O-CA 3.3Å; A47-P113 HydrophobicContact CB-CG 4.28Å; P113-A159 HydrophobicContact CB-CB 3.98Å
114	T	86.6	Confident	88.9	Confident	20 Å²	20	45.8 Å²	45.8	12%	0.123	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.1	-172	-53.1	0	0	0	0	109.2	Y45 Q74 S112	Y45-T114 PolarHBondContact N-O 3.15Å; Y45-T114 PolarHBondContact O-N 3.25Å; Y45-T114 VanDerWaalsContact O-N 3.13Å; Q74-T114 HydrophobicContact CB-CG2 4.28Å; Q74-T114 HydrophobicContact CG-CG2 3.89Å; S112-T114 PolarHBondContact O-N 2.97Å; S112-T114 PolarHBondContact O-OG1 3.3Å
115	A	85.3	Confident	88.8	Confident	7 Å²	7	41.8 Å²	41.8	6%	0.058	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.5	175	0	0	0	0	0	110.4	M44 D75	M44-A115 HydrophobicContact CB-CB 4.45Å; M44-A115 HydrophobicContact CE-CB 3.95Å; M44-A115 HydrophobicContact CG-CB 4.41Å; D75-A115 HydrophobicContact CB-CB 3.65Å; D75-A115 WeakPolarHBondContact CB-O 3.38Å; D75-A115 PolarHBondContact N-O 3.29Å
116	W	87.6	Confident	88.7	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.8	177.7	-71	76.5	0	0	0	109.6	K42 F43 Y45 M72 Y73 Q74 Q93 F94 I107	K42-W116 CarbonylContact C-O 3.53Å; K42-W116 VanDerWaalsContact CA-O 3.3Å; K42-W116 WeakPolarHBondContact CA-O 3.19Å; F43-W116 PolarHBondContact N-O 3.49Å; F43-W116 PolarHBondContact O-N 2.8Å; Y45-W116 HydrophobicContact CD2-CB 4.27Å; Y45-W116 AromaticContact CD2-CD1 3.47Å; Y45-W116 VanDerWaalsContact CD2-CD1 3.47Å; Y45-W116 AromaticContact CD2-CG 3.97Å; Y45-W116 HydrophobicContact CD2-CG 3.97Å; Y45-W116 HydrophobicContact CE2-CB 4.21Å; Y45-W116 HydrophobicContact CE2-CG 4.23Å; M72-W116 HydrophobicContact CB-CE3 3.84Å; M72-W116 HydrophobicContact CB-CZ3 4.11Å; M72-W116 HydrophobicContact CE-CB 4.29Å; M72-W116 HydrophobicContact CE-CD2 4.35Å; M72-W116 HydrophobicContact CE-CE3 4.09Å; M72-W116 HydrophobicContact CE-CG 4.5Å; Y73-W116 CarbonylContact O-C 3.58Å; Y73-W116 VanDerWaalsContact O-CA 3.27Å; Y73-W116 WeakPolarHBondContact O-CA 3.45Å; Q74-W116 HydrophobicContact CG-CD2 3.9Å; Q74-W116 HydrophobicContact CG-CE3 3.93Å; Q74-W116 HydrophobicContact CG-CH2 3.71Å; Q74-W116 HydrophobicContact CG-CZ2 3.69Å; Q74-W116 HydrophobicContact CG-CZ3 3.83Å; Q74-W116 VanDerWaalsContact NE2-CH2 3.35Å; Q93-W116 HydrophobicContact CB-CH2 4.35Å; Q93-W116 HydrophobicContact CB-CZ3 4.04Å; Q93-W116 VanDerWaalsContact OE1-CZ3 3.3Å; F94-W116 AromaticContact CD2-CH2 3.67Å; F94-W116 HydrophobicContact CD2-CH2 3.67Å; F94-W116 AromaticContact CD2-CZ3 3.62Å; F94-W116 HydrophobicContact CD2-CZ3 3.62Å; F94-W116 AromaticContact CE2-CH2 3.47Å; F94-W116 HydrophobicContact CE2-CH2 3.47Å; F94-W116 VanDerWaalsContact CE2-CH2 3.47Å; F94-W116 HydrophobicContact CE2-CZ2 4.32Å; F94-W116 AromaticContact CE2-CZ3 3.95Å; F94-W116 HydrophobicContact CE2-CZ3 3.95Å; I107-W116 HydrophobicContact CG2-CZ2 4.28Å
117	Q	87.8	Confident	88.4	Confident	42 Å²	42	41.4 Å²	41.4	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.7	172.2	-60.8	-175.8	-0.8	0	0	109	K42 M72 Y73 D75 L119	K42-Q117 HydrophobicContact CD-CG 4.34Å; K42-Q117 HydrophobicContact CG-CG 4.3Å; M72-Q117 WeakPolarHBondContact CA-O 3.48Å; Y73-Q117 PolarHBondContact N-O 3.36Å; Y73-Q117 PolarHBondContact O-N 3.06Å; D75-Q117 PolarHBondContact OD1-NE2 2.9Å; Q117-L119 HydrophobicContact CB-CD1 4.06Å
118	V	89.3	Confident	87.7	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.8	178.1	-175.7	0	0	0	0	108.5	I40 T41 L53 L70 L71 M72 L142	I40-V118 HydrophobicContact CB-CG1 4.48Å; I40-V118 WeakPolarHBondContact CB-O 3.4Å; I40-V118 PolarHBondContact N-O 3.48Å; T41-V118 HydrophobicContact CG2-CB 4.18Å; T41-V118 HydrophobicContact CG2-CG2 4.26Å; T41-V118 PolarHBondContact N-O 3.06Å; T41-V118 PolarHBondContact O-N 3.06Å; L53-V118 HydrophobicContact CD1-CG2 3.99Å; L70-V118 HydrophobicContact CB-CG1 4.41Å; L70-V118 HydrophobicContact CD1-CG1 4.49Å; L70-V118 HydrophobicContact CD2-CG1 4.01Å; L71-V118 WeakPolarHBondContact O-CA 3.31Å; M72-V118 HydrophobicContact CE-CG2 4.27Å; M72-V118 HydrophobicContact CG-CG2 4.43Å; V118-L142 HydrophobicContact CG1-CD2 4.15Å
119	L	90.6	Very high	86.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.6	176.7	-76.6	71.8	0	0	0	109.8	Q38 F39 L70 L71 Y73 Q117	Q38-L119 CarbonylContact O-C 3.57Å; Q38-L119 VanDerWaalsContact O-CA 3.27Å; Q38-L119 WeakPolarHBondContact O-CA 3.47Å; F39-L119 HydrophobicContact CD2-CD1 4.4Å; L70-L119 CarbonylContact C-O 3.55Å; L70-L119 WeakPolarHBondContact CA-O 3.23Å; L71-L119 HydrophobicContact CB-CB 4.5Å; L71-L119 PolarHBondContact N-O 2.93Å; L71-L119 PolarHBondContact O-N 2.92Å; Y73-L119 HydrophobicContact CD2-CD1 3.93Å; Y73-L119 HydrophobicContact CE2-CB 4.36Å; Y73-L119 HydrophobicContact CE2-CD1 4.14Å; Y73-L119 HydrophobicContact CE2-CD2 4.23Å; Y73-L119 HydrophobicContact CE2-CG 4.48Å; Q117-L119 HydrophobicContact CB-CD1 4.06Å
120	Y	92.8	Very high	85.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.3	168.7	167	-97.7	0	0	0	110.5	F27 A32 G37 Q38 A68 L98 D122	F27-Y120 HydrophobicContact CB-CD1 3.85Å; F27-Y120 HydrophobicContact CB-CD2 3.71Å; F27-Y120 HydrophobicContact CB-CE1 3.77Å; F27-Y120 HydrophobicContact CB-CE2 3.57Å; F27-Y120 HydrophobicContact CB-CG 3.84Å; F27-Y120 VanDerWaalsContact CD1-CB 3.48Å; F27-Y120 HydrophobicContact CD1-CD1 4.1Å; F27-Y120 AromaticContact CD1-CD2 3.53Å; F27-Y120 HydrophobicContact CD1-CD2 3.53Å; F27-Y120 HydrophobicContact CD1-CE2 4.28Å; F27-Y120 AromaticContact CD1-CG 3.42Å; F27-Y120 HydrophobicContact CD1-CG 3.42Å; F27-Y120 VanDerWaalsContact CD1-CG 3.42Å; F27-Y120 AromaticContact CD2-CD2 3.76Å; F27-Y120 HydrophobicContact CD2-CD2 3.76Å; F27-Y120 AromaticContact CD2-CE2 3.91Å; F27-Y120 HydrophobicContact CD2-CE2 3.91Å; F27-Y120 HydrophobicContact CD2-CG 4.47Å; F27-Y120 HydrophobicContact CE1-CD2 4.04Å; F27-Y120 HydrophobicContact CE1-CG 4.07Å; F27-Y120 HydrophobicContact CE2-CD2 4.22Å; F27-Y120 HydrophobicContact CG-CD1 4.2Å; F27-Y120 AromaticContact CG-CD2 3.39Å; F27-Y120 HydrophobicContact CG-CD2 3.39Å; F27-Y120 HydrophobicContact CG-CE1 4.48Å; F27-Y120 AromaticContact CG-CE2 3.68Å; F27-Y120 HydrophobicContact CG-CE2 3.68Å; F27-Y120 AromaticContact CG-CG 3.67Å; F27-Y120 HydrophobicContact CG-CG 3.67Å; F27-Y120 HydrophobicContact CZ-CD2 4.37Å; A32-Y120 HydrophobicContact CB-CD1 3.99Å; A32-Y120 HydrophobicContact CB-CE1 4.14Å; G37-Y120 CarbonylContact C-O 3.52Å; G37-Y120 WeakPolarHBondContact CA-O 3.5Å; Q38-Y120 HydrophobicContact CB-CD1 4.23Å; Q38-Y120 PolarHBondContact N-O 2.99Å; Q38-Y120 PolarHBondContact O-N 3.48Å; A68-Y120 HydrophobicContact CB-CE2 3.82Å; L98-Y120 HydrophobicContact CD1-CD2 4.21Å; L98-Y120 HydrophobicContact CD1-CE2 4.33Å; Y120-D122 HydrophobicContact CE1-CB 4.44Å; Y120-D122 WeakPolarHBondContact OH-CB 3.34Å; Y120-D122 PolarHBondContact OH-OD2 3.47Å
121	A	93.6	Very high	84.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.6	171	0	0	0	0	0	110.8	R69 L71 L89 T125	R69-A121 PolarHBondContact N-O 2.8Å; R69-A121 PolarHBondContact O-N 3.07Å; R69-A121 VanDerWaalsContact O-O 3.06Å; L71-A121 HydrophobicContact CD1-CB 3.73Å; L71-A121 HydrophobicContact CG-CB 4.34Å; L89-A121 HydrophobicContact CD2-CB 3.63Å; L89-A121 HydrophobicContact CG-CB 4.29Å; A121-T125 WeakPolarHBondContact CA-OG1 3.4Å; A121-T125 HydrophobicContact CB-CG2 4.15Å
122	D	92.9	Very high	82.8	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.027	27%	0.27	C	S	.	.			trans	-140.8	-179.8	175.5	60.8	26.1	0	0	0	110.8	S29 K66 Y120 Y124 T125	S29-D122 WeakPolarHBondContact CA-OD2 3.35Å; S29-D122 WeakPolarHBondContact CB-OD2 3.32Å; S29-D122 PolarHBondContact OG-OD2 2.87Å; K66-D122 HydrophobicContact CB-CB 4.23Å; K66-D122 WeakPolarHBondContact O-CB 3.33Å; Y120-D122 HydrophobicContact CE1-CB 4.44Å; Y120-D122 WeakPolarHBondContact OH-CB 3.34Å; Y120-D122 PolarHBondContact OH-OD2 3.47Å; D122-Y124 PolarHBondContact O-N 3.38Å; D122-Y124 VanDerWaalsContact O-N 3.08Å; D122-Y124 WeakPolarHBondContact OD1-CA 3.49Å; D122-Y124 WeakPolarHBondContact OD1-CB 3.48Å; D122-Y124 PolarHBondContact OD1-N 3.05Å; D122-T125 PolarHBondContact N-OG1 2.78Å; D122-T125 WeakPolarHBondContact O-CB 3.22Å; D122-T125 PolarHBondContact O-N 2.93Å; D122-T125 VanDerWaalsContact O-N 3.15Å; D122-T125 PolarHBondContact O-OG1 3.47Å; D122-T125 PolarHBondContact OD1-N 2.75Å; D122-T125 PolarHBondContact OD1-OG1 2.81Å
123	R	90.9	Very high	81.8	Confident	126 Å²	126	48.9 Å²	48.9	48%	0.475	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.1	179.7	65.8	177.3	-85.7	179.6	-5.2	114.3	K66 E67	K66-R123 WeakPolarHBondContact O-CG 3.49Å; K66-R123 PolarHBondContact O-N 2.82Å; E67-R123 HydrophobicContact CB-CB 4.4Å
124	Y	88.9	Confident	80.8	Confident	36 Å²	36	53.2 Å²	53.2	14%	0.141	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-11.9	-175.9	-53	-67.8	0	0	0	112.4	K66 D122 C126 E127 Y135	K66-Y124 HydrophobicContact CG-CE2 4.31Å; D122-Y124 PolarHBondContact O-N 3.38Å; D122-Y124 VanDerWaalsContact O-N 3.08Å; D122-Y124 WeakPolarHBondContact OD1-CA 3.49Å; D122-Y124 WeakPolarHBondContact OD1-CB 3.48Å; D122-Y124 PolarHBondContact OD1-N 3.05Å; Y124-C126 VanDerWaalsContact C-N 3.32Å; Y124-C126 PolarHBondContact O-N 3.28Å; Y124-E127 WeakPolarHBondContact CD1-OE2 3.34Å; Y124-E127 PolarHBondContact O-N 3.35Å; Y124-E127 VanDerWaalsContact O-N 3.1Å; Y124-Y135 AromaticContact CD1-CE1 3.79Å; Y124-Y135 HydrophobicContact CD1-CE1 3.79Å; Y124-Y135 AromaticContact CD1-CZ 3.87Å; Y124-Y135 WeakPolarHBondContact CD1-OH 3.32Å; Y124-Y135 HydrophobicContact CD2-CD1 4.05Å; Y124-Y135 AromaticContact CD2-CE1 3.67Å; Y124-Y135 HydrophobicContact CD2-CE1 3.67Å; Y124-Y135 AromaticContact CE1-CE1 3.77Å; Y124-Y135 HydrophobicContact CE1-CE1 3.77Å; Y124-Y135 AromaticContact CE2-CD1 3.96Å; Y124-Y135 HydrophobicContact CE2-CD1 3.96Å; Y124-Y135 AromaticContact CE2-CE1 3.64Å; Y124-Y135 HydrophobicContact CE2-CE1 3.64Å; Y124-Y135 AromaticContact CG-CE1 3.75Å; Y124-Y135 HydrophobicContact CG-CE1 3.75Å; Y124-Y135 AromaticContact CG-CZ 3.85Å; Y124-Y135 AromaticContact CZ-CE1 3.7Å
125	T	90	Very high	80.1	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-38.3	-172.9	-62.8	0	0	0	0	113.4	A32 R33 L89 A121 D122	A32-T125 HydrophobicContact CB-CG2 4.17Å; R33-T125 WeakPolarHBondContact CA-O 3.25Å; L89-T125 HydrophobicContact CD1-CG2 4.39Å; A121-T125 WeakPolarHBondContact CA-OG1 3.4Å; A121-T125 HydrophobicContact CB-CG2 4.15Å; D122-T125 PolarHBondContact N-OG1 2.78Å; D122-T125 WeakPolarHBondContact O-CB 3.22Å; D122-T125 PolarHBondContact O-N 2.93Å; D122-T125 VanDerWaalsContact O-N 3.15Å; D122-T125 PolarHBondContact O-OG1 3.47Å; D122-T125 PolarHBondContact OD1-N 2.75Å; D122-T125 PolarHBondContact OD1-OG1 2.81Å
126	C	89.6	Confident	80	Confident	54 Å²	54	57 Å²	57	37%	0.365	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	15.7	177.1	-57.6	0	0	0	0	113.6	C85 L89 Y124	C85-C126 HydrophobicContact CB-CB 3.82Å; C85-C126 WeakPolarHBondContact CB-SG 3.35Å; C85-C126 WeakPolarHBondContact SG-CA 3.4Å; C85-C126 WeakPolarHBondContact SG-CB 3.48Å; C85-C126 CovalentContact SG-SG 2.04Å; C85-C126 PolarHBondContact SG-SG 2.55Å; L89-C126 WeakPolarHBondContact CD1-SG 3.4Å; Y124-C126 VanDerWaalsContact C-N 3.32Å; Y124-C126 PolarHBondContact O-N 3.28Å
127	E	85.9	Confident	80	Confident	79 Å²	79	61 Å²	61	37%	0.369	35%	0.347	S	S	.	.			trans	-82.8	124.7	-178.4	-153.3	-177.6	149.7	0	0	110.5	Y124 S129	Y124-E127 WeakPolarHBondContact CD1-OE2 3.34Å; Y124-E127 PolarHBondContact O-N 3.35Å; Y124-E127 VanDerWaalsContact O-N 3.1Å; E127-S129 VanDerWaalsContact CG-OG 3.32Å; E127-S129 WeakPolarHBondContact CG-OG 3.45Å; E127-S129 PolarHBondContact O-N 2.86Å; E127-S129 PolarHBondContact OE1-OG 3.49Å
128	E	75.2	Confident	80.1	Confident	198 Å²	198	59.1 Å²	59.1	93%	0.925	34%	0.338	S	S	*	.			trans	-81.4	5.2	-179.1	-68.1	-177.2	170.1	0	0	113.7	S130	E128-S130 PolarHBondContact O-N 3.26Å
129	S	69.6	Low	80.3	Confident	41 Å²	41	59.4 Å²	59.4	29%	0.287	34%	0.341	S	S	.	.			trans	-69.3	131.3	-170.6	45.9	0	0	0	0	112.9	R33 E127 V131	R33-S129 PolarHBondContact NH1-O 3.45Å; E127-S129 VanDerWaalsContact CG-OG 3.32Å; E127-S129 WeakPolarHBondContact CG-OG 3.45Å; E127-S129 PolarHBondContact O-N 2.86Å; E127-S129 PolarHBondContact OE1-OG 3.49Å; S129-V131 PolarHBondContact O-N 2.91Å
130	S	57.3	Low	80.4	Confident	124 Å²	124	59.9 Å²	59.9	87%	0.867	34%	0.343	S	S	*	.	S	Bend	trans	-79.2	2	-172.6	64.1	0	0	0	0	115	E128	E128-S130 PolarHBondContact O-N 3.26Å
131	V	60	Low	80.4	Confident	105 Å²	105	61.3 Å²	61.3	64%	0.636	35%	0.351	S	S	*	.			trans	-102.3	120.7	175.6	-175.9	0	0	0	0	105.8	S129 P133	S129-V131 PolarHBondContact O-N 2.91Å; V131-P133 VanDerWaalsContact C-CD 3.49Å; V131-P133 WeakPolarHBondContact O-CD 3.44Å
132	T	54.5	Low	80.3	Confident	84 Å²	84	61.2 Å²	61.2	52%	0.515	35%	0.35	S	S	.	.			trans	-90.7	97.7	169.4	37.3	0	0	0	0	108.9	S134	T132-S134 PolarHBondContact O-N 3.18Å
133	P	62.4	Low	80.2	Confident	62 Å²	62	61.8 Å²	61.8	40%	0.403	35%	0.353	S	S	.	.			trans	-51.1	140.6	155.8	-21.1	28.6	0	0	0	109.3	V131 Y135	V131-P133 VanDerWaalsContact C-CD 3.49Å; V131-P133 WeakPolarHBondContact O-CD 3.44Å; P133-Y135 HydrophobicContact CB-CD1 4Å; P133-Y135 HydrophobicContact CB-CD2 4.37Å; P133-Y135 HydrophobicContact CB-CE1 3.66Å; P133-Y135 HydrophobicContact CB-CE2 4.04Å; P133-Y135 HydrophobicContact CB-CG 4.36Å; P133-Y135 VanDerWaalsContact CD-CZ 3.49Å; P133-Y135 VanDerWaalsContact CD-OH 3.27Å; P133-Y135 WeakPolarHBondContact CD-OH 3.46Å; P133-Y135 HydrophobicContact CG-CE1 3.68Å; P133-Y135 HydrophobicContact CG-CE2 4.03Å; P133-Y135 VanDerWaalsContact CG-CZ 3.41Å; P133-Y135 WeakPolarHBondContact CG-OH 3.45Å; P133-Y135 WeakPolarHBondContact O-CD2 3.18Å; P133-Y135 WeakPolarHBondContact O-CE2 3.37Å; P133-Y135 PolarHBondContact O-N 2.87Å
134	S	66.3	Low	80.2	Confident	129 Å²	129	55.8 Å²	55.8	90%	0.902	33%	0.331	S	S	*	.			trans	-67.7	87.8	164.8	179.5	0	0	0	0	107.6	T132	T132-S134 PolarHBondContact O-N 3.18Å
135	Y	72.1	Confident	80.3	Confident	45 Å²	45	55.4 Å²	55.4	18%	0.176	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-73	127.9	178.2	-58.4	-75	0	0	0	109	Y124 P133 D137	Y124-Y135 AromaticContact CD1-CE1 3.79Å; Y124-Y135 HydrophobicContact CD1-CE1 3.79Å; Y124-Y135 AromaticContact CD1-CZ 3.87Å; Y124-Y135 WeakPolarHBondContact CD1-OH 3.32Å; Y124-Y135 HydrophobicContact CD2-CD1 4.05Å; Y124-Y135 AromaticContact CD2-CE1 3.67Å; Y124-Y135 HydrophobicContact CD2-CE1 3.67Å; Y124-Y135 AromaticContact CE1-CE1 3.77Å; Y124-Y135 HydrophobicContact CE1-CE1 3.77Å; Y124-Y135 AromaticContact CE2-CD1 3.96Å; Y124-Y135 HydrophobicContact CE2-CD1 3.96Å; Y124-Y135 AromaticContact CE2-CE1 3.64Å; Y124-Y135 HydrophobicContact CE2-CE1 3.64Å; Y124-Y135 AromaticContact CG-CE1 3.75Å; Y124-Y135 HydrophobicContact CG-CE1 3.75Å; Y124-Y135 AromaticContact CG-CZ 3.85Å; Y124-Y135 AromaticContact CZ-CE1 3.7Å; P133-Y135 HydrophobicContact CB-CD1 4Å; P133-Y135 HydrophobicContact CB-CD2 4.37Å; P133-Y135 HydrophobicContact CB-CE1 3.66Å; P133-Y135 HydrophobicContact CB-CE2 4.04Å; P133-Y135 HydrophobicContact CB-CG 4.36Å; P133-Y135 VanDerWaalsContact CD-CZ 3.49Å; P133-Y135 VanDerWaalsContact CD-OH 3.27Å; P133-Y135 WeakPolarHBondContact CD-OH 3.46Å; P133-Y135 HydrophobicContact CG-CE1 3.68Å; P133-Y135 HydrophobicContact CG-CE2 4.03Å; P133-Y135 VanDerWaalsContact CG-CZ 3.41Å; P133-Y135 WeakPolarHBondContact CG-OH 3.45Å; P133-Y135 WeakPolarHBondContact O-CD2 3.18Å; P133-Y135 WeakPolarHBondContact O-CE2 3.37Å; P133-Y135 PolarHBondContact O-N 2.87Å; Y135-D137 PolarHBondContact O-N 3.45Å
136	A	83.4	Confident	80.4	Confident	61 Å²	61	55.4 Å²	55.4	50%	0.504	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-68.6	130.9	172.9	0	0	0	0	0	109.5	L62 K66	L62-A136 HydrophobicContact CD2-CB 4.16Å; K66-A136 WeakPolarHBondContact CE-O 3.42Å; K66-A136 PolarHBondContact NZ-O 2.86Å
137	D	87.9	Confident	80.4	Confident	86 Å²	86	53.8 Å²	53.8	46%	0.46	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-72	146.2	178.2	-63.9	-33.3	0	0	0	111.7	L26 G28 Y135	L26-D137 HydrophobicContact CB-CB 4.03Å; L26-D137 HydrophobicContact CD1-CB 4.37Å; L26-D137 HydrophobicContact CD2-CB 4.06Å; L26-D137 HydrophobicContact CG-CB 4.38Å; G28-D137 WeakPolarHBondContact CA-OD1 3.33Å; Y135-D137 PolarHBondContact O-N 3.45Å
138	L	89.5	Confident	80.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111.7	-179.5	173.7	64.2	0	0	0	110.1	F27 L57 N59 L62 A68	F27-L138 HydrophobicContact CB-CB 4.14Å; F27-L138 WeakPolarHBondContact CB-O 3.47Å; F27-L138 HydrophobicContact CD2-CB 4.46Å; F27-L138 HydrophobicContact CD2-CD2 4.09Å; F27-L138 HydrophobicContact CD2-CG 4.15Å; F27-L138 PolarHBondContact N-O 2.86Å; F27-L138 PolarHBondContact O-N 3.13Å; L57-L138 HydrophobicContact CD2-CD2 4.05Å; L57-L138 HydrophobicContact CD2-CG 4.27Å; N59-L138 HydrophobicContact CB-CD1 4.1Å; N59-L138 WeakPolarHBondContact O-CD1 3.42Å; L62-L138 HydrophobicContact CB-CD1 4.42Å; L62-L138 HydrophobicContact CD2-CB 4.26Å; L62-L138 HydrophobicContact CD2-CD1 4.37Å; A68-L138 HydrophobicContact CB-CD2 4.23Å
139	G	92.1	Very high	80.7	Confident	8 Å²	8	49.6 Å²	49.6	8%	0.082	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	136.6	176.1	0	0	0	0	0	112.6	D58	D58-G139 PolarHBondContact N-O 2.73Å; D58-G139 WeakPolarHBondContact OD2-CA 3.22Å
140	F	92.9	Very high	81.4	Confident	11 Å²	11	51.3 Å²	51.3	5%	0.048	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157.3	-180	76.1	-89.1	0	0	0	113.1	V23 K24 G25 F27 I40 R56 L57 L142	V23-F140 HydrophobicContact CB-CE2 4.4Å; V23-F140 HydrophobicContact CG1-CE2 3.95Å; V23-F140 HydrophobicContact CG1-CZ 4.11Å; K24-F140 WeakPolarHBondContact CA-O 3.18Å; G25-F140 VanDerWaalsContact C-CD1 3.47Å; G25-F140 PolarHBondContact N-O 3.1Å; G25-F140 VanDerWaalsContact O-CD1 3.27Å; G25-F140 WeakPolarHBondContact O-CD1 3.33Å; G25-F140 PolarHBondContact O-N 3.4Å; F27-F140 HydrophobicContact CB-CD1 4.45Å; F27-F140 AromaticContact CD1-CD1 3.33Å; F27-F140 HydrophobicContact CD1-CD1 3.33Å; F27-F140 AromaticContact CD1-CE1 3.38Å; F27-F140 HydrophobicContact CD1-CE1 3.38Å; F27-F140 HydrophobicContact CD1-CG 4.08Å; F27-F140 HydrophobicContact CD1-CZ 4.17Å; F27-F140 HydrophobicContact CD2-CB 3.8Å; F27-F140 AromaticContact CD2-CD1 3.66Å; F27-F140 HydrophobicContact CD2-CD1 3.66Å; F27-F140 AromaticContact CD2-CG 3.95Å; F27-F140 HydrophobicContact CD2-CG 3.95Å; F27-F140 HydrophobicContact CE1-CB 4.31Å; F27-F140 AromaticContact CE1-CD1 3.23Å; F27-F140 HydrophobicContact CE1-CD1 3.23Å; F27-F140 AromaticContact CE1-CD2 3.87Å; F27-F140 HydrophobicContact CE1-CD2 3.87Å; F27-F140 AromaticContact CE1-CE1 3.29Å; F27-F140 HydrophobicContact CE1-CE1 3.29Å; F27-F140 AromaticContact CE1-CE2 3.94Å; F27-F140 HydrophobicContact CE1-CE2 3.94Å; F27-F140 AromaticContact CE1-CG 3.54Å; F27-F140 HydrophobicContact CE1-CG 3.54Å; F27-F140 AromaticContact CE1-CZ 3.68Å; F27-F140 HydrophobicContact CE1-CZ 3.68Å; F27-F140 HydrophobicContact CE2-CB 3.24Å; F27-F140 AromaticContact CE2-CD1 3.6Å; F27-F140 HydrophobicContact CE2-CD1 3.6Å; F27-F140 HydrophobicContact CE2-CD2 4.22Å; F27-F140 HydrophobicContact CE2-CE1 4.5Å; F27-F140 AromaticContact CE2-CG 3.43Å; F27-F140 HydrophobicContact CE2-CG 3.43Å; F27-F140 VanDerWaalsContact CE2-CG 3.43Å; F27-F140 AromaticContact CG-CD1 3.53Å; F27-F140 HydrophobicContact CG-CD1 3.53Å; F27-F140 HydrophobicContact CG-CE1 4.02Å; F27-F140 HydrophobicContact CG-CG 4.25Å; F27-F140 HydrophobicContact CZ-CB 3.53Å; F27-F140 AromaticContact CZ-CD1 3.37Å; F27-F140 HydrophobicContact CZ-CD1 3.37Å; F27-F140 AromaticContact CZ-CD2 3.55Å; F27-F140 HydrophobicContact CZ-CD2 3.55Å; F27-F140 AromaticContact CZ-CE1 3.9Å; F27-F140 HydrophobicContact CZ-CE1 3.9Å; F27-F140 HydrophobicContact CZ-CE2 4.08Å; F27-F140 AromaticContact CZ-CG 3.17Å; F27-F140 HydrophobicContact CZ-CG 3.17Å; F27-F140 HydrophobicContact CZ-CZ 4.24Å; I40-F140 HydrophobicContact CD1-CE1 4.26Å; I40-F140 HydrophobicContact CD1-CZ 4.03Å; I40-F140 HydrophobicContact CG2-CE2 3.65Å; I40-F140 HydrophobicContact CG2-CZ 3.66Å; R56-F140 CarbonylContact O-C 3.58Å; R56-F140 VanDerWaalsContact O-CA 3.31Å; R56-F140 WeakPolarHBondContact O-CA 3.4Å; L57-F140 HydrophobicContact CD2-CB 4.23Å; F140-L142 HydrophobicContact CD2-CB 4.05Å; F140-L142 HydrophobicContact CE2-CB 4.09Å
141	N	92.6	Very high	82.6	Confident	30 Å²	30	47.6 Å²	47.6	16%	0.16	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	108.7	170.7	-177.3	27.2	0	0	0	109.2	T22 K24 R56	T22-N141 VanDerWaalsContact CG2-OD1 3.24Å; T22-N141 WeakPolarHBondContact CG2-OD1 3.31Å; K24-N141 WeakPolarHBondContact CE-OD1 3.27Å; K24-N141 HydrophobicContact CG-CB 4.18Å; K24-N141 VanDerWaalsContact CG-OD1 3.25Å; K24-N141 WeakPolarHBondContact CG-OD1 3.34Å; R56-N141 HydrophobicContact CB-CB 4.31Å; R56-N141 PolarHBondContact N-O 2.78Å; R56-N141 PolarHBondContact O-N 2.84Å
142	L	91.4	Very high	84	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.4	-177.4	-173.8	68.9	0	0	0	109.8	T22 V23 I40 T41 L53 C55 L70 V118 F140 L144	T22-L142 CarbonylContact C-O 3.53Å; T22-L142 WeakPolarHBondContact CA-O 3.44Å; V23-L142 HydrophobicContact CB-CB 4.4Å; V23-L142 PolarHBondContact N-O 2.86Å; V23-L142 PolarHBondContact O-N 3.45Å; I40-L142 HydrophobicContact CG2-CD2 3.86Å; T41-L142 HydrophobicContact CG2-CD2 3.63Å; L53-L142 HydrophobicContact CD1-CD1 4.16Å; L53-L142 HydrophobicContact CD2-CD1 3.68Å; L53-L142 HydrophobicContact CG-CD1 3.82Å; C55-L142 HydrophobicContact CB-CD1 3.91Å; L70-L142 HydrophobicContact CD1-CD1 4.22Å; V118-L142 HydrophobicContact CG1-CD2 4.15Å; F140-L142 HydrophobicContact CD2-CB 4.05Å; F140-L142 HydrophobicContact CE2-CB 4.09Å; L142-L144 HydrophobicContact CG-CG 4.48Å
143	L	91.9	Very high	85.5	Confident	16 Å²	16	44.5 Å²	44.5	8%	0.084	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.9	179.2	-53.8	162	0	0	0	109.1	T22 V54 F145	T22-L143 HydrophobicContact CG2-CD2 3.49Å; T22-L143 VanDerWaalsContact CG2-CD2 3.49Å; T22-L143 VanDerWaalsContact OG1-CD2 3.32Å; T22-L143 WeakPolarHBondContact OG1-CD2 3.34Å; V54-L143 HydrophobicContact CB-CB 4.18Å; V54-L143 HydrophobicContact CB-CD1 4.35Å; V54-L143 HydrophobicContact CG1-CD1 4.19Å; V54-L143 PolarHBondContact N-O 2.64Å; V54-L143 PolarHBondContact O-N 3.08Å; L143-F145 HydrophobicContact CB-CD2 4.35Å; L143-F145 HydrophobicContact CB-CE2 3.45Å; L143-F145 VanDerWaalsContact CB-CE2 3.45Å; L143-F145 HydrophobicContact CB-CZ 3.74Å; L143-F145 HydrophobicContact CD1-CE2 4.34Å; L143-F145 HydrophobicContact CD1-CZ 4.25Å; L143-F145 HydrophobicContact CG-CE2 4.47Å; L143-F145 HydrophobicContact CG-CZ 4.44Å
144	L	90.9	Very high	86.7	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	-177.8	-62.4	154.2	0	0	0	109	T41 F43 Y45 L53 L142 H156	T41-L144 HydrophobicContact CG2-CD1 3.59Å; F43-L144 HydrophobicContact CB-CB 4.4Å; F43-L144 HydrophobicContact CB-CD1 3.7Å; F43-L144 HydrophobicContact CB-CD2 4.21Å; F43-L144 HydrophobicContact CB-CG 4.32Å; F43-L144 HydrophobicContact CD1-CB 4.29Å; F43-L144 HydrophobicContact CD2-CB 3.43Å; F43-L144 VanDerWaalsContact CD2-CB 3.43Å; F43-L144 HydrophobicContact CD2-CD1 3.82Å; F43-L144 HydrophobicContact CD2-CG 4.17Å; F43-L144 HydrophobicContact CE1-CB 4.44Å; F43-L144 HydrophobicContact CE2-CB 3.54Å; F43-L144 HydrophobicContact CG-CB 3.82Å; F43-L144 HydrophobicContact CG-CD1 4Å; F43-L144 HydrophobicContact CG-CD2 4.37Å; F43-L144 HydrophobicContact CG-CG 4.28Å; F43-L144 HydrophobicContact CZ-CB 4.09Å; Y45-L144 WeakPolarHBondContact OH-CD2 3.01Å; L53-L144 HydrophobicContact CB-CD2 4.3Å; L53-L144 HydrophobicContact CD1-CD2 3.7Å; L53-L144 HydrophobicContact CG-CD2 3.93Å; L142-L144 HydrophobicContact CG-CG 4.48Å; L144-H156 PolarHBondContact O-ND1 3.47Å
145	F	91.3	Very high	87.7	Confident	27 Å²	27	42.3 Å²	42.3	12%	0.118	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.3	-174.4	-56.5	-82.1	0	0	0	112.4	Y45 G51 L52 V54 L143 P153 D155 H156	Y45-F145 WeakPolarHBondContact CE1-O 3.18Å; G51-F145 WeakPolarHBondContact CA-O 3.32Å; L52-F145 HydrophobicContact CB-CB 4.28Å; L52-F145 HydrophobicContact CB-CD2 4.43Å; L52-F145 HydrophobicContact CD2-CD2 4.23Å; L52-F145 HydrophobicContact CG-CD2 4.47Å; L52-F145 PolarHBondContact N-O 2.99Å; L52-F145 PolarHBondContact O-N 2.92Å; V54-F145 HydrophobicContact CB-CE2 4.45Å; V54-F145 HydrophobicContact CG2-CD2 4.42Å; V54-F145 HydrophobicContact CG2-CE2 4.08Å; L143-F145 HydrophobicContact CB-CD2 4.35Å; L143-F145 HydrophobicContact CB-CE2 3.45Å; L143-F145 VanDerWaalsContact CB-CE2 3.45Å; L143-F145 HydrophobicContact CB-CZ 3.74Å; L143-F145 HydrophobicContact CD1-CE2 4.34Å; L143-F145 HydrophobicContact CD1-CZ 4.25Å; L143-F145 HydrophobicContact CG-CE2 4.47Å; L143-F145 HydrophobicContact CG-CZ 4.44Å; F145-P153 HydrophobicContact CB-CB 4.31Å; F145-P153 WeakPolarHBondContact CB-O 3.44Å; F145-D155 CarbonylContact C-O 3.27Å; F145-D155 WeakPolarHBondContact CA-O 3.42Å; F145-H156 AromaticContact CD1-CE1 3.84Å; F145-H156 AromaticContact CD1-ND1 3.96Å; F145-H156 AromaticContact CE1-CD2 3.85Å; F145-H156 AromaticContact CE1-CE1 3.13Å; F145-H156 WeakPolarHBondContact CE1-CE1 3.34Å; F145-H156 AromaticContact CE1-ND1 3.72Å; F145-H156 AromaticContact CE1-NE2 3.22Å; F145-H156 WeakPolarHBondContact CE1-NE2 3.25Å; F145-H156 AromaticContact CZ-CE1 3.57Å; F145-H156 AromaticContact CZ-NE2 3.91Å
146	N	91.2	Very high	88.5	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	162.4	163.5	-88.4	-42.8	0	0	0	110.6	F43 M44 Y45 Q46 L154 D155 F157	F43-N146 VanDerWaalsContact CE1-ND2 3.34Å; F43-N146 WeakPolarHBondContact CE1-ND2 3.39Å; F43-N146 HydrophobicContact CZ-CB 4.5Å; F43-N146 WeakPolarHBondContact CZ-ND2 3.38Å; M44-N146 PolarHBondContact O-ND2 2.95Å; Y45-N146 VanDerWaalsContact CA-OD1 3.27Å; Y45-N146 WeakPolarHBondContact CA-OD1 2.97Å; Y45-N146 WeakPolarHBondContact CD1-OD1 3.5Å; Q46-N146 HydrophobicContact CG-CB 4.29Å; Q46-N146 PolarHBondContact N-OD1 3.04Å; N146-L154 PolarHBondContact O-N 2.84Å; N146-D155 PolarHBondContact N-O 2.82Å; N146-D155 PolarHBondContact O-N 2.85Å; N146-D155 VanDerWaalsContact O-N 3.11Å; N146-F157 WeakPolarHBondContact CB-O 3.21Å; N146-F157 PolarHBondContact ND2-O 3.06Å
147	P	89.6	Confident	88.7	Confident	20 Å²	20	38 Å²	38	13%	0.13	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.1	174.4	26.6	-33.6	0	0	0	111.2	N152	P147-N152 CarbonylContact C-O 3.28Å; P147-N152 VanDerWaalsContact CA-O 3.31Å; P147-N152 WeakPolarHBondContact CA-O 3.25Å
148	D	85.6	Confident	88.7	Confident	49 Å²	49	34.1 Å²	34.1	26%	0.262	22%	0.218	S	C	.	.			trans	-74	-178.8	171.4	73.8	2.7	0	0	0	111.2	A150 G151 N152 D155	D148-A150 PolarHBondContact O-N 3.21Å; D148-A150 VanDerWaalsContact OD1-C 3.22Å; D148-A150 VanDerWaalsContact OD1-CA 3.25Å; D148-A150 WeakPolarHBondContact OD1-CA 3.43Å; D148-A150 WeakPolarHBondContact OD1-CB 3.21Å; D148-A150 PolarHBondContact OD1-N 3.37Å; D148-G151 PolarHBondContact O-N 3.16Å; D148-G151 PolarHBondContact OD1-N 3.22Å; D148-N152 PolarHBondContact N-O 3.25Å; D148-N152 PolarHBondContact OD1-N 2.83Å; D148-D155 HydrophobicContact CB-CB 4.44Å
149	S	81.6	Confident	88.4	Confident	141 Å²	141	34.4 Å²	34.4	99%	0.986	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-16	177.7	-56	0	0	0	0	114.2
150	A	84.8	Confident	88	Confident	76 Å²	76	36.9 Å²	36.9	63%	0.628	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	1.1	175	0	0	0	0	0	112.8	D148	D148-A150 PolarHBondContact O-N 3.21Å; D148-A150 VanDerWaalsContact OD1-C 3.22Å; D148-A150 VanDerWaalsContact OD1-CA 3.25Å; D148-A150 WeakPolarHBondContact OD1-CA 3.43Å; D148-A150 WeakPolarHBondContact OD1-CB 3.21Å; D148-A150 PolarHBondContact OD1-N 3.37Å
151	G	83.3	Confident	87.5	Confident	47 Å²	47	39.2 Å²	39.2	49%	0.485	24%	0.241	S	C	.	.	S	Bend	trans	84.2	9.5	-179.8	0	0	0	0	0	115	D148	D148-G151 PolarHBondContact O-N 3.16Å; D148-G151 PolarHBondContact OD1-N 3.22Å
152	N	88.1	Confident	87.1	Confident	78 Å²	78	38.8 Å²	38.8	42%	0.417	24%	0.241	S	C	.	.			trans	-90.3	140.1	179.2	-54.8	-64.9	0	0	0	111	P147 D148 L154	P147-N152 CarbonylContact C-O 3.28Å; P147-N152 VanDerWaalsContact CA-O 3.31Å; P147-N152 WeakPolarHBondContact CA-O 3.25Å; D148-N152 PolarHBondContact N-O 3.25Å; D148-N152 PolarHBondContact OD1-N 2.83Å; N152-L154 HydrophobicContact CB-CD1 3.96Å; N152-L154 HydrophobicContact CB-CG 4.04Å; N152-L154 PolarHBondContact O-N 3.02Å
153	P	87.1	Confident	86.8	Confident	46 Å²	46	40.7 Å²	40.7	30%	0.299	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	67.4	-178.7	33.1	-37.3	0	0	0	111.9	G50 L52 F145	G50-P153 WeakPolarHBondContact O-CB 3.38Å; L52-P153 HydrophobicContact CB-CB 3.76Å; L52-P153 HydrophobicContact CB-CG 4.45Å; L52-P153 HydrophobicContact CD2-CB 4.23Å; L52-P153 HydrophobicContact CD2-CG 4.2Å; F145-P153 HydrophobicContact CB-CB 4.31Å; F145-P153 WeakPolarHBondContact CB-O 3.44Å
154	L	87.9	Confident	86.6	Confident	110 Å²	110	41.3 Å²	41.3	58%	0.576	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	-10	-174.6	-64.2	176.9	0	0	0	113.1	N146 N152	N146-L154 PolarHBondContact O-N 2.84Å; N152-L154 HydrophobicContact CB-CD1 3.96Å; N152-L154 HydrophobicContact CB-CG 4.04Å; N152-L154 PolarHBondContact O-N 3.02Å
155	D	87.1	Confident	86.6	Confident	34 Å²	34	43.5 Å²	43.5	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121	-176.3	-168.6	1.2	0	0	0	110.8	F145 N146 D148 F157	F145-D155 CarbonylContact C-O 3.27Å; F145-D155 WeakPolarHBondContact CA-O 3.42Å; N146-D155 PolarHBondContact N-O 2.82Å; N146-D155 PolarHBondContact O-N 2.85Å; N146-D155 VanDerWaalsContact O-N 3.11Å; D148-D155 HydrophobicContact CB-CB 4.44Å; D155-F157 PolarHBondContact O-N 3.11Å; D155-F157 WeakPolarHBondContact OD1-CD2 3.35Å; D155-F157 PolarHBondContact OD1-N 3.16Å
156	H	89.1	Confident	86.5	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.042	29%	0.292	C	S	.	.			trans	-75.5	-8.6	175.4	-73.5	-80.7	0	0	0	113.3	K21 L144 F145 G228	K21-H156 WeakPolarHBondContact CD-O 3.19Å; L144-H156 PolarHBondContact O-ND1 3.47Å; F145-H156 AromaticContact CD1-CE1 3.84Å; F145-H156 AromaticContact CD1-ND1 3.96Å; F145-H156 AromaticContact CE1-CD2 3.85Å; F145-H156 AromaticContact CE1-CE1 3.13Å; F145-H156 WeakPolarHBondContact CE1-CE1 3.34Å; F145-H156 AromaticContact CE1-ND1 3.72Å; F145-H156 AromaticContact CE1-NE2 3.22Å; F145-H156 WeakPolarHBondContact CE1-NE2 3.25Å; F145-H156 AromaticContact CZ-CE1 3.57Å; F145-H156 AromaticContact CZ-NE2 3.91Å; H156-G228 PolarHBondContact CD2-N 2.8Å
157	F	87.7	Confident	86.6	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.035	30%	0.296	C	S	.	.			trans	-67.1	136.8	177.7	-71.7	-61.8	0	0	0	112.5	N146 D155 E161 A162 H165 L221 Y224 S225	N146-F157 WeakPolarHBondContact CB-O 3.21Å; N146-F157 PolarHBondContact ND2-O 3.06Å; D155-F157 PolarHBondContact O-N 3.11Å; D155-F157 WeakPolarHBondContact OD1-CD2 3.35Å; D155-F157 PolarHBondContact OD1-N 3.16Å; F157-E161 HydrophobicContact CD1-CB 3.91Å; F157-A162 HydrophobicContact CB-CB 4.48Å; F157-H165 HydrophobicContact CE2-CB 4.07Å; F157-H165 HydrophobicContact CZ-CB 4.02Å; F157-L221 HydrophobicContact CE1-CD2 3.76Å; F157-L221 HydrophobicContact CZ-CB 4.11Å; F157-L221 HydrophobicContact CZ-CD2 4.21Å; F157-L221 WeakPolarHBondContact CZ-O 3.05Å; F157-Y224 AromaticContact CD1-CD1 3.68Å; F157-Y224 HydrophobicContact CD1-CD1 3.68Å; F157-Y224 AromaticContact CD1-CE1 3.75Å; F157-Y224 HydrophobicContact CD1-CE1 3.75Å; F157-Y224 AromaticContact CE1-CD1 3.35Å; F157-Y224 HydrophobicContact CE1-CD1 3.35Å; F157-Y224 AromaticContact CE1-CE1 3.87Å; F157-Y224 HydrophobicContact CE1-CE1 3.87Å; F157-Y224 HydrophobicContact CE1-CG 4.3Å; F157-Y224 HydrophobicContact CZ-CD1 4.02Å; F157-S225 VanDerWaalsContact CE2-CB 3.45Å
158	S	86.9	Confident	86.8	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.021	29%	0.293	C	S	.	.			trans	-74.9	162.3	167.3	59.2	0	0	0	0	108.2	K21 M44 E160 E161 A162	K21-S158 WeakPolarHBondContact CE-OG 3.22Å; K21-S158 VanDerWaalsContact NZ-CB 3.28Å; K21-S158 PolarHBondContact NZ-OG 2.97Å; M44-S158 WeakPolarHBondContact O-CA 3.27Å; S158-E160 PolarHBondContact O-N 3.19Å; S158-E161 PolarHBondContact O-N 3.29Å; S158-A162 WeakPolarHBondContact O-CB 3.23Å; S158-A162 PolarHBondContact O-N 3.27Å
159	A	84.3	Confident	87.2	Confident	7 Å²	7	49.2 Å²	49.2	6%	0.058	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.7	176.8	0	0	0	0	0	113.4	M44 Q46 P113 K384	M44-A159 HydrophobicContact CB-CB 4.33Å; M44-A159 HydrophobicContact CG-CB 3.92Å; M44-A159 PolarHBondContact O-N 3.11Å; M44-A159 HydrophobicContact SD-CB 3.97Å; Q46-A159 HydrophobicContact CG-CB 3.9Å; P113-A159 HydrophobicContact CB-CB 3.98Å; A159-K384 PolarHBondContact O-NZ 3.11Å
160	E	82.2	Confident	87.9	Confident	61 Å²	61	47.4 Å²	47.4	29%	0.285	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-52.4	179.7	-63.8	172.1	118.3	0	0	111	M44 S158 H380 K384	M44-E160 HydrophobicContact CB-CG 4.38Å; M44-E160 HydrophobicContact CE-CG 3.82Å; M44-E160 WeakPolarHBondContact CE-OE1 3.33Å; M44-E160 HydrophobicContact SD-CG 3.71Å; S158-E160 PolarHBondContact O-N 3.19Å; E160-H380 WeakPolarHBondContact CA-O 3.31Å; E160-H380 HydrophobicContact CG-CB 4.09Å; E160-K384 WeakPolarHBondContact O-CD 3.34Å; E160-K384 PolarHBondContact O-NZ 3.26Å
161	E	82.8	Confident	88.3	Confident	59 Å²	59	44.4 Å²	44.4	28%	0.276	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.8	-179.2	-69.5	165.7	-137	0	0	113.8	K21 F157 S158 G163 L164 Y224	K21-E161 WeakPolarHBondContact CE-OE1 3.42Å; K21-E161 IonicContact NZ-OE1 3.12Å; K21-E161 PolarHBondContact NZ-OE1 3.27Å; K21-E161 IonicContact NZ-OE2 2.84Å; K21-E161 PolarHBondContact NZ-OE2 3.18Å; F157-E161 HydrophobicContact CD1-CB 3.91Å; S158-E161 PolarHBondContact O-N 3.29Å; E161-G163 PolarHBondContact O-N 2.89Å; E161-L164 WeakPolarHBondContact O-CB 3.13Å; E161-L164 PolarHBondContact O-N 2.98Å; E161-Y224 WeakPolarHBondContact OE2-CE1 3.14Å; E161-Y224 PolarHBondContact OE2-OH 3.35Å
162	A	84.5	Confident	88.9	Confident	21 Å²	21	43.9 Å²	43.9	17%	0.174	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	126.6	179.7	0	0	0	0	0	111.3	F157 S158 K384	F157-A162 HydrophobicContact CB-CB 4.48Å; S158-A162 WeakPolarHBondContact O-CB 3.23Å; S158-A162 PolarHBondContact O-N 3.27Å; A162-K384 WeakPolarHBondContact O-CD 3.25Å; A162-K384 PolarHBondContact O-NZ 3.44Å
163	G	85	Confident	89.3	Confident	41 Å²	41	44 Å²	44	42%	0.423	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-12.4	-177.6	0	0	0	0	0	115.2	E161 H165 S166 F167	E161-G163 PolarHBondContact O-N 2.89Å; G163-H165 PolarHBondContact O-N 2.92Å; G163-S166 PolarHBondContact O-N 2.83Å; G163-F167 PolarHBondContact O-N 3.07Å
164	L	88	Confident	89.6	Confident	28 Å²	28	44.1 Å²	44.1	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-37.9	-179.5	-164.7	67.5	0	0	0	112.1	E161 S166 F167 Y168 L221 T387 I388	E161-L164 WeakPolarHBondContact O-CB 3.13Å; E161-L164 PolarHBondContact O-N 2.98Å; L164-S166 PolarHBondContact O-N 2.8Å; L164-F167 HydrophobicContact CD1-CD1 4.19Å; L164-F167 WeakPolarHBondContact O-CB 3.4Å; L164-F167 PolarHBondContact O-N 2.76Å; L164-Y168 HydrophobicContact CD1-CD2 4.46Å; L164-Y168 HydrophobicContact CD1-CE2 4.01Å; L164-Y168 HydrophobicContact CD2-CE2 4.07Å; L164-Y168 HydrophobicContact CG-CD2 3.99Å; L164-Y168 HydrophobicContact CG-CE2 3.7Å; L164-Y168 VanDerWaalsContact O-CD2 3.28Å; L164-Y168 WeakPolarHBondContact O-CD2 3.43Å; L164-Y168 PolarHBondContact O-N 3.11Å; L164-L221 HydrophobicContact CB-CD1 4.31Å; L164-L221 HydrophobicContact CD2-CD1 3.99Å; L164-L221 HydrophobicContact CG-CD1 3.97Å; L164-T387 HydrophobicContact CD1-CG2 4.45Å; L164-I388 HydrophobicContact CD1-CG1 4.19Å
165	H	90	Very high	89.9	Confident	47 Å²	47	40.5 Å²	40.5	22%	0.218	23%	0.226	C	C	.	.	H	α-helix	trans	-56.7	-48.5	172.8	174.2	-105.4	0	0	0	112.2	F157 G163 F167 Y168 F169 Y218 L221	F157-H165 HydrophobicContact CE2-CB 4.07Å; F157-H165 HydrophobicContact CZ-CB 4.02Å; G163-H165 PolarHBondContact O-N 2.92Å; H165-F167 VanDerWaalsContact C-N 3.33Å; H165-F167 PolarHBondContact O-N 2.89Å; H165-Y168 PolarHBondContact O-N 2.9Å; H165-F169 PolarHBondContact O-N 3.27Å; H165-F169 VanDerWaalsContact O-N 3.07Å; H165-Y218 AromaticContact CD2-CD2 3.94Å; H165-Y218 AromaticContact CD2-CE2 3.82Å; H165-Y218 AromaticContact CE1-CE2 3.96Å; H165-Y218 AromaticContact NE2-CD2 3.88Å; H165-Y218 AromaticContact NE2-CE2 3.28Å; H165-Y218 VanDerWaalsContact NE2-CE2 3.28Å; H165-Y218 WeakPolarHBondContact NE2-CE2 3.44Å; H165-Y218 AromaticContact NE2-CZ 3.87Å; H165-L221 HydrophobicContact CB-CB 4.21Å
166	S	89.8	Confident	90.2	Very high	69 Å²	69	45.3 Å²	45.3	48%	0.483	25%	0.245	S	C	.	.	H	α-helix	trans	-65.4	-35.6	177.8	-60.1	0	0	0	0	112.4	G163 L164 F169 L170	G163-S166 PolarHBondContact O-N 2.83Å; L164-S166 PolarHBondContact O-N 2.8Å; S166-F169 PolarHBondContact O-N 3.42Å; S166-L170 WeakPolarHBondContact O-CG 3.48Å; S166-L170 PolarHBondContact O-N 2.79Å
167	F	93.4	Very high	90.4	Very high	22 Å²	22	49 Å²	49	10%	0.096	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-50.7	173.4	166	-103.8	0	0	0	111.9	G163 L164 H165 F169 L170 L171 I388 I391 L392	G163-F167 PolarHBondContact O-N 3.07Å; L164-F167 HydrophobicContact CD1-CD1 4.19Å; L164-F167 WeakPolarHBondContact O-CB 3.4Å; L164-F167 PolarHBondContact O-N 2.76Å; H165-F167 VanDerWaalsContact C-N 3.33Å; H165-F167 PolarHBondContact O-N 2.89Å; F167-F169 VanDerWaalsContact C-N 3.3Å; F167-F169 PolarHBondContact O-N 3.01Å; F167-L170 PolarHBondContact O-N 3.07Å; F167-L171 HydrophobicContact CE1-CD2 4.2Å; F167-L171 HydrophobicContact CZ-CD2 4.16Å; F167-L171 WeakPolarHBondContact O-CB 2.96Å; F167-L171 PolarHBondContact O-N 3.22Å; F167-I388 HydrophobicContact CB-CD1 4.26Å; F167-I388 HydrophobicContact CB-CG1 4.41Å; F167-I388 HydrophobicContact CD1-CG1 3.99Å; F167-I388 HydrophobicContact CD2-CB 4.45Å; F167-I388 HydrophobicContact CD2-CD1 4.44Å; F167-I388 HydrophobicContact CD2-CG1 4.06Å; F167-I388 HydrophobicContact CD2-CG2 3.84Å; F167-I388 HydrophobicContact CE1-CG1 4.28Å; F167-I388 HydrophobicContact CE2-CB 4.34Å; F167-I388 HydrophobicContact CE2-CG1 4.35Å; F167-I388 HydrophobicContact CE2-CG2 3.71Å; F167-I388 HydrophobicContact CG-CD1 4.21Å; F167-I388 HydrophobicContact CG-CG1 3.87Å; F167-I388 HydrophobicContact CZ-CB 4.47Å; F167-I388 HydrophobicContact CZ-CG1 4.44Å; F167-I388 HydrophobicContact CZ-CG2 4.27Å; F167-I391 HydrophobicContact CE1-CB 4.35Å; F167-I391 HydrophobicContact CE1-CD1 3.9Å; F167-I391 HydrophobicContact CE1-CG2 4.19Å; F167-I391 HydrophobicContact CZ-CB 4Å; F167-I391 HydrophobicContact CZ-CD1 4.42Å; F167-I391 HydrophobicContact CZ-CG2 3.81Å; F167-L392 HydrophobicContact CE2-CD1 4.19Å; F167-L392 HydrophobicContact CE2-CD2 3.94Å; F167-L392 HydrophobicContact CE2-CG 3.84Å; F167-L392 HydrophobicContact CZ-CG 4.28Å
168	Y	94.3	Very high	90.5	Very high	18 Å²	18	50.1 Å²	50.1	7%	0.071	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-36.4	178.9	-81	-69.9	0	0	0	112.4	L164 H165 L171 L172 A214 N217 L221 I391	L164-Y168 HydrophobicContact CD1-CD2 4.46Å; L164-Y168 HydrophobicContact CD1-CE2 4.01Å; L164-Y168 HydrophobicContact CD2-CE2 4.07Å; L164-Y168 HydrophobicContact CG-CD2 3.99Å; L164-Y168 HydrophobicContact CG-CE2 3.7Å; L164-Y168 VanDerWaalsContact O-CD2 3.28Å; L164-Y168 WeakPolarHBondContact O-CD2 3.43Å; L164-Y168 PolarHBondContact O-N 3.11Å; H165-Y168 PolarHBondContact O-N 2.9Å; Y168-L171 HydrophobicContact CD1-CD2 4.24Å; Y168-L171 HydrophobicContact CE1-CD2 4.48Å; Y168-L171 PolarHBondContact O-N 3.4Å; Y168-L172 WeakPolarHBondContact O-CB 2.93Å; Y168-L172 VanDerWaalsContact O-CG 3.28Å; Y168-L172 WeakPolarHBondContact O-CG 3.32Å; Y168-L172 PolarHBondContact O-N 3.24Å; Y168-A214 HydrophobicContact CD1-CB 3.98Å; Y168-A214 HydrophobicContact CE1-CB 4.29Å; Y168-N217 HydrophobicContact CD1-CB 4.11Å; Y168-N217 HydrophobicContact CD2-CB 4.21Å; Y168-N217 HydrophobicContact CE1-CB 3.82Å; Y168-N217 HydrophobicContact CE2-CB 3.89Å; Y168-N217 HydrophobicContact CG-CB 4.31Å; Y168-N217 PolarHBondContact OH-ND2 2.99Å; Y168-L221 HydrophobicContact CD2-CD1 3.49Å; Y168-L221 VanDerWaalsContact CD2-CD1 3.49Å; Y168-L221 HydrophobicContact CE2-CD1 3.79Å; Y168-I391 HydrophobicContact CE1-CD1 4.29Å
169	F	94.3	Very high	90.6	Very high	108 Å²	108	53.8 Å²	53.8	47%	0.474	30%	0.3	S	S	.	.	H	α-helix	trans	-58.4	-50.2	172	173.8	-102.1	0	0	0	112.1	H165 S166 F167 L171 L172 L173 Y218	H165-F169 PolarHBondContact O-N 3.27Å; H165-F169 VanDerWaalsContact O-N 3.07Å; S166-F169 PolarHBondContact O-N 3.42Å; F167-F169 VanDerWaalsContact C-N 3.3Å; F167-F169 PolarHBondContact O-N 3.01Å; F169-L171 VanDerWaalsContact C-N 3.34Å; F169-L171 PolarHBondContact O-N 3.48Å; F169-L172 PolarHBondContact O-N 2.87Å; F169-L173 PolarHBondContact O-N 3.46Å; F169-Y218 HydrophobicContact CB-CD2 4.2Å; F169-Y218 HydrophobicContact CB-CE2 3.86Å; F169-Y218 HydrophobicContact CD2-CE2 4.18Å; F169-Y218 HydrophobicContact CG-CE2 4.49Å
170	L	95.5	Very high	91	Very high	104 Å²	104	57.3 Å²	57.3	55%	0.545	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-38.3	178.5	-69.6	173.3	0	0	0	112.1	S166 F167 L173 A174	S166-L170 WeakPolarHBondContact O-CG 3.48Å; S166-L170 PolarHBondContact O-N 2.79Å; F167-L170 PolarHBondContact O-N 3.07Å; L170-L173 PolarHBondContact O-N 2.97Å; L170-A174 WeakPolarHBondContact O-CB 3.01Å; L170-A174 PolarHBondContact O-N 2.94Å
171	L	94.1	Very high	91.3	Very high	12 Å²	12	59.4 Å²	59.4	6%	0.063	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-46.2	176.2	-177.9	65.8	0	0	0	111.4	F167 Y168 F169 L173 A174 Y175 A214 I391	F167-L171 HydrophobicContact CE1-CD2 4.2Å; F167-L171 HydrophobicContact CZ-CD2 4.16Å; F167-L171 WeakPolarHBondContact O-CB 2.96Å; F167-L171 PolarHBondContact O-N 3.22Å; Y168-L171 HydrophobicContact CD1-CD2 4.24Å; Y168-L171 HydrophobicContact CE1-CD2 4.48Å; Y168-L171 PolarHBondContact O-N 3.4Å; F169-L171 VanDerWaalsContact C-N 3.34Å; F169-L171 PolarHBondContact O-N 3.48Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 2.85Å; L171-A174 WeakPolarHBondContact O-CB 3.44Å; L171-A174 PolarHBondContact O-N 3.1Å; L171-Y175 HydrophobicContact CD1-CD1 4.32Å; L171-Y175 HydrophobicContact CD1-CE1 3.78Å; L171-Y175 HydrophobicContact CD1-CE2 4.43Å; L171-Y175 HydrophobicContact CG-CE1 4.38Å; L171-Y175 HydrophobicContact CG-CE2 4.22Å; L171-Y175 PolarHBondContact O-N 3.22Å; L171-A214 HydrophobicContact CD2-CB 4.08Å; L171-I391 HydrophobicContact CD1-CG2 4.38Å; L171-I391 HydrophobicContact CD2-CG2 3.56Å
172	L	96	Very high	91.4	Very high	37 Å²	37	59.8 Å²	59.8	19%	0.194	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-40.9	176.1	-74.7	169	0	0	0	111.8	Y168 F169 A174 Y175 F176 A214 L215 Y218	Y168-L172 WeakPolarHBondContact O-CB 2.93Å; Y168-L172 VanDerWaalsContact O-CG 3.28Å; Y168-L172 WeakPolarHBondContact O-CG 3.32Å; Y168-L172 PolarHBondContact O-N 3.24Å; F169-L172 PolarHBondContact O-N 2.87Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-Y175 PolarHBondContact O-N 2.69Å; L172-F176 WeakPolarHBondContact O-CB 3.26Å; L172-F176 PolarHBondContact O-N 3.45Å; L172-A214 HydrophobicContact CD2-CB 4.01Å; L172-A214 HydrophobicContact CG-CB 4.38Å; L172-L215 HydrophobicContact CD1-CD1 4.17Å; L172-L215 HydrophobicContact CD2-CB 4.1Å; L172-Y218 HydrophobicContact CD1-CD1 4.21Å; L172-Y218 HydrophobicContact CD1-CD2 4.45Å; L172-Y218 HydrophobicContact CD1-CG 3.83Å
173	L	95.4	Very high	91.6	Very high	79 Å²	79	65.2 Å²	65.2	41%	0.414	36%	0.355	S	S	.	.	H	α-helix	trans	-60.6	-45.1	173.9	179.4	62.4	0	0	0	111.3	F169 L170 L171 F176 I177	F169-L173 PolarHBondContact O-N 3.46Å; L170-L173 PolarHBondContact O-N 2.97Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 2.85Å; L173-F176 PolarHBondContact O-N 3.39Å; L173-I177 HydrophobicContact CD1-CD1 4.21Å; L173-I177 HydrophobicContact CD1-CG1 4.49Å; L173-I177 HydrophobicContact CG-CD1 4.08Å; L173-I177 VanDerWaalsContact O-CG1 3.31Å; L173-I177 WeakPolarHBondContact O-CG1 3.16Å; L173-I177 PolarHBondContact O-N 2.68Å
174	A	93.4	Very high	91.7	Very high	50 Å²	50	70 Å²	70	41%	0.413	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-42.6	176.6	0	0	0	0	0	112	L170 L171 L172 I177 A178	L170-A174 WeakPolarHBondContact O-CB 3.01Å; L170-A174 PolarHBondContact O-N 2.94Å; L171-A174 WeakPolarHBondContact O-CB 3.44Å; L171-A174 PolarHBondContact O-N 3.1Å; L172-A174 VanDerWaalsContact C-N 3.35Å; A174-I177 PolarHBondContact O-N 2.97Å; A174-A178 WeakPolarHBondContact O-CB 3.08Å; A174-A178 PolarHBondContact O-N 3.35Å
175	Y	93.2	Very high	91.5	Very high	33 Å²	33	71.6 Å²	71.6	13%	0.129	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-41.3	174.6	-76	-0.7	0	0	0	112.2	L171 L172 A178 C179 Q210 S395	L171-Y175 HydrophobicContact CD1-CD1 4.32Å; L171-Y175 HydrophobicContact CD1-CE1 3.78Å; L171-Y175 HydrophobicContact CD1-CE2 4.43Å; L171-Y175 HydrophobicContact CG-CE1 4.38Å; L171-Y175 HydrophobicContact CG-CE2 4.22Å; L171-Y175 PolarHBondContact O-N 3.22Å; L172-Y175 PolarHBondContact O-N 2.69Å; Y175-A178 PolarHBondContact O-N 3.01Å; Y175-C179 WeakPolarHBondContact O-CB 3.16Å; Y175-C179 PolarHBondContact O-N 3.4Å; Y175-C179 PolarHBondContact O-SG 2.84Å; Y175-Q210 PolarHBondContact OH-OE1 3.13Å; Y175-S395 PolarHBondContact OH-OG 3.47Å
176	F	93.6	Very high	91.2	Very high	136 Å²	136	70.5 Å²	70.5	60%	0.596	37%	0.374	S	S	*	.	H	α-helix	trans	-60.6	-48.7	175.6	178.6	-101.3	0	0	0	111.5	L172 L173 A178 C179 C180	L172-F176 WeakPolarHBondContact O-CB 3.26Å; L172-F176 PolarHBondContact O-N 3.45Å; L173-F176 PolarHBondContact O-N 3.39Å; F176-A178 PolarHBondContact O-N 2.77Å; F176-C179 WeakPolarHBondContact O-CB 3.23Å; F176-C179 PolarHBondContact O-N 3.41Å; F176-C180 PolarHBondContact O-N 3.43Å; F176-C180 PolarHBondContact O-SG 3.46Å; F176-C180 VanDerWaalsContact O-SG 3.36Å
177	I	93.1	Very high	91.1	Very high	85 Å²	85	73.5 Å²	73.5	44%	0.436	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-46.6	177	-66.7	166.1	0	0	0	110.7	L173 A174 C179 C180 I181	L173-I177 HydrophobicContact CD1-CD1 4.21Å; L173-I177 HydrophobicContact CD1-CG1 4.49Å; L173-I177 HydrophobicContact CG-CD1 4.08Å; L173-I177 VanDerWaalsContact O-CG1 3.31Å; L173-I177 WeakPolarHBondContact O-CG1 3.16Å; L173-I177 PolarHBondContact O-N 2.68Å; A174-I177 PolarHBondContact O-N 2.97Å; I177-C179 VanDerWaalsContact C-N 3.34Å; I177-C179 PolarHBondContact O-N 3.23Å; I177-C180 WeakPolarHBondContact O-CB 3.38Å; I177-C180 PolarHBondContact O-N 2.88Å; I177-I181 HydrophobicContact CG2-CD1 3.84Å; I177-I181 WeakPolarHBondContact O-CG1 3.25Å; I177-I181 PolarHBondContact O-N 2.86Å
178	A	89.8	Confident	90.6	Very high	33 Å²	33	77.4 Å²	77.4	27%	0.273	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-43.1	177.7	0	0	0	0	0	111.7	A174 Y175 F176 C180 I181 Y182	A174-A178 WeakPolarHBondContact O-CB 3.08Å; A174-A178 PolarHBondContact O-N 3.35Å; Y175-A178 PolarHBondContact O-N 3.01Å; F176-A178 PolarHBondContact O-N 2.77Å; A178-C180 PolarHBondContact O-N 2.91Å; A178-I181 PolarHBondContact O-N 3.31Å; A178-Y182 HydrophobicContact CB-CD2 4.47Å; A178-Y182 WeakPolarHBondContact O-CB 3.42Å; A178-Y182 VanDerWaalsContact O-CD2 3.28Å; A178-Y182 WeakPolarHBondContact O-CD2 3.23Å; A178-Y182 PolarHBondContact O-N 2.96Å
179	C	90.6	Very high	89.9	Confident	79 Å²	79	77.3 Å²	77.3	53%	0.534	40%	0.397	S	S	.	.	H	α-helix	trans	-57.1	-47.8	173.9	-77.5	0	0	0	0	111.1	Y175 F176 I177 I181 Y182 F183	Y175-C179 WeakPolarHBondContact O-CB 3.16Å; Y175-C179 PolarHBondContact O-N 3.4Å; Y175-C179 PolarHBondContact O-SG 2.84Å; F176-C179 WeakPolarHBondContact O-CB 3.23Å; F176-C179 PolarHBondContact O-N 3.41Å; I177-C179 VanDerWaalsContact C-N 3.34Å; I177-C179 PolarHBondContact O-N 3.23Å; C179-I181 VanDerWaalsContact C-N 3.32Å; C179-I181 PolarHBondContact O-N 3.38Å; C179-Y182 PolarHBondContact O-N 3.27Å; C179-F183 WeakPolarHBondContact O-CA 3.4Å; C179-F183 WeakPolarHBondContact O-CB 3.24Å; C179-F183 PolarHBondContact O-N 3.22Å
180	C	91.3	Very high	89.3	Confident	81 Å²	81	74.5 Å²	74.5	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-42	177.3	-67.5	0	0	0	0	112.8	F176 I177 A178	F176-C180 PolarHBondContact O-N 3.43Å; F176-C180 PolarHBondContact O-SG 3.46Å; F176-C180 VanDerWaalsContact O-SG 3.36Å; I177-C180 WeakPolarHBondContact O-CB 3.38Å; I177-C180 PolarHBondContact O-N 2.88Å; A178-C180 PolarHBondContact O-N 2.91Å
181	I	89.5	Confident	88.7	Confident	106 Å²	106	77 Å²	77	54%	0.544	39%	0.393	S	S	.	.	H	α-helix	trans	-69.8	-44.5	-179.5	-65.6	167.2	0	0	0	111.4	I177 A178 C179	I177-I181 HydrophobicContact CG2-CD1 3.84Å; I177-I181 WeakPolarHBondContact O-CG1 3.25Å; I177-I181 PolarHBondContact O-N 2.86Å; A178-I181 PolarHBondContact O-N 3.31Å; C179-I181 VanDerWaalsContact C-N 3.32Å; C179-I181 PolarHBondContact O-N 3.38Å
182	Y	85.6	Confident	87.7	Confident	67 Å²	67	82 Å²	82	26%	0.263	41%	0.414	S	S	.	.	H	α-helix	trans	-95.9	-7.5	-170.4	-69.8	-70.2	0	0	0	114.8	A178 C179 Q184 P185 L186 Y402 Q403 L406	A178-Y182 HydrophobicContact CB-CD2 4.47Å; A178-Y182 WeakPolarHBondContact O-CB 3.42Å; A178-Y182 VanDerWaalsContact O-CD2 3.28Å; A178-Y182 WeakPolarHBondContact O-CD2 3.23Å; A178-Y182 PolarHBondContact O-N 2.96Å; C179-Y182 PolarHBondContact O-N 3.27Å; Y182-Q184 PolarHBondContact O-N 3.42Å; Y182-P185 WeakPolarHBondContact O-CD 3.49Å; Y182-L186 WeakPolarHBondContact O-CB 3.4Å; Y182-L186 PolarHBondContact O-N 2.97Å; Y182-Y402 HydrophobicContact CD1-CE1 4.23Å; Y182-Y402 HydrophobicContact CG-CE1 4.2Å; Y182-Q403 PolarHBondContact OH-NE2 3.15Å; Y182-L406 HydrophobicContact CD1-CD1 4.36Å
183	F	87.3	Confident	86.4	Confident	135 Å²	135	82.3 Å²	82.3	59%	0.592	43%	0.426	S	S	*	.	H	α-helix	trans	-57.4	-50.2	-177.3	-178.8	-100.6	0	0	0	112.9	C179 L186 Y187	C179-F183 WeakPolarHBondContact O-CA 3.4Å; C179-F183 WeakPolarHBondContact O-CB 3.24Å; C179-F183 PolarHBondContact O-N 3.22Å; F183-L186 PolarHBondContact O-N 3.29Å; F183-Y187 VanDerWaalsContact O-CB 3.29Å; F183-Y187 WeakPolarHBondContact O-CB 3.32Å; F183-Y187 PolarHBondContact O-N 2.87Å
184	Q	86.6	Confident	85.1	Confident	142 Å²	142	80.6 Å²	80.6	66%	0.664	43%	0.427	S	S	*	.	H	α-helix	trans	-64.2	-52.1	-178.2	-75.4	-173.3	-12.3	0	0	112.7	Y182 L186 Y187 Q188	Y182-Q184 PolarHBondContact O-N 3.42Å; Q184-L186 VanDerWaalsContact C-N 3.3Å; Q184-L186 PolarHBondContact O-N 2.96Å; Q184-Y187 PolarHBondContact O-N 3.49Å; Q184-Q188 WeakPolarHBondContact O-CG 3.47Å; Q184-Q188 PolarHBondContact O-N 3.2Å; Q184-Q188 VanDerWaalsContact O-N 3.13Å
185	P	84.3	Confident	83.7	Confident	61 Å²	61	81.2 Å²	81.2	40%	0.396	43%	0.427	S	S	.	.	H	α-helix	trans	-56.7	-41.8	175.2	-25.8	32.8	0	0	0	113.2	Y182 A189	Y182-P185 WeakPolarHBondContact O-CD 3.49Å; P185-A189 WeakPolarHBondContact O-CB 3.46Å; P185-A189 PolarHBondContact O-N 3.42Å
186	L	84.6	Confident	82.7	Confident	23 Å²	23	80.3 Å²	80.3	12%	0.12	42%	0.424	C	S	.	.	H	α-helix	trans	-64.1	-50.2	179.4	177.1	58.4	0	0	0	111.7	Y182 F183 Q184 Q188 A189 L190 T204 Y402	Y182-L186 WeakPolarHBondContact O-CB 3.4Å; Y182-L186 PolarHBondContact O-N 2.97Å; F183-L186 PolarHBondContact O-N 3.29Å; Q184-L186 VanDerWaalsContact C-N 3.3Å; Q184-L186 PolarHBondContact O-N 2.96Å; L186-Q188 PolarHBondContact O-N 3.07Å; L186-A189 PolarHBondContact O-N 2.96Å; L186-A189 VanDerWaalsContact O-N 3.12Å; L186-L190 HydrophobicContact CD1-CD1 3.69Å; L186-L190 HydrophobicContact CD1-CD2 4.41Å; L186-L190 HydrophobicContact CD1-CG 3.76Å; L186-L190 HydrophobicContact CD2-CD1 4.28Å; L186-L190 HydrophobicContact CG-CD1 3.81Å; L186-L190 HydrophobicContact CG-CG 4.27Å; L186-L190 WeakPolarHBondContact O-CG 3.46Å; L186-L190 PolarHBondContact O-N 3.46Å; L186-T204 HydrophobicContact CD2-CG2 3.77Å; L186-Y402 WeakPolarHBondContact CB-OH 3.45Å; L186-Y402 HydrophobicContact CD1-CE2 4.25Å; L186-Y402 WeakPolarHBondContact CD1-OH 3.17Å; L186-Y402 WeakPolarHBondContact CD2-OH 3.29Å; L186-Y402 WeakPolarHBondContact CG-OH 3.4Å
187	Y	86.6	Confident	81.9	Confident	132 Å²	132	76.9 Å²	76.9	52%	0.518	41%	0.41	S	S	.	.	H	α-helix	trans	-58.8	-42.1	-177.9	179.5	-97.8	0	0	0	110.9	F183 Q184 K191	F183-Y187 VanDerWaalsContact O-CB 3.29Å; F183-Y187 WeakPolarHBondContact O-CB 3.32Å; F183-Y187 PolarHBondContact O-N 2.87Å; Q184-Y187 PolarHBondContact O-N 3.49Å; Y187-K191 HydrophobicContact CE1-CD 4.11Å; Y187-K191 VanDerWaalsContact O-CB 3.26Å; Y187-K191 WeakPolarHBondContact O-CB 3.41Å; Y187-K191 PolarHBondContact O-N 3.39Å
188	Q	84.3	Confident	81.3	Confident	104 Å²	104	77 Å²	77	49%	0.486	42%	0.415	S	S	.	.	H	α-helix	trans	-64.5	-46	174.7	-67.3	177.9	12.4	0	0	111.8	Q184 L186 L190 K191 K192	Q184-Q188 WeakPolarHBondContact O-CG 3.47Å; Q184-Q188 PolarHBondContact O-N 3.2Å; Q184-Q188 VanDerWaalsContact O-N 3.13Å; L186-Q188 PolarHBondContact O-N 3.07Å; Q188-L190 VanDerWaalsContact C-N 3.34Å; Q188-L190 PolarHBondContact O-N 3.22Å; Q188-K191 PolarHBondContact O-N 3.22Å; Q188-K192 VanDerWaalsContact O-CB 3.31Å; Q188-K192 WeakPolarHBondContact O-CB 3.46Å; Q188-K192 WeakPolarHBondContact O-CG 3.32Å; Q188-K192 PolarHBondContact O-N 3.27Å
189	A	79.4	Confident	81	Confident	16 Å²	16	76 Å²	76	13%	0.132	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-38.8	179.2	0	0	0	0	0	112.8	P185 L186 L200 L406	P185-A189 WeakPolarHBondContact O-CB 3.46Å; P185-A189 PolarHBondContact O-N 3.42Å; L186-A189 PolarHBondContact O-N 2.96Å; L186-A189 VanDerWaalsContact O-N 3.12Å; A189-L200 HydrophobicContact CB-CD1 4.21Å; A189-L406 HydrophobicContact CB-CD2 3.77Å
190	L	81.1	Confident	80.8	Confident	49 Å²	49	72.3 Å²	72.3	26%	0.257	38%	0.38	S	S	.	.	H	α-helix	trans	-70.6	-44.9	176.2	-70.6	174.3	0	0	0	111.8	L186 Q188 K192 G193 H197 L200	L186-L190 HydrophobicContact CD1-CD1 3.69Å; L186-L190 HydrophobicContact CD1-CD2 4.41Å; L186-L190 HydrophobicContact CD1-CG 3.76Å; L186-L190 HydrophobicContact CD2-CD1 4.28Å; L186-L190 HydrophobicContact CG-CD1 3.81Å; L186-L190 HydrophobicContact CG-CG 4.27Å; L186-L190 WeakPolarHBondContact O-CG 3.46Å; L186-L190 PolarHBondContact O-N 3.46Å; Q188-L190 VanDerWaalsContact C-N 3.34Å; Q188-L190 PolarHBondContact O-N 3.22Å; L190-K192 PolarHBondContact O-N 3.36Å; L190-G193 PolarHBondContact O-N 3.11Å; L190-H197 PolarHBondContact O-CD2 3.08Å; L190-H197 VanDerWaalsContact O-CD2 3.28Å; L190-H197 PolarHBondContact O-NE2 2.82Å; L190-L200 HydrophobicContact CD2-CB 4.27Å
191	K	83.1	Confident	80.6	Confident	158 Å²	158	74.5 Å²	74.5	69%	0.687	38%	0.38	S	S	*	.	H	α-helix	trans	-65.7	-38.3	-179.3	-175.2	176.6	179.5	178.5	0	112.7	Y187 Q188 G193	Y187-K191 HydrophobicContact CE1-CD 4.11Å; Y187-K191 VanDerWaalsContact O-CB 3.26Å; Y187-K191 WeakPolarHBondContact O-CB 3.41Å; Y187-K191 PolarHBondContact O-N 3.39Å; Q188-K191 PolarHBondContact O-N 3.22Å; K191-G193 VanDerWaalsContact C-N 3.31Å; K191-G193 PolarHBondContact O-N 3.02Å
192	K	73.9	Confident	80.6	Confident	117 Å²	117	71.4 Å²	71.4	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-29.7	-177.8	-74.3	176	178.6	-167.1	0	112.6	Q188 L190 E413	Q188-K192 VanDerWaalsContact O-CB 3.31Å; Q188-K192 WeakPolarHBondContact O-CB 3.46Å; Q188-K192 WeakPolarHBondContact O-CG 3.32Å; Q188-K192 PolarHBondContact O-N 3.27Å; L190-K192 PolarHBondContact O-N 3.36Å; K192-E413 IonicContact NZ-OE1 2.78Å; K192-E413 PolarHBondContact NZ-OE1 3.44Å; K192-E413 IonicContact NZ-OE2 3.37Å; K192-E413 PolarHBondContact NZ-OE2 2.96Å
193	G	66.7	Low	80.8	Confident	42 Å²	42	68.3 Å²	68.3	43%	0.433	35%	0.354	S	S	.	.			trans	69.1	157	-171.9	0	0	0	0	0	112.1	L190 K191	L190-G193 PolarHBondContact O-N 3.11Å; K191-G193 VanDerWaalsContact C-N 3.31Å; K191-G193 PolarHBondContact O-N 3.02Å
194	G	68.3	Low	81	Confident	43 Å²	43	63.6 Å²	63.6	44%	0.443	34%	0.337	S	S	.	.			trans	174.3	172	-177.8	0	0	0	0	0	111.2	M196 H197	G194-M196 PolarHBondContact O-N 3.24Å; G194-M196 VanDerWaalsContact O-N 3.15Å; G194-H197 WeakPolarHBondContact O-CB 3.42Å; G194-H197 PolarHBondContact O-N 3.47Å
195	P	64.4	Low	81.2	Confident	64 Å²	64	60.4 Å²	60.4	42%	0.416	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.1	-177.9	26.5	-34.6	0	0	0	113	L273	P195-L273 HydrophobicContact CB-CB 3.59Å; P195-L273 HydrophobicContact CB-CD1 3.42Å; P195-L273 VanDerWaalsContact CB-CD1 3.42Å; P195-L273 HydrophobicContact CB-CG 4.11Å; P195-L273 HydrophobicContact CG-CD1 3.56Å
196	M	72.5	Confident	81.6	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.069	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.9	176.6	-61.8	-61.3	153.8	0	0	113.7	G194 T198 V199 L200 W260 L273 F405	G194-M196 PolarHBondContact O-N 3.24Å; G194-M196 VanDerWaalsContact O-N 3.15Å; M196-T198 PolarHBondContact O-N 3.01Å; M196-V199 WeakPolarHBondContact O-CB 3.32Å; M196-V199 PolarHBondContact O-N 3.46Å; M196-V199 HydrophobicContact SD-CG2 4.41Å; M196-L200 PolarHBondContact O-N 3.07Å; M196-W260 HydrophobicContact CE-CZ2 4.11Å; M196-L273 HydrophobicContact CE-CD1 4.14Å; M196-L273 HydrophobicContact CE-CD2 4Å; M196-F405 HydrophobicContact SD-CD1 4.11Å; M196-F405 HydrophobicContact SD-CE1 4.4Å
197	H	76.5	Confident	82	Confident	64 Å²	64	58.9 Å²	58.9	30%	0.296	32%	0.315	S	S	.	.	H	α-helix	trans	-59.8	-43.6	-175.6	175.4	-91.2	0	0	0	112.7	L190 G194 V199 L200 K201	L190-H197 PolarHBondContact O-CD2 3.08Å; L190-H197 VanDerWaalsContact O-CD2 3.28Å; L190-H197 PolarHBondContact O-NE2 2.82Å; G194-H197 WeakPolarHBondContact O-CB 3.42Å; G194-H197 PolarHBondContact O-N 3.47Å; H197-V199 VanDerWaalsContact C-N 3.31Å; H197-V199 PolarHBondContact O-N 2.84Å; H197-L200 PolarHBondContact O-N 3.14Å; H197-K201 WeakPolarHBondContact O-CB 3.3Å; H197-K201 PolarHBondContact O-N 3.48Å
198	T	81.1	Confident	82.4	Confident	88 Å²	88	55.2 Å²	55.2	54%	0.54	31%	0.312	S	S	.	.	H	α-helix	trans	-62.5	-40.1	177.9	-54.1	0	0	0	0	111.7	M196 K201 V202	M196-T198 PolarHBondContact O-N 3.01Å; T198-K201 PolarHBondContact O-N 3.28Å; T198-V202 WeakPolarHBondContact O-CG2 3.44Å; T198-V202 PolarHBondContact O-N 3.44Å
199	V	84.4	Confident	82.9	Confident	10 Å²	10	52 Å²	52	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-49.1	178.6	-178.3	0	0	0	0	110.3	M196 H197 K201 V202 L203 M252 L256 F405	M196-V199 WeakPolarHBondContact O-CB 3.32Å; M196-V199 PolarHBondContact O-N 3.46Å; M196-V199 HydrophobicContact SD-CG2 4.41Å; H197-V199 VanDerWaalsContact C-N 3.31Å; H197-V199 PolarHBondContact O-N 2.84Å; V199-K201 VanDerWaalsContact C-N 3.28Å; V199-K201 PolarHBondContact O-N 2.85Å; V199-V202 PolarHBondContact O-N 2.89Å; V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 3.29Å; V199-M252 HydrophobicContact CG1-CG 4.33Å; V199-M252 HydrophobicContact CG1-SD 3.8Å; V199-L256 HydrophobicContact CG1-CD1 3.96Å; V199-L256 HydrophobicContact CG2-CD1 4.45Å; V199-L256 HydrophobicContact CG2-CD2 3.8Å; V199-F405 HydrophobicContact CG1-CD1 4.16Å; V199-F405 HydrophobicContact CG1-CD2 3.79Å; V199-F405 HydrophobicContact CG1-CE1 4.04Å; V199-F405 HydrophobicContact CG1-CE2 3.68Å; V199-F405 HydrophobicContact CG1-CG 4.07Å; V199-F405 HydrophobicContact CG1-CZ 3.83Å
200	L	85.6	Confident	83.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-37.5	177.3	-72.6	172.1	0	0	0	112	A189 L190 M196 H197 T204 F405 L406	A189-L200 HydrophobicContact CB-CD1 4.21Å; L190-L200 HydrophobicContact CD2-CB 4.27Å; M196-L200 PolarHBondContact O-N 3.07Å; H197-L200 PolarHBondContact O-N 3.14Å; L200-T204 VanDerWaalsContact O-CB 3.26Å; L200-T204 WeakPolarHBondContact O-CB 3.28Å; L200-T204 PolarHBondContact O-N 2.98Å; L200-T204 PolarHBondContact O-OG1 3.17Å; L200-F405 HydrophobicContact CD2-CB 3.73Å; L200-F405 HydrophobicContact CG-CB 4.32Å; L200-L406 HydrophobicContact CD1-CD2 4.15Å; L200-L406 HydrophobicContact CD2-CD2 4.04Å; L200-L406 HydrophobicContact CD2-CG 4.22Å
201	K	87.3	Confident	84.3	Confident	126 Å²	126	50 Å²	50	55%	0.548	29%	0.29	S	S	.	.	H	α-helix	trans	-63.4	-50.8	175.1	-174	178.1	178.6	-179.9	0	111.4	H197 T198 V199 T204 T205	H197-K201 WeakPolarHBondContact O-CB 3.3Å; H197-K201 PolarHBondContact O-N 3.48Å; T198-K201 PolarHBondContact O-N 3.28Å; V199-K201 VanDerWaalsContact C-N 3.28Å; V199-K201 PolarHBondContact O-N 2.85Å; K201-T204 PolarHBondContact O-N 3.08Å; K201-T205 PolarHBondContact O-N 2.82Å; K201-T205 PolarHBondContact O-OG1 2.8Å
202	V	88.9	Confident	84.9	Confident	42 Å²	42	45 Å²	45	26%	0.255	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-46	179.1	174.6	0	0	0	0	110.9	T198 V199 T204 T205 A206 M252	T198-V202 WeakPolarHBondContact O-CG2 3.44Å; T198-V202 PolarHBondContact O-N 3.44Å; V199-V202 PolarHBondContact O-N 2.89Å; V202-T204 VanDerWaalsContact C-N 3.35Å; V202-T204 PolarHBondContact O-N 2.94Å; V202-T205 PolarHBondContact O-N 3.33Å; V202-A206 WeakPolarHBondContact O-CB 3.3Å; V202-A206 PolarHBondContact O-N 2.98Å; V202-M252 HydrophobicContact CB-SD 4.45Å; V202-M252 HydrophobicContact CG1-CB 3.96Å; V202-M252 HydrophobicContact CG1-CG 4.26Å; V202-M252 HydrophobicContact CG1-SD 4.28Å
203	L	89.4	Confident	86	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-40.3	178.6	-174.7	58	0	0	0	112.3	V199 A206 L207 M249 M252 M398 L401 Y402 F405	V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 3.29Å; L203-A206 PolarHBondContact O-N 3.46Å; L203-L207 WeakPolarHBondContact O-CB 3.37Å; L203-L207 PolarHBondContact O-N 3.18Å; L203-M249 HydrophobicContact CD1-CE 4.01Å; L203-M249 HydrophobicContact CD1-SD 3.56Å; L203-M249 VanDerWaalsContact CD1-SD 3.56Å; L203-M252 HydrophobicContact CB-SD 4.01Å; L203-M252 HydrophobicContact CD1-CE 4.19Å; L203-M398 HydrophobicContact CD1-SD 3.69Å; L203-L401 HydrophobicContact CD2-CB 4.35Å; L203-Y402 HydrophobicContact CD2-CD2 3.63Å; L203-Y402 HydrophobicContact CD2-CG 4.21Å; L203-Y402 HydrophobicContact CG-CD2 3.94Å; L203-F405 HydrophobicContact CD2-CD2 4.13Å
204	T	91.8	Very high	87.3	Confident	37 Å²	37	37.8 Å²	37.8	23%	0.227	23%	0.232	C	C	.	.	H	α-helix	trans	-66.7	-41.8	175.5	-56.7	0	0	0	0	111.3	L186 L200 K201 V202 L207 A208	L186-T204 HydrophobicContact CD2-CG2 3.77Å; L200-T204 VanDerWaalsContact O-CB 3.26Å; L200-T204 WeakPolarHBondContact O-CB 3.28Å; L200-T204 PolarHBondContact O-N 2.98Å; L200-T204 PolarHBondContact O-OG1 3.17Å; K201-T204 PolarHBondContact O-N 3.08Å; V202-T204 VanDerWaalsContact C-N 3.35Å; V202-T204 PolarHBondContact O-N 2.94Å; T204-L207 PolarHBondContact O-N 3.32Å; T204-A208 WeakPolarHBondContact O-CB 3.28Å; T204-A208 PolarHBondContact O-N 2.86Å
205	T	91.7	Very high	88.7	Confident	74 Å²	74	39.7 Å²	39.7	45%	0.454	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-43.4	175.8	-60	0	0	0	0	111.5	K201 V202 A208 L209	K201-T205 PolarHBondContact O-N 2.82Å; K201-T205 PolarHBondContact O-OG1 2.8Å; V202-T205 PolarHBondContact O-N 3.33Å; T205-A208 PolarHBondContact O-N 3.42Å; T205-L209 HydrophobicContact CG2-CD1 4.24Å; T205-L209 WeakPolarHBondContact O-CG 3.4Å; T205-L209 PolarHBondContact O-N 3.31Å
206	A	93.1	Very high	90.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-46.3	176.9	0	0	0	0	0	112.1	V202 L203 A208 L209 Q210 S245 S248 M249	V202-A206 WeakPolarHBondContact O-CB 3.3Å; V202-A206 PolarHBondContact O-N 2.98Å; L203-A206 PolarHBondContact O-N 3.46Å; A206-A208 VanDerWaalsContact C-N 3.33Å; A206-A208 PolarHBondContact O-N 3.38Å; A206-L209 PolarHBondContact O-N 2.79Å; A206-Q210 WeakPolarHBondContact O-CB 3.29Å; A206-Q210 PolarHBondContact O-N 3.2Å; A206-S245 PolarHBondContact O-OG 3.15Å; A206-S248 WeakPolarHBondContact CB-OG 3.27Å; A206-M249 HydrophobicContact CB-CG 3.55Å; A206-M249 HydrophobicContact CB-SD 3.75Å
207	L	93	Very high	91.2	Very high	52 Å²	52	37.6 Å²	37.6	27%	0.272	22%	0.217	S	C	.	.	H	α-helix	trans	-63.7	-39.6	177.4	-175.2	64.7	0	0	0	111.8	L203 T204 Q210 G211	L203-L207 WeakPolarHBondContact O-CB 3.37Å; L203-L207 PolarHBondContact O-N 3.18Å; T204-L207 PolarHBondContact O-N 3.32Å; L207-Q210 PolarHBondContact O-N 2.66Å; L207-G211 PolarHBondContact O-N 3.37Å
208	A	94.2	Very high	92	Very high	55 Å²	55	37.8 Å²	37.8	46%	0.455	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-44.7	175.1	0	0	0	0	0	111.6	T204 T205 A206 Q210 G211 C212	T204-A208 WeakPolarHBondContact O-CB 3.28Å; T204-A208 PolarHBondContact O-N 2.86Å; T205-A208 PolarHBondContact O-N 3.42Å; A206-A208 VanDerWaalsContact C-N 3.33Å; A206-A208 PolarHBondContact O-N 3.38Å; A208-Q210 VanDerWaalsContact C-N 3.33Å; A208-Q210 PolarHBondContact O-N 3.38Å; A208-G211 PolarHBondContact O-N 3.04Å; A208-C212 WeakPolarHBondContact O-CB 3.1Å; A208-C212 PolarHBondContact O-N 3.46Å; A208-C212 PolarHBondContact O-SG 3.29Å
209	L	94.7	Very high	92.7	Very high	38 Å²	38	36.6 Å²	36.6	20%	0.199	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-42.7	174.8	-73.7	169	0	0	0	111.9	T205 A206 C212 S213 W241 V244	T205-L209 HydrophobicContact CG2-CD1 4.24Å; T205-L209 WeakPolarHBondContact O-CG 3.4Å; T205-L209 PolarHBondContact O-N 3.31Å; A206-L209 PolarHBondContact O-N 2.79Å; L209-C212 PolarHBondContact O-N 2.98Å; L209-S213 WeakPolarHBondContact O-CB 3.23Å; L209-S213 PolarHBondContact O-N 3.01Å; L209-W241 HydrophobicContact CD2-CG 4.42Å; L209-V244 HydrophobicContact CD1-CB 4.26Å; L209-V244 HydrophobicContact CD1-CG1 3.66Å
210	Q	94.4	Very high	93.1	Very high	7 Å²	7	37.8 Å²	37.8	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-39	176.7	-164.4	-178.5	13	0	0	111.9	Y175 A206 L207 A208 S213 A214	Y175-Q210 PolarHBondContact OH-OE1 3.13Å; A206-Q210 WeakPolarHBondContact O-CB 3.29Å; A206-Q210 PolarHBondContact O-N 3.2Å; L207-Q210 PolarHBondContact O-N 2.66Å; A208-Q210 VanDerWaalsContact C-N 3.33Å; A208-Q210 PolarHBondContact O-N 3.38Å; Q210-S213 PolarHBondContact O-N 2.8Å; Q210-A214 PolarHBondContact O-N 3.46Å
211	G	95.4	Very high	93.3	Very high	16 Å²	16	38.1 Å²	38.1	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-40.5	174	0	0	0	0	0	113.1	L207 A208 A214 L215	L207-G211 PolarHBondContact O-N 3.37Å; A208-G211 PolarHBondContact O-N 3.04Å; G211-A214 PolarHBondContact O-N 2.94Å; G211-L215 PolarHBondContact O-N 2.88Å
212	C	96.2	Very high	93.5	Very high	52 Å²	52	33.3 Å²	33.3	35%	0.351	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-42.4	173.1	-71	0	0	0	0	111.2	A208 L209 L215 C216 W241	A208-C212 WeakPolarHBondContact O-CB 3.1Å; A208-C212 PolarHBondContact O-N 3.46Å; A208-C212 PolarHBondContact O-SG 3.29Å; L209-C212 PolarHBondContact O-N 2.98Å; C212-L215 WeakPolarHBondContact O-CB 3.4Å; C212-L215 PolarHBondContact O-N 3.29Å; C212-C216 PolarHBondContact O-N 3.46Å; C212-W241 HydrophobicContact CB-CD2 4.02Å; C212-W241 HydrophobicContact CB-CE3 3.36Å; C212-W241 HydrophobicContact CB-CH2 4.18Å; C212-W241 HydrophobicContact CB-CZ3 3.42Å; C212-W241 VanDerWaalsContact CB-CZ3 3.42Å; C212-W241 WeakPolarHBondContact O-CZ3 3.29Å
213	S	95.7	Very high	93.6	Very high	5 Å²	5	37.8 Å²	37.8	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-58.3	-49.6	174.2	171.4	0	0	0	0	111.4	L209 Q210 L215 C216 N217 A238	L209-S213 WeakPolarHBondContact O-CB 3.23Å; L209-S213 PolarHBondContact O-N 3.01Å; Q210-S213 PolarHBondContact O-N 2.8Å; S213-L215 VanDerWaalsContact C-N 3.26Å; S213-L215 PolarHBondContact O-N 2.92Å; S213-C216 PolarHBondContact O-N 3.46Å; S213-C216 VanDerWaalsContact O-N 3.16Å; S213-N217 PolarHBondContact O-N 3.15Å; S213-A238 VanDerWaalsContact CB-O 3.26Å; S213-A238 WeakPolarHBondContact CB-O 3.48Å; S213-A238 WeakPolarHBondContact O-CB 3.48Å; S213-A238 PolarHBondContact OG-O 3.43Å
214	A	95.8	Very high	93.6	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-58.5	-36.6	176.2	0	0	0	0	0	112.8	Y168 L171 L172 Q210 G211 Y218	Y168-A214 HydrophobicContact CD1-CB 3.98Å; Y168-A214 HydrophobicContact CE1-CB 4.29Å; L171-A214 HydrophobicContact CD2-CB 4.08Å; L172-A214 HydrophobicContact CD2-CB 4.01Å; L172-A214 HydrophobicContact CG-CB 4.38Å; Q210-A214 PolarHBondContact O-N 3.46Å; G211-A214 PolarHBondContact O-N 2.94Å; A214-Y218 WeakPolarHBondContact O-CB 3.36Å; A214-Y218 PolarHBondContact O-N 3.08Å
215	L	96.6	Very high	93.4	Very high	82 Å²	82	38.2 Å²	38.2	43%	0.429	21%	0.21	S	C	.	.	H	α-helix	trans	-67.7	-44.4	176.1	-179.9	63.3	0	0	0	111.9	L172 G211 C212 S213 Y218 I219	L172-L215 HydrophobicContact CD1-CD1 4.17Å; L172-L215 HydrophobicContact CD2-CB 4.1Å; G211-L215 PolarHBondContact O-N 2.88Å; C212-L215 WeakPolarHBondContact O-CB 3.4Å; C212-L215 PolarHBondContact O-N 3.29Å; S213-L215 VanDerWaalsContact C-N 3.26Å; S213-L215 PolarHBondContact O-N 2.92Å; L215-Y218 PolarHBondContact O-N 3.34Å; L215-I219 HydrophobicContact CD1-CD1 4.18Å; L215-I219 HydrophobicContact CD1-CG1 4.44Å; L215-I219 HydrophobicContact CG-CD1 4.04Å; L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.41Å; L215-I219 PolarHBondContact O-N 3.45Å
216	C	95.2	Very high	93.1	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.041	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-44.2	175.4	-84	0	0	0	0	111.8	C212 S213 Y218 I219 H220 M234 A238 W241	C212-C216 PolarHBondContact O-N 3.46Å; S213-C216 PolarHBondContact O-N 3.46Å; S213-C216 VanDerWaalsContact O-N 3.16Å; C216-Y218 PolarHBondContact O-N 3.28Å; C216-I219 PolarHBondContact O-N 3.02Å; C216-H220 WeakPolarHBondContact O-CB 3.32Å; C216-H220 PolarHBondContact O-N 3.33Å; C216-M234 WeakPolarHBondContact CB-O 3.5Å; C216-M234 HydrophobicContact CB-SD 4.44Å; C216-M234 VanDerWaalsContact SG-SD 3.62Å; C216-A238 HydrophobicContact CB-CB 3.67Å; C216-W241 HydrophobicContact CB-CE3 4.47Å; C216-W241 HydrophobicContact CB-CZ3 4.29Å; C216-W241 WeakPolarHBondContact SG-CZ3 3.37Å
217	N	93.7	Very high	92.7	Very high	29 Å²	29	46.9 Å²	46.9	16%	0.155	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-42.4	174.2	-87.6	-24.3	0	0	0	112.2	Y168 S213 I219 H220 L221 A238	Y168-N217 HydrophobicContact CD1-CB 4.11Å; Y168-N217 HydrophobicContact CD2-CB 4.21Å; Y168-N217 HydrophobicContact CE1-CB 3.82Å; Y168-N217 HydrophobicContact CE2-CB 3.89Å; Y168-N217 HydrophobicContact CG-CB 4.31Å; Y168-N217 PolarHBondContact OH-ND2 2.99Å; S213-N217 PolarHBondContact O-N 3.15Å; N217-I219 PolarHBondContact O-N 3.41Å; N217-H220 PolarHBondContact O-N 3.44Å; N217-L221 WeakPolarHBondContact O-CB 3.28Å; N217-L221 VanDerWaalsContact O-CG 3.22Å; N217-L221 WeakPolarHBondContact O-CG 3.07Å; N217-L221 PolarHBondContact O-N 2.93Å; N217-A238 HydrophobicContact CB-CB 4.21Å; N217-A238 WeakPolarHBondContact OD1-CB 3.45Å
218	Y	95.1	Very high	92.3	Very high	67 Å²	67	44.4 Å²	44.4	26%	0.263	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-47.3	174.2	174.1	-100.6	0	0	0	112	H165 F169 L172 A214 L215 C216 L221 A222	H165-Y218 AromaticContact CD2-CD2 3.94Å; H165-Y218 AromaticContact CD2-CE2 3.82Å; H165-Y218 AromaticContact CE1-CE2 3.96Å; H165-Y218 AromaticContact NE2-CD2 3.88Å; H165-Y218 AromaticContact NE2-CE2 3.28Å; H165-Y218 VanDerWaalsContact NE2-CE2 3.28Å; H165-Y218 WeakPolarHBondContact NE2-CE2 3.44Å; H165-Y218 AromaticContact NE2-CZ 3.87Å; F169-Y218 HydrophobicContact CB-CD2 4.2Å; F169-Y218 HydrophobicContact CB-CE2 3.86Å; F169-Y218 HydrophobicContact CD2-CE2 4.18Å; F169-Y218 HydrophobicContact CG-CE2 4.49Å; L172-Y218 HydrophobicContact CD1-CD1 4.21Å; L172-Y218 HydrophobicContact CD1-CD2 4.45Å; L172-Y218 HydrophobicContact CD1-CG 3.83Å; A214-Y218 WeakPolarHBondContact O-CB 3.36Å; A214-Y218 PolarHBondContact O-N 3.08Å; L215-Y218 PolarHBondContact O-N 3.34Å; C216-Y218 PolarHBondContact O-N 3.28Å; Y218-L221 PolarHBondContact O-N 3.32Å; Y218-A222 WeakPolarHBondContact O-CB 3.38Å; Y218-A222 PolarHBondContact O-N 2.96Å
219	I	94.3	Very high	91.7	Very high	63 Å²	63	44.5 Å²	44.5	32%	0.323	22%	0.22	S	C	.	.	H	α-helix	trans	-63.7	-43.3	179.4	-68.1	166.9	0	0	0	111	L215 C216 N217 R223 I231 M234	L215-I219 HydrophobicContact CD1-CD1 4.18Å; L215-I219 HydrophobicContact CD1-CG1 4.44Å; L215-I219 HydrophobicContact CG-CD1 4.04Å; L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.41Å; L215-I219 PolarHBondContact O-N 3.45Å; C216-I219 PolarHBondContact O-N 3.02Å; N217-I219 PolarHBondContact O-N 3.41Å; I219-R223 PolarHBondContact O-N 3.38Å; I219-I231 HydrophobicContact CG2-CD1 4.06Å; I219-M234 HydrophobicContact CG2-CG 4.19Å
220	H	92.4	Very high	91.4	Very high	35 Å²	35	43 Å²	43	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-54.8	175.9	173.2	81.2	0	0	0	110.7	C216 N217 A222 R223 Y224 I231 M234	C216-H220 WeakPolarHBondContact O-CB 3.32Å; C216-H220 PolarHBondContact O-N 3.33Å; N217-H220 PolarHBondContact O-N 3.44Å; H220-A222 PolarHBondContact O-N 2.9Å; H220-R223 PolarHBondContact O-N 3.05Å; H220-Y224 WeakPolarHBondContact O-CB 3.36Å; H220-Y224 PolarHBondContact O-N 3.05Å; H220-I231 PolarHBondContact ND1-N 3.32Å; H220-I231 PolarHBondContact ND1-O 2.89Å; H220-M234 HydrophobicContact CB-CB 4.06Å
221	L	90.8	Very high	91	Very high	11 Å²	11	45.2 Å²	45.2	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-35	-178.3	-66.8	171	0	0	0	112.7	F157 L164 H165 Y168 N217 Y218 R223 Y224 S225	F157-L221 HydrophobicContact CE1-CD2 3.76Å; F157-L221 HydrophobicContact CZ-CB 4.11Å; F157-L221 HydrophobicContact CZ-CD2 4.21Å; F157-L221 WeakPolarHBondContact CZ-O 3.05Å; L164-L221 HydrophobicContact CB-CD1 4.31Å; L164-L221 HydrophobicContact CD2-CD1 3.99Å; L164-L221 HydrophobicContact CG-CD1 3.97Å; H165-L221 HydrophobicContact CB-CB 4.21Å; Y168-L221 HydrophobicContact CD2-CD1 3.49Å; Y168-L221 VanDerWaalsContact CD2-CD1 3.49Å; Y168-L221 HydrophobicContact CE2-CD1 3.79Å; N217-L221 WeakPolarHBondContact O-CB 3.28Å; N217-L221 VanDerWaalsContact O-CG 3.22Å; N217-L221 WeakPolarHBondContact O-CG 3.07Å; N217-L221 PolarHBondContact O-N 2.93Å; Y218-L221 PolarHBondContact O-N 3.32Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.04Å; L221-Y224 WeakPolarHBondContact O-CB 3.46Å; L221-Y224 PolarHBondContact O-N 3.44Å; L221-S225 PolarHBondContact O-N 3.38Å
222	A	91.4	Very high	90.5	Very high	24 Å²	24	46.8 Å²	46.8	20%	0.198	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-37.4	176.3	0	0	0	0	0	111.7	Y218 H220 S225	Y218-A222 WeakPolarHBondContact O-CB 3.38Å; Y218-A222 PolarHBondContact O-N 2.96Å; H220-A222 PolarHBondContact O-N 2.9Å; A222-S225 PolarHBondContact O-OG 3.34Å
223	R	91.1	Very high	90.1	Very high	136 Å²	136	48.7 Å²	48.7	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-73.3	-45.6	171.9	-71.2	-56.5	-170.2	109.2	-1.6	111.7	I219 H220 L221 S225 R226 D227 I231	I219-R223 PolarHBondContact O-N 3.38Å; H220-R223 PolarHBondContact O-N 3.05Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.04Å; R223-S225 PolarHBondContact O-N 3.07Å; R223-S225 VanDerWaalsContact O-N 3.17Å; R223-R226 WeakPolarHBondContact O-CB 3.46Å; R223-R226 PolarHBondContact O-N 3.45Å; R223-D227 VanDerWaalsContact C-OD1 3.29Å; R223-D227 VanDerWaalsContact O-CG 3.27Å; R223-D227 PolarHBondContact O-N 3.45Å; R223-D227 VanDerWaalsContact O-N 3.15Å; R223-I231 HydrophobicContact CB-CG1 4.21Å; R223-I231 HydrophobicContact CG-CD1 3.91Å; R223-I231 HydrophobicContact CG-CG1 3.93Å
224	Y	88.9	Confident	89.8	Confident	18 Å²	18	50.7 Å²	50.7	7%	0.071	25%	0.249	C	C	.	.	H	α-helix	trans	-52.2	-40.9	179.1	-171.3	-88.8	0	0	0	112.9	K21 F157 E161 H220 L221 R226 D227 G228	K21-Y224 HydrophobicContact CD-CE1 4.02Å; K21-Y224 WeakPolarHBondContact CD-OH 3.47Å; K21-Y224 WeakPolarHBondContact CE-OH 3.5Å; K21-Y224 WeakPolarHBondContact CG-OH 3.19Å; K21-Y224 PolarHBondContact NZ-OH 2.04Å; K21-Y224 VanDerWaalsContact NZ-OH 3.13Å; F157-Y224 AromaticContact CD1-CD1 3.68Å; F157-Y224 HydrophobicContact CD1-CD1 3.68Å; F157-Y224 AromaticContact CD1-CE1 3.75Å; F157-Y224 HydrophobicContact CD1-CE1 3.75Å; F157-Y224 AromaticContact CE1-CD1 3.35Å; F157-Y224 HydrophobicContact CE1-CD1 3.35Å; F157-Y224 AromaticContact CE1-CE1 3.87Å; F157-Y224 HydrophobicContact CE1-CE1 3.87Å; F157-Y224 HydrophobicContact CE1-CG 4.3Å; F157-Y224 HydrophobicContact CZ-CD1 4.02Å; E161-Y224 WeakPolarHBondContact OE2-CE1 3.14Å; E161-Y224 PolarHBondContact OE2-OH 3.35Å; H220-Y224 WeakPolarHBondContact O-CB 3.36Å; H220-Y224 PolarHBondContact O-N 3.05Å; L221-Y224 WeakPolarHBondContact O-CB 3.46Å; L221-Y224 PolarHBondContact O-N 3.44Å; Y224-R226 PolarHBondContact O-N 3Å; Y224-D227 WeakPolarHBondContact CA-OD1 3.46Å; Y224-G228 VanDerWaalsContact CE2-O 3.23Å; Y224-G228 WeakPolarHBondContact CE2-O 3.4Å; Y224-G228 VanDerWaalsContact O-CA 3.23Å; Y224-G228 WeakPolarHBondContact O-CA 3.33Å; Y224-G228 PolarHBondContact O-N 2.85Å
225	S	87.4	Confident	89.4	Confident	30 Å²	30	51 Å²	51	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-25	176.4	71.9	0	0	0	0	114.5	F157 L221 A222 R223	F157-S225 VanDerWaalsContact CE2-CB 3.45Å; L221-S225 PolarHBondContact O-N 3.38Å; A222-S225 PolarHBondContact O-OG 3.34Å; R223-S225 PolarHBondContact O-N 3.07Å; R223-S225 VanDerWaalsContact O-N 3.17Å
226	R	85.8	Confident	88.9	Confident	202 Å²	202	47.8 Å²	47.8	76%	0.762	24%	0.236	S	C	*	.	H	α-helix	trans	-103.8	-32.2	-174.5	-61.5	-176.8	-179	176.2	-0.6	114.2	R223 Y224	R223-R226 WeakPolarHBondContact O-CB 3.46Å; R223-R226 PolarHBondContact O-N 3.45Å; Y224-R226 PolarHBondContact O-N 3Å
227	D	85.4	Confident	88.6	Confident	54 Å²	54	49.2 Å²	49.2	29%	0.289	24%	0.243	S	C	.	.	H	α-helix	trans	-118.1	-10.5	-173.8	58.3	20.6	0	0	0	113.6	T22 R223 Y224 T229 G230	T22-D227 WeakPolarHBondContact CB-O 3.28Å; T22-D227 PolarHBondContact OG1-O 3.34Å; R223-D227 VanDerWaalsContact C-OD1 3.29Å; R223-D227 VanDerWaalsContact O-CG 3.27Å; R223-D227 PolarHBondContact O-N 3.45Å; R223-D227 VanDerWaalsContact O-N 3.15Å; Y224-D227 WeakPolarHBondContact CA-OD1 3.46Å; D227-T229 PolarHBondContact O-N 3.32Å; D227-T229 PolarHBondContact OD1-N 2.88Å; D227-T229 PolarHBondContact OD1-OG1 2.91Å; D227-G230 PolarHBondContact OD1-N 3.48Å
228	G	83.4	Confident	88.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	70.1	0.8	-176.6	0	0	0	0	0	114.5	G20 K21 T22 H156 Y224	G20-G228 CarbonylContact C-O 3.58Å; G20-G228 VanDerWaalsContact C-O 3.28Å; G20-G228 WeakPolarHBondContact CA-O 3.44Å; K21-G228 PolarHBondContact N-O 3.48Å; T22-G228 PolarHBondContact N-O 3.46Å; H156-G228 PolarHBondContact CD2-N 2.8Å; Y224-G228 VanDerWaalsContact CE2-O 3.23Å; Y224-G228 WeakPolarHBondContact CE2-O 3.4Å; Y224-G228 VanDerWaalsContact O-CA 3.23Å; Y224-G228 WeakPolarHBondContact O-CA 3.33Å; Y224-G228 PolarHBondContact O-N 2.85Å
229	T	82.8	Confident	88.3	Confident	56 Å²	56	48.3 Å²	48.3	34%	0.344	24%	0.24	S	C	.	.	S	Bend	trans	-115.2	-31.9	-177.8	57.6	0	0	0	0	112.6	D227	D227-T229 PolarHBondContact O-N 3.32Å; D227-T229 PolarHBondContact OD1-N 2.88Å; D227-T229 PolarHBondContact OD1-OG1 2.91Å
230	G	86.8	Confident	88	Confident	7 Å²	7	48.8 Å²	48.8	7%	0.072	24%	0.24	C	C	.	.			trans	65.3	-160.1	-173.5	0	0	0	0	0	112.6	D227	D227-G230 PolarHBondContact OD1-N 3.48Å
231	I	87.3	Confident	88.1	Confident	53 Å²	53	50.5 Å²	50.5	27%	0.272	25%	0.245	S	C	.	.			trans	-110.6	105.3	173	-55.8	177	0	0	0	107.4	I219 H220 R223 L233 M234 G235	I219-I231 HydrophobicContact CG2-CD1 4.06Å; H220-I231 PolarHBondContact ND1-N 3.32Å; H220-I231 PolarHBondContact ND1-O 2.89Å; R223-I231 HydrophobicContact CB-CG1 4.21Å; R223-I231 HydrophobicContact CG-CD1 3.91Å; R223-I231 HydrophobicContact CG-CG1 3.93Å; I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 HydrophobicContact CG2-CB 4.33Å; I231-L233 PolarHBondContact O-N 3.34Å; I231-M234 HydrophobicContact CB-CB 4.05Å; I231-M234 HydrophobicContact CB-CG 3.89Å; I231-M234 HydrophobicContact CD1-CG 4.31Å; I231-M234 HydrophobicContact CG2-CB 4.16Å; I231-M234 HydrophobicContact CG2-CG 3.69Å; I231-M234 WeakPolarHBondContact O-CB 3.07Å; I231-M234 PolarHBondContact O-N 3.43Å; I231-G235 PolarHBondContact O-N 2.89Å
232	P	84.5	Confident	88.2	Confident	49 Å²	49	51.8 Å²	51.8	32%	0.318	25%	0.252	S	S	.	.	H	α-helix	trans	-60.3	-41.5	-173.1	21.7	-32.7	0	0	0	112	A18 M234 G235 S236	A18-P232 HydrophobicContact CB-CB 3.59Å; A18-P232 HydrophobicContact CB-CG 4.46Å; P232-M234 PolarHBondContact O-N 2.86Å; P232-G235 WeakPolarHBondContact O-CA 3.4Å; P232-G235 PolarHBondContact O-N 2.9Å; P232-S236 PolarHBondContact O-N 2.82Å; P232-S236 PolarHBondContact O-OG 3.06Å
233	L	87.1	Confident	88.2	Confident	93 Å²	93	52 Å²	52	49%	0.487	25%	0.249	S	C	.	.	H	α-helix	trans	-55.2	-37.2	174.7	-179.9	64.4	0	0	0	113	I231 L237	I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 HydrophobicContact CG2-CB 4.33Å; I231-L233 PolarHBondContact O-N 3.34Å; L233-L237 HydrophobicContact CD1-CD1 4.32Å; L233-L237 HydrophobicContact CD1-CG 4.35Å; L233-L237 HydrophobicContact CG-CD1 4.09Å; L233-L237 WeakPolarHBondContact O-CB 3.3Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.45Å; L233-L237 PolarHBondContact O-N 3.49Å
234	M	89.1	Confident	88.2	Confident	47 Å²	47	48.1 Å²	48.1	23%	0.232	24%	0.241	C	C	.	.	H	α-helix	trans	-72.5	-35.1	178	-69	-68	139.6	0	0	111.5	C216 I219 H220 I231 P232 L237 A238	C216-M234 WeakPolarHBondContact CB-O 3.5Å; C216-M234 HydrophobicContact CB-SD 4.44Å; C216-M234 VanDerWaalsContact SG-SD 3.62Å; I219-M234 HydrophobicContact CG2-CG 4.19Å; H220-M234 HydrophobicContact CB-CB 4.06Å; I231-M234 HydrophobicContact CB-CB 4.05Å; I231-M234 HydrophobicContact CB-CG 3.89Å; I231-M234 HydrophobicContact CD1-CG 4.31Å; I231-M234 HydrophobicContact CG2-CB 4.16Å; I231-M234 HydrophobicContact CG2-CG 3.69Å; I231-M234 WeakPolarHBondContact O-CB 3.07Å; I231-M234 PolarHBondContact O-N 3.43Å; P232-M234 PolarHBondContact O-N 2.86Å; M234-L237 HydrophobicContact CE-CD1 4.2Å; M234-A238 WeakPolarHBondContact O-CB 3.37Å; M234-A238 PolarHBondContact O-N 3.43Å
235	G	87.5	Confident	88.4	Confident	8 Å²	8	47.4 Å²	47.4	8%	0.082	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-54.2	171.7	0	0	0	0	0	111.3	I231 P232 L237 A238 E239	I231-G235 PolarHBondContact O-N 2.89Å; P232-G235 WeakPolarHBondContact O-CA 3.4Å; P232-G235 PolarHBondContact O-N 2.9Å; G235-L237 VanDerWaalsContact C-N 3.32Å; G235-L237 PolarHBondContact O-N 3.4Å; G235-A238 WeakPolarHBondContact O-CB 3.48Å; G235-A238 PolarHBondContact O-N 2.88Å; G235-E239 PolarHBondContact O-N 2.9Å
236	S	86.4	Confident	88.7	Confident	15 Å²	15	47.3 Å²	47.3	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-37.9	179.8	-44.8	0	0	0	0	112.9	P232 F240	P232-S236 PolarHBondContact O-N 2.82Å; P232-S236 PolarHBondContact O-OG 3.06Å; S236-F240 WeakPolarHBondContact O-CB 3.49Å; S236-F240 PolarHBondContact O-N 3.33Å
237	L	89.9	Confident	89	Confident	36 Å²	36	39.5 Å²	39.5	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-37.8	174.3	-78.1	173.3	0	0	0	112.3	L12 L233 M234 G235 F240 W241	L12-L237 HydrophobicContact CD2-CD2 4.47Å; L233-L237 HydrophobicContact CD1-CD1 4.32Å; L233-L237 HydrophobicContact CD1-CG 4.35Å; L233-L237 HydrophobicContact CG-CD1 4.09Å; L233-L237 WeakPolarHBondContact O-CB 3.3Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.45Å; L233-L237 PolarHBondContact O-N 3.49Å; M234-L237 HydrophobicContact CE-CD1 4.2Å; G235-L237 VanDerWaalsContact C-N 3.32Å; G235-L237 PolarHBondContact O-N 3.4Å; L237-F240 PolarHBondContact O-N 3.22Å; L237-W241 WeakPolarHBondContact O-CB 3.46Å; L237-W241 PolarHBondContact O-N 3.19Å
238	A	91.9	Very high	89.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-48.5	177.8	0	0	0	0	0	111.2	S213 C216 N217 M234 G235 W241 D242	S213-A238 VanDerWaalsContact CB-O 3.26Å; S213-A238 WeakPolarHBondContact CB-O 3.48Å; S213-A238 WeakPolarHBondContact O-CB 3.48Å; S213-A238 PolarHBondContact OG-O 3.43Å; C216-A238 HydrophobicContact CB-CB 3.67Å; N217-A238 HydrophobicContact CB-CB 4.21Å; N217-A238 WeakPolarHBondContact OD1-CB 3.45Å; M234-A238 WeakPolarHBondContact O-CB 3.37Å; M234-A238 PolarHBondContact O-N 3.43Å; G235-A238 WeakPolarHBondContact O-CB 3.48Å; G235-A238 PolarHBondContact O-N 2.88Å; A238-W241 PolarHBondContact O-N 3.43Å; A238-D242 WeakPolarHBondContact O-CB 3.25Å; A238-D242 PolarHBondContact O-N 2.84Å
239	E	89.8	Confident	89.6	Confident	78 Å²	78	38.2 Å²	38.2	36%	0.364	20%	0.204	S	C	.	.	H	α-helix	trans	-58.4	-49.3	175.2	-71.8	166.4	-158.3	0	0	111.3	G235 W241 D242 M243 Q300	G235-E239 PolarHBondContact O-N 2.9Å; E239-W241 PolarHBondContact O-N 3.49Å; E239-D242 PolarHBondContact O-N 3.3Å; E239-D242 VanDerWaalsContact O-N 3.17Å; E239-M243 WeakPolarHBondContact O-CG 3.21Å; E239-M243 PolarHBondContact O-N 2.87Å; E239-Q300 PolarHBondContact OE2-NE2 3.42Å
240	F	89.3	Confident	90	Very high	72 Å²	72	35.5 Å²	35.5	32%	0.316	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-47.7	-179.5	174.2	-105.5	0	0	0	112.5	L8 S236 L237 D242 M243 V244	L8-F240 HydrophobicContact CD2-CE2 3.68Å; L8-F240 HydrophobicContact CD2-CZ 3.65Å; S236-F240 WeakPolarHBondContact O-CB 3.49Å; S236-F240 PolarHBondContact O-N 3.33Å; L237-F240 PolarHBondContact O-N 3.22Å; F240-D242 VanDerWaalsContact C-N 3.3Å; F240-D242 PolarHBondContact O-N 3.49Å; F240-M243 PolarHBondContact O-N 3.29Å; F240-V244 HydrophobicContact CD2-CG2 4.35Å; F240-V244 HydrophobicContact CE1-CG2 4.12Å; F240-V244 HydrophobicContact CE2-CG2 3.86Å; F240-V244 HydrophobicContact CZ-CG2 3.73Å; F240-V244 WeakPolarHBondContact O-CG2 3.4Å; F240-V244 PolarHBondContact O-N 2.96Å
241	W	93	Very high	90.1	Very high	72 Å²	72	38.9 Å²	38.9	27%	0.273	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-35.6	177.9	-71.9	-16.3	0	0	0	112.5	L209 C212 C216 L237 A238 E239 S245	L209-W241 HydrophobicContact CD2-CG 4.42Å; C212-W241 HydrophobicContact CB-CD2 4.02Å; C212-W241 HydrophobicContact CB-CE3 3.36Å; C212-W241 HydrophobicContact CB-CH2 4.18Å; C212-W241 HydrophobicContact CB-CZ3 3.42Å; C212-W241 VanDerWaalsContact CB-CZ3 3.42Å; C212-W241 WeakPolarHBondContact O-CZ3 3.29Å; C216-W241 HydrophobicContact CB-CE3 4.47Å; C216-W241 HydrophobicContact CB-CZ3 4.29Å; C216-W241 WeakPolarHBondContact SG-CZ3 3.37Å; L237-W241 WeakPolarHBondContact O-CB 3.46Å; L237-W241 PolarHBondContact O-N 3.19Å; A238-W241 PolarHBondContact O-N 3.43Å; E239-W241 PolarHBondContact O-N 3.49Å; W241-S245 WeakPolarHBondContact O-CB 3.17Å; W241-S245 PolarHBondContact O-N 3.14Å
242	D	92.9	Very high	90.1	Very high	38 Å²	38	36.6 Å²	36.6	20%	0.203	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-47.1	174.3	-167.6	61.5	0	0	0	111.5	A238 E239 F240 V244 S245 Q246	A238-D242 WeakPolarHBondContact O-CB 3.25Å; A238-D242 PolarHBondContact O-N 2.84Å; E239-D242 PolarHBondContact O-N 3.3Å; E239-D242 VanDerWaalsContact O-N 3.17Å; F240-D242 VanDerWaalsContact C-N 3.3Å; F240-D242 PolarHBondContact O-N 3.49Å; D242-V244 VanDerWaalsContact C-N 3.35Å; D242-V244 PolarHBondContact O-N 3.38Å; D242-S245 CarbonylContact O-C 3.58Å; D242-S245 WeakPolarHBondContact O-CA 3.28Å; D242-S245 WeakPolarHBondContact O-CB 3.5Å; D242-S245 PolarHBondContact O-N 3.02Å; D242-Q246 WeakPolarHBondContact O-CG 3.25Å; D242-Q246 PolarHBondContact O-N 2.99Å; D242-Q246 PolarHBondContact OD2-NE2 3.23Å
243	M	91.4	Very high	90.4	Very high	27 Å²	27	34.3 Å²	34.3	13%	0.133	17%	0.172	C	C	.	.	H	α-helix	trans	-56.1	-47	176.3	-70.8	-172.6	-174.7	0	0	112.3	E239 F240 S245 Q246 V247 L296 L297 Q300	E239-M243 WeakPolarHBondContact O-CG 3.21Å; E239-M243 PolarHBondContact O-N 2.87Å; F240-M243 PolarHBondContact O-N 3.29Å; M243-S245 VanDerWaalsContact C-N 3.31Å; M243-S245 PolarHBondContact O-N 3.45Å; M243-Q246 PolarHBondContact O-N 3.32Å; M243-V247 WeakPolarHBondContact O-CB 3.49Å; M243-V247 WeakPolarHBondContact O-CG2 3.44Å; M243-V247 PolarHBondContact O-N 3.36Å; M243-L296 HydrophobicContact CB-CD1 4.48Å; M243-L296 HydrophobicContact CE-CB 4.25Å; M243-L296 WeakPolarHBondContact CE-O 3.34Å; M243-L296 HydrophobicContact CG-CB 4.29Å; M243-L296 HydrophobicContact CG-CD1 4.33Å; M243-L296 HydrophobicContact SD-CB 4.1Å; M243-L297 HydrophobicContact SD-CD2 4.32Å; M243-Q300 HydrophobicContact CE-CB 3.66Å; M243-Q300 HydrophobicContact CE-CG 4.15Å
244	V	91.4	Very high	90.3	Very high	56 Å²	56	30 Å²	30	34%	0.339	15%	0.15	S	C	.	.	H	α-helix	trans	-62.6	-41	177.5	178.2	0	0	0	0	110.5	L209 F240 D242 S248	L209-V244 HydrophobicContact CD1-CB 4.26Å; L209-V244 HydrophobicContact CD1-CG1 3.66Å; F240-V244 HydrophobicContact CD2-CG2 4.35Å; F240-V244 HydrophobicContact CE1-CG2 4.12Å; F240-V244 HydrophobicContact CE2-CG2 3.86Å; F240-V244 HydrophobicContact CZ-CG2 3.73Å; F240-V244 WeakPolarHBondContact O-CG2 3.4Å; F240-V244 PolarHBondContact O-N 2.96Å; D242-V244 VanDerWaalsContact C-N 3.35Å; D242-V244 PolarHBondContact O-N 3.38Å; V244-S248 VanDerWaalsContact O-CB 3.31Å; V244-S248 WeakPolarHBondContact O-CB 3.38Å; V244-S248 PolarHBondContact O-N 3.13Å; V244-S248 PolarHBondContact O-OG 2.74Å
245	S	94.1	Very high	90	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-60.4	-51.2	174.8	-173.4	0	0	0	0	111.4	A206 W241 D242 M243 V247 S248 M249	A206-S245 PolarHBondContact O-OG 3.15Å; W241-S245 WeakPolarHBondContact O-CB 3.17Å; W241-S245 PolarHBondContact O-N 3.14Å; D242-S245 CarbonylContact O-C 3.58Å; D242-S245 WeakPolarHBondContact O-CA 3.28Å; D242-S245 WeakPolarHBondContact O-CB 3.5Å; D242-S245 PolarHBondContact O-N 3.02Å; M243-S245 VanDerWaalsContact C-N 3.31Å; M243-S245 PolarHBondContact O-N 3.45Å; S245-V247 VanDerWaalsContact C-N 3.34Å; S245-V247 PolarHBondContact O-N 3.37Å; S245-S248 PolarHBondContact O-N 2.6Å; S245-S248 PolarHBondContact O-OG 2.9Å; S245-M249 WeakPolarHBondContact O-CB 3.35Å; S245-M249 WeakPolarHBondContact O-CG 3.22Å; S245-M249 PolarHBondContact O-N 3.5Å
246	Q	93.3	Very high	89.6	Confident	28 Å²	28	28.2 Å²	28.2	13%	0.131	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-42.9	179.7	-69.7	-165.6	47.9	0	0	112.6	D242 M243 L250	D242-Q246 WeakPolarHBondContact O-CG 3.25Å; D242-Q246 PolarHBondContact O-N 2.99Å; D242-Q246 PolarHBondContact OD2-NE2 3.23Å; M243-Q246 PolarHBondContact O-N 3.32Å; Q246-L250 WeakPolarHBondContact O-CB 3.35Å; Q246-L250 PolarHBondContact O-N 2.95Å
247	V	91.3	Very high	89.2	Confident	39 Å²	39	27.6 Å²	27.6	24%	0.236	14%	0.136	C	C	.	.	H	α-helix	trans	-65.6	-45	176.5	160.2	0	0	0	0	111.5	M243 S245 M249 L250 Y251 V289	M243-V247 WeakPolarHBondContact O-CB 3.49Å; M243-V247 WeakPolarHBondContact O-CG2 3.44Å; M243-V247 PolarHBondContact O-N 3.36Å; S245-V247 VanDerWaalsContact C-N 3.34Å; S245-V247 PolarHBondContact O-N 3.37Å; V247-M249 VanDerWaalsContact C-N 3.28Å; V247-M249 PolarHBondContact O-N 3.17Å; V247-L250 PolarHBondContact O-N 3.37Å; V247-Y251 WeakPolarHBondContact O-CB 3.41Å; V247-Y251 PolarHBondContact O-N 3.43Å; V247-V289 HydrophobicContact CG1-CG1 3.59Å
248	S	90.3	Very high	88.3	Confident	26 Å²	26	26.8 Å²	26.8	18%	0.182	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-38	179.1	74	0	0	0	0	112.1	A206 V244 S245 M252	A206-S248 WeakPolarHBondContact CB-OG 3.27Å; V244-S248 VanDerWaalsContact O-CB 3.31Å; V244-S248 WeakPolarHBondContact O-CB 3.38Å; V244-S248 PolarHBondContact O-N 3.13Å; V244-S248 PolarHBondContact O-OG 2.74Å; S245-S248 PolarHBondContact O-N 2.6Å; S245-S248 PolarHBondContact O-OG 2.9Å; S248-M252 WeakPolarHBondContact O-CB 3.35Å; S248-M252 PolarHBondContact O-N 2.9Å
249	M	91.9	Very high	86.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70	-44.9	177.2	-78.7	-67.2	-40.8	0	0	112.3	L203 A206 S245 V247 Y251 M252 L253 W363 M398 L401	L203-M249 HydrophobicContact CD1-CE 4.01Å; L203-M249 HydrophobicContact CD1-SD 3.56Å; L203-M249 VanDerWaalsContact CD1-SD 3.56Å; A206-M249 HydrophobicContact CB-CG 3.55Å; A206-M249 HydrophobicContact CB-SD 3.75Å; S245-M249 WeakPolarHBondContact O-CB 3.35Å; S245-M249 WeakPolarHBondContact O-CG 3.22Å; S245-M249 PolarHBondContact O-N 3.5Å; V247-M249 VanDerWaalsContact C-N 3.28Å; V247-M249 PolarHBondContact O-N 3.17Å; M249-Y251 VanDerWaalsContact C-N 3.3Å; M249-Y251 PolarHBondContact O-N 3.17Å; M249-M252 HydrophobicContact CE-CE 3.44Å; M249-M252 VanDerWaalsContact CE-CE 3.44Å; M249-M252 PolarHBondContact O-N 3.48Å; M249-M252 HydrophobicContact SD-CE 3.88Å; M249-L253 HydrophobicContact CE-CD1 4.38Å; M249-L253 HydrophobicContact CE-CD2 4.49Å; M249-L253 HydrophobicContact CE-CG 4.26Å; M249-L253 WeakPolarHBondContact O-CG 3.21Å; M249-L253 PolarHBondContact O-N 3.47Å; M249-W363 HydrophobicContact CB-CH2 4.34Å; M249-W363 HydrophobicContact CB-CZ2 3.76Å; M249-M398 HydrophobicContact CB-CE 4.08Å; M249-M398 HydrophobicContact CE-CE 3.47Å; M249-M398 VanDerWaalsContact CE-CE 3.47Å; M249-M398 HydrophobicContact CE-SD 3.17Å; M249-M398 WeakPolarHBondContact CE-SD 3.41Å; M249-M398 HydrophobicContact CG-CE 3.31Å; M249-M398 HydrophobicContact CG-SD 4.08Å; M249-M398 HydrophobicContact SD-CE 3.5Å; M249-M398 WeakPolarHBondContact SD-CE 3.32Å; M249-M398 HydrophobicContact SD-SD 3.38Å; M249-L401 HydrophobicContact CE-CD1 4.13Å
250	L	91.8	Very high	84.8	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-56.2	-49	173.6	177.6	61.7	0	0	0	110.9	Q246 V247 M252 L253 L254 V289 Q292 L329 W363 F364	Q246-L250 WeakPolarHBondContact O-CB 3.35Å; Q246-L250 PolarHBondContact O-N 2.95Å; V247-L250 PolarHBondContact O-N 3.37Å; L250-M252 VanDerWaalsContact C-N 3.33Å; L250-M252 PolarHBondContact O-N 2.86Å; L250-L253 PolarHBondContact O-N 3.32Å; L250-L254 HydrophobicContact CD1-CD1 3.69Å; L250-L254 HydrophobicContact CD1-CG 3.82Å; L250-L254 HydrophobicContact CD2-CD1 4.42Å; L250-L254 HydrophobicContact CG-CD1 3.9Å; L250-L254 HydrophobicContact CG-CG 4.35Å; L250-L254 WeakPolarHBondContact O-CB 3.04Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 3.25Å; L250-V289 HydrophobicContact CB-CG2 4.32Å; L250-V289 HydrophobicContact CD2-CB 4.48Å; L250-V289 HydrophobicContact CD2-CG2 3.91Å; L250-V289 HydrophobicContact CG-CG2 3.91Å; L250-Q292 HydrophobicContact CD2-CB 3.78Å; L250-Q292 HydrophobicContact CD2-CG 4.28Å; L250-Q292 VanDerWaalsContact CD2-OE1 3.27Å; L250-L329 HydrophobicContact CD1-CD1 4.04Å; L250-L329 HydrophobicContact CD2-CD1 4.41Å; L250-W363 HydrophobicContact CB-CH2 3.91Å; L250-W363 HydrophobicContact CB-CZ3 4.29Å; L250-W363 HydrophobicContact CD1-CZ3 4.15Å; L250-F364 HydrophobicContact CD1-CE1 3.43Å; L250-F364 VanDerWaalsContact CD1-CE1 3.43Å; L250-F364 HydrophobicContact CD1-CZ 3.39Å
251	Y	87.9	Confident	82.5	Confident	78 Å²	78	26.5 Å²	26.5	31%	0.306	14%	0.135	S	C	.	.	H	α-helix	trans	-57.5	-46.8	178.8	176.5	-100.3	0	0	0	111.4	V247 M249 S255 W275 V289	V247-Y251 WeakPolarHBondContact O-CB 3.41Å; V247-Y251 PolarHBondContact O-N 3.43Å; M249-Y251 VanDerWaalsContact C-N 3.3Å; M249-Y251 PolarHBondContact O-N 3.17Å; Y251-S255 WeakPolarHBondContact O-CB 3.29Å; Y251-S255 PolarHBondContact O-N 2.85Å; Y251-S255 PolarHBondContact O-OG 3.41Å; Y251-W275 HydrophobicContact CE1-CH2 4.45Å; Y251-W275 HydrophobicContact CE1-CZ2 4.33Å; Y251-V289 HydrophobicContact CD2-CG2 4.28Å
252	M	87.7	Confident	79.9	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.025	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-49.8	178.3	-173.9	-166.3	71.6	0	0	111.5	V199 V202 L203 S248 M249 L250 S255 L256	V199-M252 HydrophobicContact CG1-CG 4.33Å; V199-M252 HydrophobicContact CG1-SD 3.8Å; V202-M252 HydrophobicContact CB-SD 4.45Å; V202-M252 HydrophobicContact CG1-CB 3.96Å; V202-M252 HydrophobicContact CG1-CG 4.26Å; V202-M252 HydrophobicContact CG1-SD 4.28Å; L203-M252 HydrophobicContact CB-SD 4.01Å; L203-M252 HydrophobicContact CD1-CE 4.19Å; S248-M252 WeakPolarHBondContact O-CB 3.35Å; S248-M252 PolarHBondContact O-N 2.9Å; M249-M252 HydrophobicContact CE-CE 3.44Å; M249-M252 VanDerWaalsContact CE-CE 3.44Å; M249-M252 PolarHBondContact O-N 3.48Å; M249-M252 HydrophobicContact SD-CE 3.88Å; L250-M252 VanDerWaalsContact C-N 3.33Å; L250-M252 PolarHBondContact O-N 2.86Å; M252-S255 PolarHBondContact O-N 3.17Å; M252-L256 HydrophobicContact CG-CD1 4.11Å; M252-L256 WeakPolarHBondContact O-CB 3.35Å; M252-L256 VanDerWaalsContact O-CG 3.31Å; M252-L256 WeakPolarHBondContact O-CG 3.36Å; M252-L256 PolarHBondContact O-N 2.82Å
253	L	89.3	Confident	77.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-51.6	-178.1	-68	-179.1	0	0	0	111.4	M249 L250 S255 L256 C257 F356 W363 F364 L401	M249-L253 HydrophobicContact CE-CD1 4.38Å; M249-L253 HydrophobicContact CE-CD2 4.49Å; M249-L253 HydrophobicContact CE-CG 4.26Å; M249-L253 WeakPolarHBondContact O-CG 3.21Å; M249-L253 PolarHBondContact O-N 3.47Å; L250-L253 PolarHBondContact O-N 3.32Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.94Å; L253-L256 PolarHBondContact O-N 3.37Å; L253-C257 PolarHBondContact O-N 3.48Å; L253-C257 VanDerWaalsContact O-N 3.07Å; L253-C257 PolarHBondContact O-SG 3.06Å; L253-F356 HydrophobicContact CD2-CE2 4.22Å; L253-F356 HydrophobicContact CD2-CZ 4.41Å; L253-W363 HydrophobicContact CD1-CB 4.44Å; L253-W363 HydrophobicContact CD1-CD2 3.97Å; L253-W363 HydrophobicContact CD1-CE3 3.7Å; L253-W363 HydrophobicContact CD1-CG 4.29Å; L253-W363 HydrophobicContact CD1-CZ3 4.25Å; L253-F364 HydrophobicContact CB-CE2 4.3Å; L253-F364 HydrophobicContact CD1-CD2 4.47Å; L253-F364 HydrophobicContact CD1-CE2 3.87Å; L253-L401 HydrophobicContact CD2-CD1 3.81Å; L253-L401 HydrophobicContact CD2-CD2 4.46Å
254	L	86.8	Confident	74.9	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-41.6	179.1	-70.4	-179.8	0	0	0	111.7	L250 L256 C257 M258 A285 L329 F364	L250-L254 HydrophobicContact CD1-CD1 3.69Å; L250-L254 HydrophobicContact CD1-CG 3.82Å; L250-L254 HydrophobicContact CD2-CD1 4.42Å; L250-L254 HydrophobicContact CG-CD1 3.9Å; L250-L254 HydrophobicContact CG-CG 4.35Å; L250-L254 WeakPolarHBondContact O-CB 3.04Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 3.25Å; L254-L256 PolarHBondContact O-N 3.31Å; L254-C257 PolarHBondContact O-N 2.72Å; L254-M258 VanDerWaalsContact O-CB 3.23Å; L254-M258 WeakPolarHBondContact O-CB 3.44Å; L254-M258 WeakPolarHBondContact O-CG 3.43Å; L254-M258 PolarHBondContact O-N 3Å; L254-A285 HydrophobicContact CB-CB 3.94Å; L254-L329 HydrophobicContact CD1-CD2 4.33Å; L254-L329 HydrophobicContact CD2-CD2 4.31Å; L254-F364 HydrophobicContact CD2-CZ 4.48Å
255	S	81.1	Confident	72.1	Confident	9 Å²	9	38.8 Å²	38.8	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-67.5	-36.1	179.9	-60.5	0	0	0	0	113.1	Y251 M252 L253 G259 W275	Y251-S255 WeakPolarHBondContact O-CB 3.29Å; Y251-S255 PolarHBondContact O-N 2.85Å; Y251-S255 PolarHBondContact O-OG 3.41Å; M252-S255 PolarHBondContact O-N 3.17Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.94Å; S255-G259 WeakPolarHBondContact O-CA 3.14Å; S255-G259 PolarHBondContact O-N 2.98Å; S255-W275 WeakPolarHBondContact OG-CZ2 3.42Å
256	L	80.1	Confident	69.4	Low	9 Å²	9	51 Å²	51	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-40.7	174.5	-77.1	174	0	0	0	111.7	V199 M252 L253 L254 W260 F356 F405	V199-L256 HydrophobicContact CG1-CD1 3.96Å; V199-L256 HydrophobicContact CG2-CD1 4.45Å; V199-L256 HydrophobicContact CG2-CD2 3.8Å; M252-L256 HydrophobicContact CG-CD1 4.11Å; M252-L256 WeakPolarHBondContact O-CB 3.35Å; M252-L256 VanDerWaalsContact O-CG 3.31Å; M252-L256 WeakPolarHBondContact O-CG 3.36Å; M252-L256 PolarHBondContact O-N 2.82Å; L253-L256 PolarHBondContact O-N 3.37Å; L254-L256 PolarHBondContact O-N 3.31Å; L256-W260 VanDerWaalsContact O-CB 3.25Å; L256-W260 WeakPolarHBondContact O-CB 3.38Å; L256-W260 PolarHBondContact O-N 3.3Å; L256-F356 HydrophobicContact CB-CZ 3.95Å; L256-F356 HydrophobicContact CD1-CE2 4.08Å; L256-F356 HydrophobicContact CD1-CZ 4.17Å; L256-F405 HydrophobicContact CD1-CE1 4.25Å; L256-F405 HydrophobicContact CD1-CE2 4.32Å; L256-F405 HydrophobicContact CD1-CZ 3.59Å
257	C	77.6	Confident	66.5	Low	3 Å²	3	58.7 Å²	58.7	2%	0.02	29%	0.285	C	S	.	.	H	α-helix	trans	-74.3	-43.3	-177.1	-57.1	0	0	0	0	111.6	L253 L254 T261 L333 F356	L253-C257 PolarHBondContact O-N 3.48Å; L253-C257 VanDerWaalsContact O-N 3.07Å; L253-C257 PolarHBondContact O-SG 3.06Å; L254-C257 PolarHBondContact O-N 2.72Å; C257-T261 WeakPolarHBondContact O-CG2 3.49Å; C257-T261 PolarHBondContact O-OG1 3.18Å; C257-L333 HydrophobicContact CB-CD1 3.33Å; C257-L333 WeakPolarHBondContact SG-CD1 3.46Å; C257-F356 WeakPolarHBondContact SG-CE1 3.43Å
258	M	70.6	Confident	63.9	Low	18 Å²	18	62.6 Å²	62.6	9%	0.089	31%	0.311	C	S	.	.	H	α-helix	trans	-84.6	-33.2	-177.9	-69.8	-75.3	-169.6	0	0	113.7	L254 W260 T261 V284 L332 I336	L254-M258 VanDerWaalsContact O-CB 3.23Å; L254-M258 WeakPolarHBondContact O-CB 3.44Å; L254-M258 WeakPolarHBondContact O-CG 3.43Å; L254-M258 PolarHBondContact O-N 3Å; M258-W260 PolarHBondContact O-N 3.03Å; M258-T261 PolarHBondContact O-N 2.98Å; M258-T261 PolarHBondContact O-OG1 3.26Å; M258-V284 HydrophobicContact CE-CB 4.45Å; M258-V284 HydrophobicContact CE-CG1 3.89Å; M258-L332 HydrophobicContact CE-CD1 4.03Å; M258-L332 HydrophobicContact CE-CD2 3.37Å; M258-L332 HydrophobicContact CE-CG 3.96Å; M258-I336 HydrophobicContact CE-CD1 3.22Å; M258-I336 HydrophobicContact CG-CD1 4.39Å; M258-I336 HydrophobicContact SD-CD1 3.48Å; M258-I336 WeakPolarHBondContact SD-CD1 3.33Å
259	G	58.6	Low	61.6	Low	18 Å²	18	71 Å²	71	19%	0.186	35%	0.347	C	S	.	.	H	α-helix	trans	-70.6	-21.2	174.9	0	0	0	0	0	112.5	S255	S255-G259 WeakPolarHBondContact O-CA 3.14Å; S255-G259 PolarHBondContact O-N 2.98Å
260	W	51.2	Low	58.8	Low	85 Å²	85	76 Å²	76	32%	0.322	38%	0.383	S	S	.	.	H	α-helix	trans	-83.1	-27.2	172.9	-80.4	37.2	0	0	0	113.5	M196 L256 M258 F352 Y353	M196-W260 HydrophobicContact CE-CZ2 4.11Å; L256-W260 VanDerWaalsContact O-CB 3.25Å; L256-W260 WeakPolarHBondContact O-CB 3.38Å; L256-W260 PolarHBondContact O-N 3.3Å; M258-W260 PolarHBondContact O-N 3.03Å; W260-F352 HydrophobicContact CH2-CD1 4.17Å; W260-F352 AromaticContact CH2-CE1 3.4Å; W260-F352 HydrophobicContact CH2-CE1 3.4Å; W260-F352 AromaticContact CH2-CZ 3.95Å; W260-F352 HydrophobicContact CH2-CZ 3.95Å; W260-F352 HydrophobicContact CZ2-CE1 4.29Å; W260-F352 HydrophobicContact CZ3-CD1 4.29Å; W260-F352 AromaticContact CZ3-CE1 3.79Å; W260-F352 HydrophobicContact CZ3-CE1 3.79Å; W260-Y353 HydrophobicContact CD2-CE1 4.48Å; W260-Y353 HydrophobicContact CE3-CD1 4.43Å; W260-Y353 AromaticContact CE3-CE1 3.21Å; W260-Y353 HydrophobicContact CE3-CE1 3.21Å; W260-Y353 AromaticContact CE3-CZ 3.52Å; W260-Y353 HydrophobicContact CH2-CE1 4.28Å; W260-Y353 HydrophobicContact CZ3-CD1 4.16Å; W260-Y353 AromaticContact CZ3-CE1 3.08Å; W260-Y353 HydrophobicContact CZ3-CE1 3.08Å; W260-Y353 HydrophobicContact CZ3-CE2 4.47Å; W260-Y353 AromaticContact CZ3-CZ 3.27Å; W260-Y353 WeakPolarHBondContact CZ3-OH 3.33Å
261	T	41	Very low	56.1	Low	42 Å²	42	86.4 Å²	86.4	26%	0.258	42%	0.422	S	S	.	.	H	α-helix	trans	-92.7	-18.3	-170.2	50.7	0	0	0	0	116.5	C257 M258 I336 I340	C257-T261 WeakPolarHBondContact O-CG2 3.49Å; C257-T261 PolarHBondContact O-OG1 3.18Å; M258-T261 PolarHBondContact O-N 2.98Å; M258-T261 PolarHBondContact O-OG1 3.26Å; T261-I336 HydrophobicContact CG2-CG2 3.3Å; T261-I340 HydrophobicContact CG2-CD1 3.39Å; T261-I340 HydrophobicContact CG2-CG1 3.51Å
262	L	36.4	Very low	53.7	Low	84 Å²	84	87.5 Å²	87.5	44%	0.44	44%	0.439	S	S	.	.	S	Bend	trans	-93.3	6	-179.1	-99.2	139.9	0	0	0	115.1	R264 S278	L262-R264 PolarHBondContact O-N 2.67Å; L262-S278 WeakPolarHBondContact CD2-OG 3.5Å
263	S	37.7	Very low	51.4	Low	80 Å²	80	91 Å²	91	56%	0.559	46%	0.457	S	S	*	.			trans	-76.9	33	166.2	-147.8	0	0	0	0	112.3	G265 E276	S263-G265 VanDerWaalsContact C-N 3.27Å; S263-G265 PolarHBondContact O-N 2.85Å; S263-E276 PolarHBondContact OG-OE2 3.18Å
264	R	41.6	Very low	49	Very low	230 Å²	230	97.6 Å²	97.6	87%	0.868	49%	0.488	S	S	*	.			trans	-93.4	59.3	171.9	-153.5	177.4	-169.7	-173.6	2.9	109.3	L262	L262-R264 PolarHBondContact O-N 2.67Å
265	G	33.8	Very low	46.8	Very low	56 Å²	56	103 Å²	103	58%	0.577	51%	0.508	S	S	*	.	S	Bend	trans	-144.5	96.8	172.3	0	0	0	0	0	109.4	S263 K267	S263-G265 VanDerWaalsContact C-N 3.27Å; S263-G265 PolarHBondContact O-N 2.85Å; G265-K267 PolarHBondContact O-N 3.08Å
266	R	36.5	Very low	45	Very low	259 Å²	259	107.6 Å²	107.6	98%	0.977	53%	0.529	S	S	*	.			trans	-14.6	92	172.2	-80.4	176.3	173	166.4	-2.2	114
267	K	32.7	Very low	43.4	Very low	190 Å²	190	115.6 Å²	115.6	83%	0.826	56%	0.559	S	S	*	*			trans	-137.6	143.7	153.8	-78.4	-171.6	-179.5	171.9	0	109.7	G265	G265-K267 PolarHBondContact O-N 3.08Å
268	P	36.8	Very low	42.6	Very low	120 Å²	120	116.7 Å²	116.7	78%	0.779	57%	0.566	S	S	*	*			trans	-69.6	141.2	-167	-6.7	22	0	0	0	111.4	S270	P268-S270 PolarHBondContact O-N 2.91Å
269	Q	42.1	Very low	42.4	Very low	202 Å²	202	121.1 Å²	121.1	94%	0.944	60%	0.596	S	S	*	*	S	Bend	trans	-51.2	86.8	173.1	-175.8	174.1	-3.9	0	0	112.8
270	S	33.8	Very low	42.8	Very low	107 Å²	107	123.1 Å²	123.1	75%	0.748	61%	0.611	S	S	*	*			trans	-157.6	9.6	166.5	64.2	0	0	0	0	116.8	P268	P268-S270 PolarHBondContact O-N 2.91Å
271	R	34.5	Very low	43.6	Very low	217 Å²	217	119.3 Å²	119.3	82%	0.819	60%	0.597	S	S	*	*	S	Bend	trans	-124.1	136.8	176.9	-74.7	-174.8	176	177.8	-1	113.2
272	P	37.1	Very low	45.1	Very low	102 Å²	102	119.3 Å²	119.3	66%	0.662	60%	0.597	S	S	*	*			trans	-79.4	134.3	-169.6	32.3	-33.4	0	0	0	111	Q274	P272-Q274 VanDerWaalsContact C-N 3.31Å; P272-Q274 PolarHBondContact O-N 3.44Å
273	L	40.4	Very low	47.2	Very low	78 Å²	78	118.3 Å²	118.3	41%	0.408	60%	0.601	S	S	.	*			trans	24.4	61.2	154	-71.3	154.7	0	0	0	115.1	P195 M196 W412	P195-L273 HydrophobicContact CB-CB 3.59Å; P195-L273 HydrophobicContact CB-CD1 3.42Å; P195-L273 VanDerWaalsContact CB-CD1 3.42Å; P195-L273 HydrophobicContact CB-CG 4.11Å; P195-L273 HydrophobicContact CG-CD1 3.56Å; M196-L273 HydrophobicContact CE-CD1 4.14Å; M196-L273 HydrophobicContact CE-CD2 4Å; L273-W412 HydrophobicContact CD1-CZ2 4.19Å
274	Q	38	Very low	49.3	Very low	138 Å²	138	117.5 Å²	117.5	65%	0.645	59%	0.593	S	S	*	*			trans	-94.6	135.7	171.4	-84.5	-177.1	-11.6	0	0	109.6	P272 E276	P272-Q274 VanDerWaalsContact C-N 3.31Å; P272-Q274 PolarHBondContact O-N 3.44Å; Q274-E276 VanDerWaalsContact C-N 3.29Å; Q274-E276 PolarHBondContact O-N 2.94Å
275	W	40.6	Very low	51.2	Low	116 Å²	116	106.7 Å²	106.7	44%	0.439	55%	0.553	S	S	.	*			trans	-63.4	84.2	172.7	-170	-77.8	0	0	0	109.5	Y251 S255 R277	Y251-W275 HydrophobicContact CE1-CH2 4.45Å; Y251-W275 HydrophobicContact CE1-CZ2 4.33Å; S255-W275 WeakPolarHBondContact OG-CZ2 3.42Å; W275-R277 PolarHBondContact O-N 2.86Å
276	E	44.5	Very low	53.7	Low	105 Å²	105	107.2 Å²	107.2	49%	0.491	54%	0.544	S	S	.	.			trans	-83	106.7	179.8	-72.7	-155.9	152	0	0	110.8	S263 Q274 S278	S263-E276 PolarHBondContact OG-OE2 3.18Å; Q274-E276 VanDerWaalsContact C-N 3.29Å; Q274-E276 PolarHBondContact O-N 2.94Å; E276-S278 PolarHBondContact O-N 3.47Å
277	R	46.5	Very low	56.1	Low	178 Å²	178	96.3 Å²	96.3	67%	0.672	51%	0.513	S	S	*	.			trans	-72.2	106.3	174.1	-81.6	179	172.3	152.4	-2.3	110.1	W275	W275-R277 PolarHBondContact O-N 2.86Å
278	S	59.9	Low	58.7	Low	26 Å²	26	87.7 Å²	87.7	18%	0.182	48%	0.478	C	S	.	.			trans	-79.2	138.8	148.2	167.2	0	0	0	0	108.6	L262 E276 A280 S281 T282	L262-S278 WeakPolarHBondContact CD2-OG 3.5Å; E276-S278 PolarHBondContact O-N 3.47Å; S278-A280 PolarHBondContact O-N 3.22Å; S278-S281 WeakPolarHBondContact CB-OG 3.2Å; S278-S281 PolarHBondContact O-N 3.3Å; S278-S281 PolarHBondContact O-OG 3.5Å; S278-T282 PolarHBondContact O-N 2.9Å; S278-T282 VanDerWaalsContact O-N 3.13Å; S278-T282 PolarHBondContact O-OG1 3.27Å
279	P	66.1	Low	61.2	Low	110 Å²	110	83 Å²	83	71%	0.714	45%	0.447	S	S	*	.	H	α-helix	trans	-61.1	-33.1	-179.2	23	-32.5	0	0	0	112	A283	P279-A283 WeakPolarHBondContact O-CB 3.46Å; P279-A283 PolarHBondContact O-N 2.87Å
280	A	66.7	Low	63.5	Low	60 Å²	60	77.3 Å²	77.3	50%	0.496	43%	0.426	S	S	.	.	H	α-helix	trans	-70.4	-42.5	179	0	0	0	0	0	112.9	S278 A283 V284	S278-A280 PolarHBondContact O-N 3.22Å; A280-A283 PolarHBondContact O-N 2.91Å; A280-V284 WeakPolarHBondContact O-CG2 3.08Å; A280-V284 PolarHBondContact O-N 3.38Å; A280-V284 VanDerWaalsContact O-N 3.1Å
281	S	68.1	Low	66.2	Low	6 Å²	6	75.4 Å²	75.4	4%	0.042	41%	0.41	C	S	.	.	H	α-helix	trans	-67	-38.2	176.6	43.3	0	0	0	0	112.4	S278 A283 V284 A285	S278-S281 WeakPolarHBondContact CB-OG 3.2Å; S278-S281 PolarHBondContact O-N 3.3Å; S278-S281 PolarHBondContact O-OG 3.5Å; S281-A283 VanDerWaalsContact C-N 3.34Å; S281-V284 PolarHBondContact O-N 3.33Å; S281-A285 WeakPolarHBondContact O-CB 3.28Å; S281-A285 PolarHBondContact O-N 3.12Å
282	T	73.3	Confident	69	Low	41 Å²	41	65.1 Å²	65.1	25%	0.252	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-40.6	176.5	-51.1	0	0	0	0	110.6	S278 A285 V286	S278-T282 PolarHBondContact O-N 2.9Å; S278-T282 VanDerWaalsContact O-N 3.13Å; S278-T282 PolarHBondContact O-OG1 3.27Å; T282-A285 PolarHBondContact O-N 2.99Å; T282-V286 HydrophobicContact CG2-CG2 4.15Å; T282-V286 VanDerWaalsContact O-CB 3.32Å; T282-V286 WeakPolarHBondContact O-CB 3.45Å; T282-V286 VanDerWaalsContact O-CG2 3.23Å; T282-V286 WeakPolarHBondContact O-CG2 3.45Å; T282-V286 PolarHBondContact O-N 3.5Å
283	A	80.2	Confident	71.5	Confident	64 Å²	64	61.1 Å²	61.1	53%	0.529	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-42.6	177	0	0	0	0	0	112.5	P279 A280 S281 G287	P279-A283 WeakPolarHBondContact O-CB 3.46Å; P279-A283 PolarHBondContact O-N 2.87Å; A280-A283 PolarHBondContact O-N 2.91Å; S281-A283 VanDerWaalsContact C-N 3.34Å; A283-G287 WeakPolarHBondContact O-CA 3.34Å; A283-G287 PolarHBondContact O-N 2.92Å
284	V	81.6	Confident	73.8	Confident	62 Å²	62	61.3 Å²	61.3	38%	0.376	35%	0.353	S	S	.	.	H	α-helix	trans	-67.2	-43	177.4	175.9	0	0	0	0	111.6	M258 A280 S281 G288 L332	M258-V284 HydrophobicContact CE-CB 4.45Å; M258-V284 HydrophobicContact CE-CG1 3.89Å; A280-V284 WeakPolarHBondContact O-CG2 3.08Å; A280-V284 PolarHBondContact O-N 3.38Å; A280-V284 VanDerWaalsContact O-N 3.1Å; S281-V284 PolarHBondContact O-N 3.33Å; V284-G288 PolarHBondContact O-N 3.21Å; V284-L332 HydrophobicContact CG1-CD1 4.36Å
285	A	82.7	Confident	76.3	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-46.8	178.8	0	0	0	0	0	112.2	L254 S281 T282 V289	L254-A285 HydrophobicContact CB-CB 3.94Å; S281-A285 WeakPolarHBondContact O-CB 3.28Å; S281-A285 PolarHBondContact O-N 3.12Å; T282-A285 PolarHBondContact O-N 2.99Å; A285-V289 WeakPolarHBondContact O-CB 3.19Å; A285-V289 WeakPolarHBondContact O-CG2 3.38Å; A285-V289 PolarHBondContact O-N 2.88Å; A285-V289 VanDerWaalsContact O-N 3.12Å
286	V	85.9	Confident	78.5	Confident	66 Å²	66	50.6 Å²	50.6	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-42.6	177.3	174.2	0	0	0	0	110.7	T282 V289 V290	T282-V286 HydrophobicContact CG2-CG2 4.15Å; T282-V286 VanDerWaalsContact O-CB 3.32Å; T282-V286 WeakPolarHBondContact O-CB 3.45Å; T282-V286 VanDerWaalsContact O-CG2 3.23Å; T282-V286 WeakPolarHBondContact O-CG2 3.45Å; T282-V286 PolarHBondContact O-N 3.5Å; V286-V289 PolarHBondContact O-N 2.97Å; V286-V290 HydrophobicContact CG1-CG2 4.21Å; V286-V290 WeakPolarHBondContact O-CB 3.34Å; V286-V290 VanDerWaalsContact O-CG2 3.29Å; V286-V290 WeakPolarHBondContact O-CG2 3.37Å; V286-V290 PolarHBondContact O-N 3.37Å
287	G	86.8	Confident	80.6	Confident	31 Å²	31	50.6 Å²	50.6	32%	0.32	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-52	176.6	0	0	0	0	0	111.9	A283 V289 V290 T291	A283-G287 WeakPolarHBondContact O-CA 3.34Å; A283-G287 PolarHBondContact O-N 2.92Å; G287-V289 VanDerWaalsContact C-N 3.29Å; G287-V289 PolarHBondContact O-N 2.91Å; G287-V290 PolarHBondContact O-N 3.18Å; G287-T291 WeakPolarHBondContact O-CB 3.47Å; G287-T291 PolarHBondContact O-N 3.49Å; G287-T291 PolarHBondContact O-OG1 3.37Å
288	G	87.4	Confident	82.5	Confident	8 Å²	8	48.6 Å²	48.6	8%	0.082	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-39.3	177.5	0	0	0	0	0	113.1	V284 Q292	V284-G288 PolarHBondContact O-N 3.21Å; G288-Q292 WeakPolarHBondContact O-CB 3.48Å; G288-Q292 PolarHBondContact O-N 2.91Å
289	V	89	Confident	83.6	Confident	21 Å²	21	49.5 Å²	49.5	13%	0.127	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-46.1	175.9	164	0	0	0	0	112.2	V247 L250 Y251 A285 V286 G287 Q292 G293	V247-V289 HydrophobicContact CG1-CG1 3.59Å; L250-V289 HydrophobicContact CB-CG2 4.32Å; L250-V289 HydrophobicContact CD2-CB 4.48Å; L250-V289 HydrophobicContact CD2-CG2 3.91Å; L250-V289 HydrophobicContact CG-CG2 3.91Å; Y251-V289 HydrophobicContact CD2-CG2 4.28Å; A285-V289 WeakPolarHBondContact O-CB 3.19Å; A285-V289 WeakPolarHBondContact O-CG2 3.38Å; A285-V289 PolarHBondContact O-N 2.88Å; A285-V289 VanDerWaalsContact O-N 3.12Å; V286-V289 PolarHBondContact O-N 2.97Å; G287-V289 VanDerWaalsContact C-N 3.29Å; G287-V289 PolarHBondContact O-N 2.91Å; V289-Q292 PolarHBondContact O-N 2.88Å; V289-G293 PolarHBondContact O-N 3.23Å
290	V	90.3	Very high	84.2	Confident	84 Å²	84	46.4 Å²	46.4	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-45.8	178.3	170.7	0	0	0	0	110.2	V286 G287 Q292 G293 V294	V286-V290 HydrophobicContact CG1-CG2 4.21Å; V286-V290 WeakPolarHBondContact O-CB 3.34Å; V286-V290 VanDerWaalsContact O-CG2 3.29Å; V286-V290 WeakPolarHBondContact O-CG2 3.37Å; V286-V290 PolarHBondContact O-N 3.37Å; G287-V290 PolarHBondContact O-N 3.18Å; V290-Q292 PolarHBondContact O-N 3.47Å; V290-G293 PolarHBondContact O-N 3.39Å; V290-V294 HydrophobicContact CG1-CG2 4.33Å; V290-V294 WeakPolarHBondContact O-CG2 3.46Å; V290-V294 PolarHBondContact O-N 3.42Å
291	T	91.6	Very high	84.7	Confident	67 Å²	67	50.6 Å²	50.6	41%	0.411	29%	0.285	S	S	.	.	H	α-helix	trans	-60.3	-45.4	177.2	-54.3	0	0	0	0	111.4	G287 V294 L295 L325	G287-T291 WeakPolarHBondContact O-CB 3.47Å; G287-T291 PolarHBondContact O-N 3.49Å; G287-T291 PolarHBondContact O-OG1 3.37Å; T291-V294 PolarHBondContact O-N 2.98Å; T291-L295 HydrophobicContact CG2-CD1 4.07Å; T291-L295 WeakPolarHBondContact O-CB 3.28Å; T291-L295 VanDerWaalsContact O-CG 3.3Å; T291-L295 WeakPolarHBondContact O-CG 3.39Å; T291-L295 PolarHBondContact O-N 2.95Å; T291-L325 HydrophobicContact CG2-CD1 4.39Å; T291-L325 HydrophobicContact CG2-CD2 4.07Å
292	Q	91.6	Very high	84.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-44.9	176.3	-171.7	179.5	-75	0	0	111.7	L250 G288 V289 V290 V294 L295 L296 L322 L325 R326	L250-Q292 HydrophobicContact CD2-CB 3.78Å; L250-Q292 HydrophobicContact CD2-CG 4.28Å; L250-Q292 VanDerWaalsContact CD2-OE1 3.27Å; G288-Q292 WeakPolarHBondContact O-CB 3.48Å; G288-Q292 PolarHBondContact O-N 2.91Å; V289-Q292 PolarHBondContact O-N 2.88Å; V290-Q292 PolarHBondContact O-N 3.47Å; Q292-V294 PolarHBondContact O-N 3.17Å; Q292-L295 PolarHBondContact O-N 3.45Å; Q292-L296 HydrophobicContact CG-CD1 4.09Å; Q292-L296 HydrophobicContact CG-CG 4.44Å; Q292-L296 WeakPolarHBondContact O-CG 3.45Å; Q292-L296 PolarHBondContact O-N 2.99Å; Q292-L322 HydrophobicContact CG-CD2 4.13Å; Q292-L325 HydrophobicContact CB-CD2 3.9Å; Q292-R326 VanDerWaalsContact OE1-CZ 3.25Å
293	G	89.4	Confident	84.3	Confident	18 Å²	18	55.1 Å²	55.1	19%	0.186	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-42.5	178.8	0	0	0	0	0	112.9	V289 V290 L296 L297	V289-G293 PolarHBondContact O-N 3.23Å; V290-G293 PolarHBondContact O-N 3.39Å; G293-L296 PolarHBondContact O-N 3.27Å; G293-L297 WeakPolarHBondContact O-CG 3.49Å; G293-L297 PolarHBondContact O-N 3.25Å
294	V	90.4	Very high	83.3	Confident	83 Å²	83	55 Å²	55	50%	0.503	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-42.4	176.4	169.9	0	0	0	0	111.3	V290 T291 Q292 L297 W298	V290-V294 HydrophobicContact CG1-CG2 4.33Å; V290-V294 WeakPolarHBondContact O-CG2 3.46Å; V290-V294 PolarHBondContact O-N 3.42Å; T291-V294 PolarHBondContact O-N 2.98Å; Q292-V294 PolarHBondContact O-N 3.17Å; V294-L297 PolarHBondContact O-N 3.19Å; V294-W298 PolarHBondContact O-N 3.43Å
295	L	89.9	Confident	81.8	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-68.1	-37.5	179.2	-72.6	173	0	0	0	112.6	T291 Q292 W298 E299 L321 L322 L325	T291-L295 HydrophobicContact CG2-CD1 4.07Å; T291-L295 WeakPolarHBondContact O-CB 3.28Å; T291-L295 VanDerWaalsContact O-CG 3.3Å; T291-L295 WeakPolarHBondContact O-CG 3.39Å; T291-L295 PolarHBondContact O-N 2.95Å; Q292-L295 PolarHBondContact O-N 3.45Å; L295-W298 WeakPolarHBondContact O-CB 3.32Å; L295-W298 PolarHBondContact O-N 3.34Å; L295-E299 WeakPolarHBondContact O-CB 3.23Å; L295-E299 PolarHBondContact O-N 2.97Å; L295-L321 HydrophobicContact CD1-CB 4.1Å; L295-L321 HydrophobicContact CD2-CB 3.82Å; L295-L321 HydrophobicContact CD2-CD1 3.92Å; L295-L322 HydrophobicContact CB-CD1 4.3Å; L295-L322 HydrophobicContact CB-CD2 3.4Å; L295-L322 HydrophobicContact CB-CG 3.65Å; L295-L322 HydrophobicContact CD1-CD2 3.95Å; L295-L322 HydrophobicContact CD1-CG 4.19Å; L295-L322 HydrophobicContact CG-CD2 4.34Å; L295-L325 HydrophobicContact CD1-CD2 4.08Å
296	L	87.4	Confident	80.1	Confident	13 Å²	13	61.3 Å²	61.3	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-40.6	173.6	-73.2	170	0	0	0	111.8	M243 Q292 G293 W298 E299 Q300 L322	M243-L296 HydrophobicContact CB-CD1 4.48Å; M243-L296 HydrophobicContact CE-CB 4.25Å; M243-L296 WeakPolarHBondContact CE-O 3.34Å; M243-L296 HydrophobicContact CG-CB 4.29Å; M243-L296 HydrophobicContact CG-CD1 4.33Å; M243-L296 HydrophobicContact SD-CB 4.1Å; Q292-L296 HydrophobicContact CG-CD1 4.09Å; Q292-L296 HydrophobicContact CG-CG 4.44Å; Q292-L296 WeakPolarHBondContact O-CG 3.45Å; Q292-L296 PolarHBondContact O-N 2.99Å; G293-L296 PolarHBondContact O-N 3.27Å; L296-W298 VanDerWaalsContact C-N 3.35Å; L296-E299 PolarHBondContact O-N 3.42Å; L296-Q300 PolarHBondContact O-N 3.07Å; L296-Q300 VanDerWaalsContact O-N 3.08Å; L296-L322 HydrophobicContact CD2-CD1 3.95Å; L296-L322 HydrophobicContact CD2-CD2 4.41Å; L296-L322 HydrophobicContact CG-CD1 4.46Å; L296-L322 HydrophobicContact CG-CD2 4.25Å
297	L	87.3	Confident	78.1	Confident	104 Å²	104	62.8 Å²	62.8	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-67.3	-36.3	174.9	-71.5	171.6	0	0	0	112.2	M243 G293 V294 Y301	M243-L297 HydrophobicContact SD-CD2 4.32Å; G293-L297 WeakPolarHBondContact O-CG 3.49Å; G293-L297 PolarHBondContact O-N 3.25Å; V294-L297 PolarHBondContact O-N 3.19Å; L297-Y301 WeakPolarHBondContact O-CB 3.42Å; L297-Y301 PolarHBondContact O-N 3.24Å
298	W	86.7	Confident	76	Confident	137 Å²	137	66.2 Å²	66.2	52%	0.519	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-52	172.7	-174.6	-41	0	0	0	109.9	V294 L295 L296 Q300 Y301 S302 A318	V294-W298 PolarHBondContact O-N 3.43Å; L295-W298 WeakPolarHBondContact O-CB 3.32Å; L295-W298 PolarHBondContact O-N 3.34Å; L296-W298 VanDerWaalsContact C-N 3.35Å; W298-Q300 VanDerWaalsContact C-N 3.3Å; W298-Q300 PolarHBondContact O-N 3.45Å; W298-Y301 PolarHBondContact O-N 3.24Å; W298-Y301 VanDerWaalsContact O-N 3.08Å; W298-S302 WeakPolarHBondContact O-CB 3.32Å; W298-S302 PolarHBondContact O-N 3.45Å; W298-A318 HydrophobicContact CB-CB 4.17Å; W298-A318 HydrophobicContact CG-CB 3.88Å
299	E	82.8	Confident	73.5	Confident	45 Å²	45	74.1 Å²	74.1	21%	0.21	38%	0.379	C	S	.	.	H	α-helix	trans	-53	-49.1	-179.6	-173.2	167.8	-134.6	0	0	111.1	L295 L296 Y301 S302 E303 A318 L322	L295-E299 WeakPolarHBondContact O-CB 3.23Å; L295-E299 PolarHBondContact O-N 2.97Å; L296-E299 PolarHBondContact O-N 3.42Å; E299-Y301 PolarHBondContact O-N 2.94Å; E299-S302 PolarHBondContact O-N 3.4Å; E299-E303 WeakPolarHBondContact O-CG 3.4Å; E299-E303 PolarHBondContact O-N 3.49Å; E299-A318 HydrophobicContact CB-CB 4.09Å; E299-L322 WeakPolarHBondContact OE2-CD1 3.42Å
300	Q	79.5	Confident	71.1	Confident	44 Å²	44	75.8 Å²	75.8	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-61.3	-39.9	176.7	-175.4	177.5	24.4	0	0	113.6	E239 M243 L296 W298 S304	E239-Q300 PolarHBondContact OE2-NE2 3.42Å; M243-Q300 HydrophobicContact CE-CB 3.66Å; M243-Q300 HydrophobicContact CE-CG 4.15Å; L296-Q300 PolarHBondContact O-N 3.07Å; L296-Q300 VanDerWaalsContact O-N 3.08Å; W298-Q300 VanDerWaalsContact C-N 3.3Å; W298-Q300 PolarHBondContact O-N 3.45Å; Q300-S304 PolarHBondContact O-N 3.45Å
301	Y	76.4	Confident	68.6	Low	149 Å²	149	78 Å²	78	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-68.5	-41	176.4	-175.7	-102.4	0	0	0	112	L297 W298 E299 E303 S304 E305	L297-Y301 WeakPolarHBondContact O-CB 3.42Å; L297-Y301 PolarHBondContact O-N 3.24Å; W298-Y301 PolarHBondContact O-N 3.24Å; W298-Y301 VanDerWaalsContact O-N 3.08Å; E299-Y301 PolarHBondContact O-N 2.94Å; Y301-E303 VanDerWaalsContact C-N 3.32Å; Y301-E303 PolarHBondContact O-N 3.19Å; Y301-S304 PolarHBondContact O-N 3.03Å; Y301-E305 WeakPolarHBondContact CE1-OE2 3.45Å; Y301-E305 PolarHBondContact O-N 2.89Å; Y301-E305 VanDerWaalsContact O-N 3.11Å
302	S	69.3	Low	66.4	Low	42 Å²	42	80.4 Å²	80.4	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-65.4	-36.1	178.9	-173.5	0	0	0	0	112.1	W298 E299 S306	W298-S302 WeakPolarHBondContact O-CB 3.32Å; W298-S302 PolarHBondContact O-N 3.45Å; E299-S302 PolarHBondContact O-N 3.4Å; S302-S306 VanDerWaalsContact O-CB 3.25Å; S302-S306 WeakPolarHBondContact O-CB 3.49Å; S302-S306 PolarHBondContact O-N 2.73Å; S302-S306 PolarHBondContact O-OG 3Å; S302-S306 VanDerWaalsContact O-OG 3.11Å
303	E	64.8	Low	63.9	Low	99 Å²	99	83.4 Å²	83.4	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-65.6	-43.9	174.7	-74.8	176.3	169.9	0	0	110.9	E299 Y301 E305 S306	E299-E303 WeakPolarHBondContact O-CG 3.4Å; E299-E303 PolarHBondContact O-N 3.49Å; Y301-E303 VanDerWaalsContact C-N 3.32Å; Y301-E303 PolarHBondContact O-N 3.19Å; E303-E305 VanDerWaalsContact C-N 3.32Å; E303-E305 PolarHBondContact O-N 3.21Å; E303-S306 PolarHBondContact O-N 3.47Å; E303-S306 PolarHBondContact O-OG 3.27Å; E303-S306 VanDerWaalsContact O-OG 3.11Å
304	S	58.4	Low	61.7	Low	61 Å²	61	87.6 Å²	87.6	43%	0.427	44%	0.437	S	S	.	.	H	α-helix	trans	-63.8	-30.5	178.2	-171.2	0	0	0	0	114.2	Q300 Y301	Q300-S304 PolarHBondContact O-N 3.45Å; Y301-S304 PolarHBondContact O-N 3.03Å
305	E	50.7	Low	59.9	Low	135 Å²	135	92.9 Å²	92.9	63%	0.631	45%	0.448	S	S	*	.	H	α-helix	trans	-88.9	-18.5	-178.5	-160.4	174.4	-167.7	0	0	112.6	Y301 E303 E307	Y301-E305 WeakPolarHBondContact CE1-OE2 3.45Å; Y301-E305 PolarHBondContact O-N 2.89Å; Y301-E305 VanDerWaalsContact O-N 3.11Å; E303-E305 VanDerWaalsContact C-N 3.32Å; E303-E305 PolarHBondContact O-N 3.21Å; E305-E307 VanDerWaalsContact C-N 3.31Å; E305-E307 PolarHBondContact O-N 3.21Å
306	S	47	Very low	58.9	Low	64 Å²	64	93 Å²	93	45%	0.448	45%	0.45	S	S	.	.			trans	-88.1	33.3	-171	68.6	0	0	0	0	115.5	S302 E303 H308	S302-S306 VanDerWaalsContact O-CB 3.25Å; S302-S306 WeakPolarHBondContact O-CB 3.49Å; S302-S306 PolarHBondContact O-N 2.73Å; S302-S306 PolarHBondContact O-OG 3Å; S302-S306 VanDerWaalsContact O-OG 3.11Å; E303-S306 PolarHBondContact O-N 3.47Å; E303-S306 PolarHBondContact O-OG 3.27Å; E303-S306 VanDerWaalsContact O-OG 3.11Å; S306-H308 PolarHBondContact O-N 2.94Å
307	E	44.4	Very low	58.5	Low	98 Å²	98	97.5 Å²	97.5	46%	0.458	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-12.3	178.9	-75.8	-165.6	131.4	0	0	114.5	E305	E305-E307 VanDerWaalsContact C-N 3.31Å; E305-E307 PolarHBondContact O-N 3.21Å
308	H	40.7	Very low	58.4	Low	103 Å²	103	92.6 Å²	92.6	48%	0.477	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-14.2	-168.5	-74.2	67.9	0	0	0	117	S306	S306-H308 PolarHBondContact O-N 2.94Å
309	H	36.4	Very low	58.2	Low	174 Å²	174	86.5 Å²	86.5	81%	0.806	43%	0.428	S	S	*	.			trans	-136.6	86.7	-180	-73.8	-19.2	0	0	0	113	Y311	H309-Y311 PolarHBondContact O-N 3.27Å
310	S	38.7	Very low	58.4	Low	55 Å²	55	90 Å²	90	39%	0.385	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	73.6	-175.5	49.8	0	0	0	0	113.5	K42	K42-S310 VanDerWaalsContact CD-OG 3.24Å; K42-S310 WeakPolarHBondContact CD-OG 3.4Å; K42-S310 PolarHBondContact NZ-O 3.11Å
311	Y	38	Very low	58.9	Low	132 Å²	132	91.5 Å²	91.5	52%	0.518	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.7	11.7	155.4	-137.5	-102.3	0	0	0	117.3	H309 D379	H309-Y311 PolarHBondContact O-N 3.27Å; Y311-D379 WeakPolarHBondContact OH-CB 3.42Å; Y311-D379 VanDerWaalsContact OH-CG 3.23Å; Y311-D379 PolarHBondContact OH-OD2 2.94Å
312	H	43.5	Very low	59.6	Low	116 Å²	116	84.8 Å²	84.8	54%	0.537	43%	0.431	S	S	.	.			trans	-127.7	16.9	-173.6	-75.2	-19.2	0	0	0	116.7	Q314 R315 S316	H312-Q314 PolarHBondContact O-N 3.48Å; H312-R315 HydrophobicContact CB-CB 4.09Å; H312-R315 CarbonylContact O-C 3.49Å; H312-R315 VanDerWaalsContact O-C 3.27Å; H312-R315 WeakPolarHBondContact O-CA 3.5Å; H312-R315 PolarHBondContact O-N 2.96Å; H312-S316 PolarHBondContact O-N 2.84Å
313	A	40.8	Very low	60.6	Low	63 Å²	63	84.1 Å²	84.1	52%	0.521	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-52.3	-43.6	174.2	0	0	0	0	0	112.2	R315 S316	A313-R315 PolarHBondContact O-N 3.3Å; A313-S316 WeakPolarHBondContact O-CB 3.46Å; A313-S316 PolarHBondContact O-N 3.41Å; A313-S316 VanDerWaalsContact O-N 3.16Å; A313-S316 PolarHBondContact O-OG 2.82Å
314	Q	43	Very low	62	Low	107 Å²	107	82 Å²	82	50%	0.5	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-77.4	-4.4	177.2	-153.6	163.5	-42.9	0	0	114.6	H312 S374 I386	H312-Q314 PolarHBondContact O-N 3.48Å; Q314-S374 PolarHBondContact NE2-OG 3.32Å; Q314-I386 VanDerWaalsContact NE2-CD1 3.31Å
315	R	52.6	Low	63.6	Low	193 Å²	193	80.6 Å²	80.6	73%	0.728	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-111.3	10	172.4	-133.9	177.7	-159.5	169.9	5.8	111.9	H312 A313 L317	H312-R315 HydrophobicContact CB-CB 4.09Å; H312-R315 CarbonylContact O-C 3.49Å; H312-R315 VanDerWaalsContact O-C 3.27Å; H312-R315 WeakPolarHBondContact O-CA 3.5Å; H312-R315 PolarHBondContact O-N 2.96Å; A313-R315 PolarHBondContact O-N 3.3Å; R315-L317 PolarHBondContact O-N 2.9Å
316	S	68.2	Low	65.6	Low	19 Å²	19	74.7 Å²	74.7	13%	0.133	38%	0.383	C	S	.	.			trans	-58	131.6	174	82.4	0	0	0	0	107.8	H312 A313 A318 G319 L320	H312-S316 PolarHBondContact O-N 2.84Å; A313-S316 WeakPolarHBondContact O-CB 3.46Å; A313-S316 PolarHBondContact O-N 3.41Å; A313-S316 VanDerWaalsContact O-N 3.16Å; A313-S316 PolarHBondContact O-OG 2.82Å; S316-A318 PolarHBondContact O-N 2.98Å; S316-G319 PolarHBondContact O-N 3.41Å; S316-G319 VanDerWaalsContact O-N 3.16Å; S316-G319 PolarHBondContact OG-N 3.16Å; S316-G319 VanDerWaalsContact OG-N 3.07Å; S316-L320 PolarHBondContact O-N 2.68Å; S316-L320 VanDerWaalsContact O-N 3.11Å
317	L	79.2	Confident	67.9	Low	108 Å²	108	74.3 Å²	74.3	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-59.3	-31.7	-179	-177.8	140	0	0	0	110.3	R315 L321	R315-L317 PolarHBondContact O-N 2.9Å; L317-L321 HydrophobicContact CD2-CD1 3.5Å; L317-L321 HydrophobicContact CD2-CG 4.16Å; L317-L321 HydrophobicContact CG-CD1 4.39Å; L317-L321 WeakPolarHBondContact O-CB 3.28Å; L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 2.97Å
318	A	84.3	Confident	70.3	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-50.8	174	0	0	0	0	0	112.8	W298 E299 S316 L320 L321 L322	W298-A318 HydrophobicContact CB-CB 4.17Å; W298-A318 HydrophobicContact CG-CB 3.88Å; E299-A318 HydrophobicContact CB-CB 4.09Å; S316-A318 PolarHBondContact O-N 2.98Å; A318-L320 VanDerWaalsContact C-N 3.34Å; A318-L320 PolarHBondContact O-N 2.85Å; A318-L321 PolarHBondContact O-N 2.97Å; A318-L322 WeakPolarHBondContact O-CG 3.36Å; A318-L322 PolarHBondContact O-N 3.2Å
319	G	83.3	Confident	72.7	Confident	9 Å²	9	67.9 Å²	67.9	9%	0.093	36%	0.357	C	S	.	.	H	α-helix	trans	-60.8	-41.2	177.5	0	0	0	0	0	112.4	S316 L321 L322 L323	S316-G319 PolarHBondContact O-N 3.41Å; S316-G319 VanDerWaalsContact O-N 3.16Å; S316-G319 PolarHBondContact OG-N 3.16Å; S316-G319 VanDerWaalsContact OG-N 3.07Å; G319-L321 PolarHBondContact O-N 2.76Å; G319-L322 WeakPolarHBondContact O-CB 3.36Å; G319-L322 PolarHBondContact O-N 3.21Å; G319-L323 VanDerWaalsContact O-CG 3.32Å; G319-L323 WeakPolarHBondContact O-CG 3.36Å; G319-L323 PolarHBondContact O-N 3.29Å
320	L	86.7	Confident	75.4	Confident	118 Å²	118	59.8 Å²	59.8	62%	0.618	32%	0.32	S	S	*	.	H	α-helix	trans	-64.7	-40.5	175.5	-172.1	67.8	0	0	0	112.4	S316 A318 L323 A324	S316-L320 PolarHBondContact O-N 2.68Å; S316-L320 VanDerWaalsContact O-N 3.11Å; A318-L320 VanDerWaalsContact C-N 3.34Å; A318-L320 PolarHBondContact O-N 2.85Å; L320-L323 WeakPolarHBondContact O-CB 3.43Å; L320-L323 PolarHBondContact O-N 3.38Å; L320-A324 WeakPolarHBondContact O-CB 3.3Å; L320-A324 PolarHBondContact O-N 3Å
321	L	90.8	Very high	78	Confident	77 Å²	77	62.7 Å²	62.7	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-66.8	-37.3	175.1	-73.4	178.9	0	0	0	112	L295 L317 A318 G319 A324 L325	L295-L321 HydrophobicContact CD1-CB 4.1Å; L295-L321 HydrophobicContact CD2-CB 3.82Å; L295-L321 HydrophobicContact CD2-CD1 3.92Å; L317-L321 HydrophobicContact CD2-CD1 3.5Å; L317-L321 HydrophobicContact CD2-CG 4.16Å; L317-L321 HydrophobicContact CG-CD1 4.39Å; L317-L321 WeakPolarHBondContact O-CB 3.28Å; L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 2.97Å; A318-L321 PolarHBondContact O-N 2.97Å; G319-L321 PolarHBondContact O-N 2.76Å; L321-A324 PolarHBondContact O-N 3.27Å; L321-L325 VanDerWaalsContact O-CB 3.32Å; L321-L325 WeakPolarHBondContact O-CB 3.32Å; L321-L325 PolarHBondContact O-N 3.02Å
322	L	90.1	Very high	80.5	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-46.4	173.3	-78.4	167.7	0	0	0	111.2	Q292 L295 L296 E299 A318 G319 L325 R326	Q292-L322 HydrophobicContact CG-CD2 4.13Å; L295-L322 HydrophobicContact CB-CD1 4.3Å; L295-L322 HydrophobicContact CB-CD2 3.4Å; L295-L322 HydrophobicContact CB-CG 3.65Å; L295-L322 HydrophobicContact CD1-CD2 3.95Å; L295-L322 HydrophobicContact CD1-CG 4.19Å; L295-L322 HydrophobicContact CG-CD2 4.34Å; L296-L322 HydrophobicContact CD2-CD1 3.95Å; L296-L322 HydrophobicContact CD2-CD2 4.41Å; L296-L322 HydrophobicContact CG-CD1 4.46Å; L296-L322 HydrophobicContact CG-CD2 4.25Å; E299-L322 WeakPolarHBondContact OE2-CD1 3.42Å; A318-L322 WeakPolarHBondContact O-CG 3.36Å; A318-L322 PolarHBondContact O-N 3.2Å; G319-L322 WeakPolarHBondContact O-CB 3.36Å; G319-L322 PolarHBondContact O-N 3.21Å; L322-L325 PolarHBondContact O-N 3.32Å; L322-R326 WeakPolarHBondContact O-CG 3.5Å; L322-R326 PolarHBondContact O-N 2.95Å
323	L	91.5	Very high	82.7	Confident	27 Å²	27	53.7 Å²	53.7	14%	0.141	30%	0.295	C	S	.	.	H	α-helix	trans	-57.8	-49.2	175	-74.5	164.1	0	0	0	111.4	G319 L320 L325 R326 V327 H367 P368 V371	G319-L323 VanDerWaalsContact O-CG 3.32Å; G319-L323 WeakPolarHBondContact O-CG 3.36Å; G319-L323 PolarHBondContact O-N 3.29Å; L320-L323 WeakPolarHBondContact O-CB 3.43Å; L320-L323 PolarHBondContact O-N 3.38Å; L323-L325 PolarHBondContact O-N 2.91Å; L323-R326 PolarHBondContact O-N 2.85Å; L323-V327 WeakPolarHBondContact O-CG2 3.17Å; L323-V327 PolarHBondContact O-N 3.41Å; L323-H367 WeakPolarHBondContact CD2-CD2 3.35Å; L323-P368 VanDerWaalsContact CD2-CA 3.43Å; L323-P368 HydrophobicContact CD2-CB 3.75Å; L323-V371 HydrophobicContact CD1-CG1 4.18Å; L323-V371 HydrophobicContact CD1-CG2 4.31Å; L323-V371 HydrophobicContact CD2-CB 4.37Å; L323-V371 HydrophobicContact CD2-CG2 4.04Å
324	A	93.1	Very high	85.1	Confident	56 Å²	56	52.2 Å²	52.2	46%	0.463	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-43.2	178	0	0	0	0	0	112	L320 L321 V327 A328	L320-A324 WeakPolarHBondContact O-CB 3.3Å; L320-A324 PolarHBondContact O-N 3Å; L321-A324 PolarHBondContact O-N 3.27Å; A324-V327 PolarHBondContact O-N 3.24Å; A324-A328 WeakPolarHBondContact O-CB 3.23Å; A324-A328 PolarHBondContact O-N 3.01Å
325	L	92.7	Very high	87.3	Confident	31 Å²	31	49.9 Å²	49.9	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-45.9	175.8	178.3	67.5	0	0	0	111.4	T291 Q292 L295 L321 L322 L323 V327 A328 L329	T291-L325 HydrophobicContact CG2-CD1 4.39Å; T291-L325 HydrophobicContact CG2-CD2 4.07Å; Q292-L325 HydrophobicContact CB-CD2 3.9Å; L295-L325 HydrophobicContact CD1-CD2 4.08Å; L321-L325 VanDerWaalsContact O-CB 3.32Å; L321-L325 WeakPolarHBondContact O-CB 3.32Å; L321-L325 PolarHBondContact O-N 3.02Å; L322-L325 PolarHBondContact O-N 3.32Å; L323-L325 PolarHBondContact O-N 2.91Å; L325-V327 VanDerWaalsContact C-N 3.35Å; L325-V327 PolarHBondContact O-N 3.39Å; L325-A328 PolarHBondContact O-N 3.32Å; L325-L329 HydrophobicContact CD1-CD1 3.98Å; L325-L329 HydrophobicContact CD1-CG 4.09Å; L325-L329 HydrophobicContact CD2-CD1 4.48Å; L325-L329 HydrophobicContact CG-CD1 3.86Å; L325-L329 HydrophobicContact CG-CG 4.35Å; L325-L329 WeakPolarHBondContact O-CB 3.34Å; L325-L329 VanDerWaalsContact O-CG 3.28Å; L325-L329 WeakPolarHBondContact O-CG 3.31Å; L325-L329 PolarHBondContact O-N 2.81Å
326	R	92.9	Very high	88.9	Confident	11 Å²	11	41.5 Å²	41.5	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-43.6	178.5	-69	-79.5	-179.2	151.4	2	111.5	Q292 L322 L323 S330	Q292-R326 VanDerWaalsContact OE1-CZ 3.25Å; L322-R326 WeakPolarHBondContact O-CG 3.5Å; L322-R326 PolarHBondContact O-N 2.95Å; L323-R326 PolarHBondContact O-N 2.85Å; R326-S330 WeakPolarHBondContact O-CB 3.48Å; R326-S330 PolarHBondContact O-N 3.36Å
327	V	95.1	Very high	89.8	Confident	55 Å²	55	41 Å²	41	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-63.8	-48.2	175.7	174.6	0	0	0	0	110.7	L323 A324 L325 L329 S330 L331 P368	L323-V327 WeakPolarHBondContact O-CG2 3.17Å; L323-V327 PolarHBondContact O-N 3.41Å; A324-V327 PolarHBondContact O-N 3.24Å; L325-V327 VanDerWaalsContact C-N 3.35Å; L325-V327 PolarHBondContact O-N 3.39Å; V327-L329 PolarHBondContact O-N 2.94Å; V327-S330 PolarHBondContact O-N 2.74Å; V327-S330 VanDerWaalsContact O-N 3.15Å; V327-S330 PolarHBondContact O-OG 3.06Å; V327-L331 HydrophobicContact CG1-CD1 4.27Å; V327-L331 WeakPolarHBondContact O-CG 3.46Å; V327-L331 PolarHBondContact O-N 3.01Å; V327-P368 HydrophobicContact CG2-CB 3.94Å; V327-P368 HydrophobicContact CG2-CG 3.98Å
328	A	94.2	Very high	90.3	Very high	54 Å²	54	44 Å²	44	45%	0.446	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-45.9	179.1	0	0	0	0	0	112.5	A324 L325 S330 L331 L332	A324-A328 WeakPolarHBondContact O-CB 3.23Å; A324-A328 PolarHBondContact O-N 3.01Å; L325-A328 PolarHBondContact O-N 3.32Å; A328-S330 VanDerWaalsContact C-N 3.32Å; A328-S330 PolarHBondContact O-N 3.18Å; A328-L331 PolarHBondContact O-N 3.35Å; A328-L332 WeakPolarHBondContact O-CB 3.34Å; A328-L332 PolarHBondContact O-N 3.44Å
329	L	91.8	Very high	90.4	Very high	13 Å²	13	49.8 Å²	49.8	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-37.3	176.2	-69.5	174.2	0	0	0	111.8	L250 L254 L325 V327 L333 F364	L250-L329 HydrophobicContact CD1-CD1 4.04Å; L250-L329 HydrophobicContact CD2-CD1 4.41Å; L254-L329 HydrophobicContact CD1-CD2 4.33Å; L254-L329 HydrophobicContact CD2-CD2 4.31Å; L325-L329 HydrophobicContact CD1-CD1 3.98Å; L325-L329 HydrophobicContact CD1-CG 4.09Å; L325-L329 HydrophobicContact CD2-CD1 4.48Å; L325-L329 HydrophobicContact CG-CD1 3.86Å; L325-L329 HydrophobicContact CG-CG 4.35Å; L325-L329 WeakPolarHBondContact O-CB 3.34Å; L325-L329 VanDerWaalsContact O-CG 3.28Å; L325-L329 WeakPolarHBondContact O-CG 3.31Å; L325-L329 PolarHBondContact O-N 2.81Å; V327-L329 PolarHBondContact O-N 2.94Å; L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 PolarHBondContact O-N 3.01Å; L329-F364 HydrophobicContact CB-CD1 4.31Å; L329-F364 HydrophobicContact CB-CE1 3.89Å; L329-F364 HydrophobicContact CD1-CE1 4.13Å
330	S	93.1	Very high	90.3	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.028	28%	0.276	C	S	.	.	H	α-helix	trans	-65.3	-39.6	175.9	79.3	0	0	0	0	112.6	R326 V327 A328 L333 A334 L365	R326-S330 WeakPolarHBondContact O-CB 3.48Å; R326-S330 PolarHBondContact O-N 3.36Å; V327-S330 PolarHBondContact O-N 2.74Å; V327-S330 VanDerWaalsContact O-N 3.15Å; V327-S330 PolarHBondContact O-OG 3.06Å; A328-S330 VanDerWaalsContact C-N 3.32Å; A328-S330 PolarHBondContact O-N 3.18Å; S330-L333 PolarHBondContact O-N 3.35Å; S330-A334 WeakPolarHBondContact O-CB 3.32Å; S330-A334 PolarHBondContact O-N 3.45Å; S330-L365 WeakPolarHBondContact OG-CD2 3.26Å
331	L	93.6	Very high	90.2	Very high	115 Å²	115	46.1 Å²	46.1	60%	0.602	26%	0.256	S	S	*	.	H	α-helix	trans	-67.9	-44.2	176.8	-69.9	174.3	0	0	0	111.5	V327 A328 L333 A334 S335	V327-L331 HydrophobicContact CG1-CD1 4.27Å; V327-L331 WeakPolarHBondContact O-CG 3.46Å; V327-L331 PolarHBondContact O-N 3.01Å; A328-L331 PolarHBondContact O-N 3.35Å; L331-L333 VanDerWaalsContact C-N 3.31Å; L331-L333 PolarHBondContact O-N 3.35Å; L331-A334 WeakPolarHBondContact O-CB 3.35Å; L331-A334 PolarHBondContact O-N 2.97Å; L331-S335 PolarHBondContact O-N 3.31Å
332	L	90.8	Very high	89.8	Confident	58 Å²	58	46 Å²	46	30%	0.304	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-45.5	173.7	168.7	140.2	0	0	0	110.4	M258 V284 A328 A334 S335 I336	M258-L332 HydrophobicContact CE-CD1 4.03Å; M258-L332 HydrophobicContact CE-CD2 3.37Å; M258-L332 HydrophobicContact CE-CG 3.96Å; V284-L332 HydrophobicContact CG1-CD1 4.36Å; A328-L332 WeakPolarHBondContact O-CB 3.34Å; A328-L332 PolarHBondContact O-N 3.44Å; L332-A334 PolarHBondContact O-N 3.48Å; L332-S335 PolarHBondContact O-N 3.31Å; L332-S335 PolarHBondContact O-OG 3.32Å; L332-I336 HydrophobicContact CD2-CD1 3.96Å; L332-I336 HydrophobicContact CG-CD1 4.15Å; L332-I336 WeakPolarHBondContact O-CD1 3.39Å; L332-I336 VanDerWaalsContact O-CG1 3.28Å; L332-I336 WeakPolarHBondContact O-CG1 3.36Å; L332-I336 PolarHBondContact O-N 3.49Å
333	L	88.4	Confident	89.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-40.7	176.2	178.8	54.3	0	0	0	112.9	C257 L329 S330 L331 S335 I336 L337 C360 F364	C257-L333 HydrophobicContact CB-CD1 3.33Å; C257-L333 WeakPolarHBondContact SG-CD1 3.46Å; L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 PolarHBondContact O-N 3.01Å; S330-L333 PolarHBondContact O-N 3.35Å; L331-L333 VanDerWaalsContact C-N 3.31Å; L331-L333 PolarHBondContact O-N 3.35Å; L333-S335 VanDerWaalsContact C-N 3.34Å; L333-S335 PolarHBondContact O-N 2.86Å; L333-I336 PolarHBondContact O-N 3.46Å; L333-L337 HydrophobicContact CD1-CD1 3.71Å; L333-L337 HydrophobicContact CD1-CG 3.89Å; L333-L337 HydrophobicContact CD2-CD1 4.43Å; L333-L337 HydrophobicContact CG-CD1 3.78Å; L333-L337 HydrophobicContact CG-CG 4.41Å; L333-L337 WeakPolarHBondContact O-CB 3.42Å; L333-L337 WeakPolarHBondContact O-CG 3.18Å; L333-L337 PolarHBondContact O-N 3.07Å; L333-C360 HydrophobicContact CD2-CB 3.58Å; L333-F364 HydrophobicContact CD2-CD2 4.04Å; L333-F364 HydrophobicContact CD2-CE2 3.79Å
334	A	91.8	Very high	88.9	Confident	32 Å²	32	51.3 Å²	51.3	26%	0.264	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-45.2	175.3	0	0	0	0	0	112	S330 L331 L332 I336 L337 Y338 F361	S330-A334 WeakPolarHBondContact O-CB 3.32Å; S330-A334 PolarHBondContact O-N 3.45Å; L331-A334 WeakPolarHBondContact O-CB 3.35Å; L331-A334 PolarHBondContact O-N 2.97Å; L332-A334 PolarHBondContact O-N 3.48Å; A334-I336 VanDerWaalsContact C-N 3.28Å; A334-I336 PolarHBondContact O-N 3Å; A334-L337 PolarHBondContact O-N 3.27Å; A334-Y338 WeakPolarHBondContact O-CB 3.42Å; A334-Y338 PolarHBondContact O-N 3.36Å; A334-F361 HydrophobicContact CB-CE1 3.72Å; A334-F361 HydrophobicContact CB-CZ 3.52Å
335	S	89.7	Confident	88.1	Confident	59 Å²	59	60.3 Å²	60.3	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-41.3	179.5	76.8	0	0	0	0	111.7	L331 L332 L333 Q339	L331-S335 PolarHBondContact O-N 3.31Å; L332-S335 PolarHBondContact O-N 3.31Å; L332-S335 PolarHBondContact O-OG 3.32Å; L333-S335 VanDerWaalsContact C-N 3.34Å; L333-S335 PolarHBondContact O-N 2.86Å; S335-Q339 WeakPolarHBondContact O-CG 3.43Å; S335-Q339 PolarHBondContact O-N 2.93Å; S335-Q339 VanDerWaalsContact O-N 3.17Å
336	I	86.4	Confident	87.3	Confident	17 Å²	17	61.1 Å²	61.1	9%	0.087	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-51.4	180	-68.3	168.8	0	0	0	110.5	M258 T261 L332 L333 A334 Y338 Q339 I340	M258-I336 HydrophobicContact CE-CD1 3.22Å; M258-I336 HydrophobicContact CG-CD1 4.39Å; M258-I336 HydrophobicContact SD-CD1 3.48Å; M258-I336 WeakPolarHBondContact SD-CD1 3.33Å; T261-I336 HydrophobicContact CG2-CG2 3.3Å; L332-I336 HydrophobicContact CD2-CD1 3.96Å; L332-I336 HydrophobicContact CG-CD1 4.15Å; L332-I336 WeakPolarHBondContact O-CD1 3.39Å; L332-I336 VanDerWaalsContact O-CG1 3.28Å; L332-I336 WeakPolarHBondContact O-CG1 3.36Å; L332-I336 PolarHBondContact O-N 3.49Å; L333-I336 PolarHBondContact O-N 3.46Å; A334-I336 VanDerWaalsContact C-N 3.28Å; A334-I336 PolarHBondContact O-N 3Å; I336-Y338 VanDerWaalsContact C-N 3.28Å; I336-Y338 PolarHBondContact O-N 2.92Å; I336-Q339 PolarHBondContact O-N 2.94Å; I336-I340 HydrophobicContact CG2-CD1 4.15Å; I336-I340 WeakPolarHBondContact O-CG1 3.46Å; I336-I340 PolarHBondContact O-N 3.47Å
337	L	86.9	Confident	86.6	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-38.2	179.4	-75.4	168.7	0	0	0	111.7	L333 A334 Q339 I340 V341 F356 A357	L333-L337 HydrophobicContact CD1-CD1 3.71Å; L333-L337 HydrophobicContact CD1-CG 3.89Å; L333-L337 HydrophobicContact CD2-CD1 4.43Å; L333-L337 HydrophobicContact CG-CD1 3.78Å; L333-L337 HydrophobicContact CG-CG 4.41Å; L333-L337 WeakPolarHBondContact O-CB 3.42Å; L333-L337 WeakPolarHBondContact O-CG 3.18Å; L333-L337 PolarHBondContact O-N 3.07Å; A334-L337 PolarHBondContact O-N 3.27Å; L337-Q339 PolarHBondContact O-N 3.03Å; L337-I340 HydrophobicContact CD2-CD1 4.45Å; L337-I340 PolarHBondContact O-N 3.05Å; L337-V341 WeakPolarHBondContact O-CB 3.44Å; L337-V341 VanDerWaalsContact O-CG2 3.23Å; L337-V341 WeakPolarHBondContact O-CG2 3.24Å; L337-V341 PolarHBondContact O-N 3.45Å; L337-F356 HydrophobicContact CD2-CD1 3.93Å; L337-F356 HydrophobicContact CD2-CE1 4.24Å; L337-A357 HydrophobicContact CD1-CB 3.79Å
338	Y	88.4	Confident	85.7	Confident	172 Å²	172	65 Å²	65	68%	0.675	35%	0.345	S	S	*	.	H	α-helix	trans	-61.1	-43.8	175.2	179.7	-99.8	0	0	0	112	A334 I336 V341 S342	A334-Y338 WeakPolarHBondContact O-CB 3.42Å; A334-Y338 PolarHBondContact O-N 3.36Å; I336-Y338 VanDerWaalsContact C-N 3.28Å; I336-Y338 PolarHBondContact O-N 2.92Å; Y338-V341 PolarHBondContact O-N 3.42Å; Y338-S342 VanDerWaalsContact O-CB 3.28Å; Y338-S342 WeakPolarHBondContact O-CB 3.32Å; Y338-S342 PolarHBondContact O-N 2.95Å; Y338-S342 PolarHBondContact O-OG 3.38Å
339	Q	86.6	Confident	84.8	Confident	121 Å²	121	67.2 Å²	67.2	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-62.9	-41.3	174.9	-72.5	179.6	7.7	0	0	112.1	S335 I336 L337 S342 T343	S335-Q339 WeakPolarHBondContact O-CG 3.43Å; S335-Q339 PolarHBondContact O-N 2.93Å; S335-Q339 VanDerWaalsContact O-N 3.17Å; I336-Q339 PolarHBondContact O-N 2.94Å; L337-Q339 PolarHBondContact O-N 3.03Å; Q339-S342 WeakPolarHBondContact CA-OG 3.4Å; Q339-S342 PolarHBondContact O-OG 2.9Å; Q339-S342 VanDerWaalsContact O-OG 3.13Å; Q339-T343 WeakPolarHBondContact O-CB 3.38Å; Q339-T343 VanDerWaalsContact O-CG2 3.32Å; Q339-T343 WeakPolarHBondContact O-CG2 3.34Å; Q339-T343 PolarHBondContact O-N 3.44Å; Q339-T343 PolarHBondContact O-OG1 3.36Å
340	I	81.5	Confident	84.3	Confident	19 Å²	19	71.8 Å²	71.8	10%	0.097	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-51.3	176.9	-61.7	169.3	0	0	0	110.6	T261 I336 L337 S342 T343 E344 Y353	T261-I340 HydrophobicContact CG2-CD1 3.39Å; T261-I340 HydrophobicContact CG2-CG1 3.51Å; I336-I340 HydrophobicContact CG2-CD1 4.15Å; I336-I340 WeakPolarHBondContact O-CG1 3.46Å; I336-I340 PolarHBondContact O-N 3.47Å; L337-I340 HydrophobicContact CD2-CD1 4.45Å; L337-I340 PolarHBondContact O-N 3.05Å; I340-S342 VanDerWaalsContact C-N 3.33Å; I340-S342 PolarHBondContact O-N 2.97Å; I340-T343 PolarHBondContact O-N 3.1Å; I340-T343 PolarHBondContact O-OG1 3.36Å; I340-E344 VanDerWaalsContact O-CB 3.31Å; I340-E344 WeakPolarHBondContact O-CB 3.23Å; I340-E344 PolarHBondContact O-N 2.91Å; I340-Y353 HydrophobicContact CD1-CE1 4.45Å; I340-Y353 HydrophobicContact CG2-CD1 3.84Å; I340-Y353 HydrophobicContact CG2-CD2 3.81Å; I340-Y353 HydrophobicContact CG2-CE1 3.48Å; I340-Y353 VanDerWaalsContact CG2-CE1 3.48Å; I340-Y353 HydrophobicContact CG2-CE2 3.49Å; I340-Y353 VanDerWaalsContact CG2-CE2 3.49Å; I340-Y353 HydrophobicContact CG2-CG 3.99Å
341	V	84.3	Confident	83.8	Confident	31 Å²	31	75.5 Å²	75.5	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-62.6	-38.9	-176.7	166.8	0	0	0	0	111.9	L337 Y338 R350 Y353 L354	L337-V341 WeakPolarHBondContact O-CB 3.44Å; L337-V341 VanDerWaalsContact O-CG2 3.23Å; L337-V341 WeakPolarHBondContact O-CG2 3.24Å; L337-V341 PolarHBondContact O-N 3.45Å; Y338-V341 PolarHBondContact O-N 3.42Å; V341-R350 HydrophobicContact CG1-CG 3.88Å; V341-Y353 HydrophobicContact CG2-CG 4.4Å; V341-L354 HydrophobicContact CG1-CD2 4.36Å
342	S	83.7	Confident	83.3	Confident	75 Å²	75	70.9 Å²	70.9	52%	0.524	36%	0.356	S	S	.	.	H	α-helix	trans	-74.4	-27.1	-179.8	56.6	0	0	0	0	113.7	Y338 Q339 I340	Y338-S342 VanDerWaalsContact O-CB 3.28Å; Y338-S342 WeakPolarHBondContact O-CB 3.32Å; Y338-S342 PolarHBondContact O-N 2.95Å; Y338-S342 PolarHBondContact O-OG 3.38Å; Q339-S342 WeakPolarHBondContact CA-OG 3.4Å; Q339-S342 PolarHBondContact O-OG 2.9Å; Q339-S342 VanDerWaalsContact O-OG 3.13Å; I340-S342 VanDerWaalsContact C-N 3.33Å; I340-S342 PolarHBondContact O-N 2.97Å
343	T	81.4	Confident	83	Confident	101 Å²	101	69.1 Å²	69.1	62%	0.62	35%	0.345	S	S	*	.	H	α-helix	trans	-91.7	-20.7	179	55.4	0	0	0	0	113.4	Q339 I340 R345	Q339-T343 WeakPolarHBondContact O-CB 3.38Å; Q339-T343 VanDerWaalsContact O-CG2 3.32Å; Q339-T343 WeakPolarHBondContact O-CG2 3.34Å; Q339-T343 PolarHBondContact O-N 3.44Å; Q339-T343 PolarHBondContact O-OG1 3.36Å; I340-T343 PolarHBondContact O-N 3.1Å; I340-T343 PolarHBondContact O-OG1 3.36Å; T343-R345 PolarHBondContact O-N 3.3Å
344	E	79.6	Confident	82.9	Confident	45 Å²	45	72.7 Å²	72.7	21%	0.21	36%	0.364	C	S	.	.			trans	-73.6	123.5	-178.8	-173.8	60.9	-111.5	0	0	111.8	I340 S346 K349 Y353	I340-E344 VanDerWaalsContact O-CB 3.31Å; I340-E344 WeakPolarHBondContact O-CB 3.23Å; I340-E344 PolarHBondContact O-N 2.91Å; E344-S346 PolarHBondContact OE1-N 2.99Å; E344-K349 VanDerWaalsContact CD-CD 3.49Å; E344-K349 HydrophobicContact CG-CB 3.7Å; E344-K349 HydrophobicContact CG-CD 4.34Å; E344-K349 WeakPolarHBondContact OE1-CD 3.46Å; E344-K349 WeakPolarHBondContact OE2-CD 3.43Å; E344-Y353 HydrophobicContact CB-CE2 4.46Å; E344-Y353 HydrophobicContact CG-CD2 4.49Å; E344-Y353 HydrophobicContact CG-CE2 4.11Å
345	R	77.6	Confident	82.8	Confident	244 Å²	244	73.6 Å²	73.6	92%	0.921	37%	0.368	S	S	*	.			trans	-88	-22.7	-178.5	-65.7	-176.8	-179.7	170.1	-1.1	113	T343	T343-R345 PolarHBondContact O-N 3.3Å
346	S	76.3	Confident	82.8	Confident	48 Å²	48	71.3 Å²	71.3	34%	0.336	35%	0.35	S	S	.	.			trans	-82.4	118.5	-179.7	179	0	0	0	0	111.1	E344 L348 K349 R350	E344-S346 PolarHBondContact OE1-N 2.99Å; S346-L348 PolarHBondContact O-N 2.79Å; S346-K349 PolarHBondContact O-N 3.07Å; S346-R350 WeakPolarHBondContact O-CB 3.47Å; S346-R350 PolarHBondContact O-N 2.79Å
347	T	78.6	Confident	83	Confident	88 Å²	88	71 Å²	71	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-55.3	-41.3	175.3	53.4	0	0	0	0	112.1	K349 R350 D351	T347-K349 PolarHBondContact O-N 3.22Å; T347-R350 WeakPolarHBondContact O-CB 3.45Å; T347-R350 PolarHBondContact O-N 3.1Å; T347-D351 VanDerWaalsContact O-CG 3.24Å; T347-D351 PolarHBondContact O-N 2.9Å
348	L	74.7	Confident	83.2	Confident	60 Å²	60	77.3 Å²	77.3	31%	0.314	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-39.3	-179.8	177.4	153.3	0	0	0	113.2	S346 F352 R408 Y411	S346-L348 PolarHBondContact O-N 2.79Å; L348-F352 PolarHBondContact O-N 3.4Å; L348-R408 PolarHBondContact O-NH2 2.98Å; L348-Y411 HydrophobicContact CD1-CE2 4.09Å
349	K	75.5	Confident	83.5	Confident	101 Å²	101	69.1 Å²	69.1	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-72.8	-39.4	174.6	-70.5	-178.6	178.1	179.4	0	111.2	E344 S346 T347 D351 F352 Y353	E344-K349 VanDerWaalsContact CD-CD 3.49Å; E344-K349 HydrophobicContact CG-CB 3.7Å; E344-K349 HydrophobicContact CG-CD 4.34Å; E344-K349 WeakPolarHBondContact OE1-CD 3.46Å; E344-K349 WeakPolarHBondContact OE2-CD 3.43Å; S346-K349 PolarHBondContact O-N 3.07Å; T347-K349 PolarHBondContact O-N 3.22Å; K349-D351 VanDerWaalsContact C-N 3.31Å; K349-D351 PolarHBondContact O-N 3.46Å; K349-F352 WeakPolarHBondContact O-CB 3.43Å; K349-F352 PolarHBondContact O-N 2.84Å; K349-F352 VanDerWaalsContact O-N 3.13Å; K349-Y353 HydrophobicContact CB-CD2 4.49Å; K349-Y353 HydrophobicContact CB-CE2 4.1Å; K349-Y353 WeakPolarHBondContact O-CD2 3.31Å; K349-Y353 PolarHBondContact O-N 2.97Å
350	R	80.6	Confident	83.8	Confident	108 Å²	108	63.3 Å²	63.3	41%	0.408	32%	0.318	S	S	.	.	H	α-helix	trans	-56.9	-45	175.1	-165.1	176.6	63.7	-172.9	0.1	111.7	V341 S346 T347 F352 Y353 L354	V341-R350 HydrophobicContact CG1-CG 3.88Å; S346-R350 WeakPolarHBondContact O-CB 3.47Å; S346-R350 PolarHBondContact O-N 2.79Å; T347-R350 WeakPolarHBondContact O-CB 3.45Å; T347-R350 PolarHBondContact O-N 3.1Å; R350-F352 VanDerWaalsContact C-N 3.31Å; R350-F352 PolarHBondContact O-N 3.4Å; R350-Y353 PolarHBondContact O-N 3.29Å; R350-L354 WeakPolarHBondContact O-CG 3.45Å; R350-L354 PolarHBondContact O-N 2.87Å
351	D	82.8	Confident	84.4	Confident	82 Å²	82	65.4 Å²	65.4	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-36.3	177.4	-66.5	-15.2	0	0	0	112.1	T347 K349 L354 C355	T347-D351 VanDerWaalsContact O-CG 3.24Å; T347-D351 PolarHBondContact O-N 2.9Å; K349-D351 VanDerWaalsContact C-N 3.31Å; K349-D351 PolarHBondContact O-N 3.46Å; D351-L354 PolarHBondContact O-N 3.38Å; D351-C355 PolarHBondContact O-N 3.41Å; D351-C355 PolarHBondContact O-SG 2.96Å
352	F	83.9	Confident	84.9	Confident	18 Å²	18	66.5 Å²	66.5	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-48.6	171.4	168.6	-88.2	0	0	0	111.5	W260 L348 K349 R350 L354 C355 F356 L404 F405 R408	W260-F352 HydrophobicContact CH2-CD1 4.17Å; W260-F352 AromaticContact CH2-CE1 3.4Å; W260-F352 HydrophobicContact CH2-CE1 3.4Å; W260-F352 AromaticContact CH2-CZ 3.95Å; W260-F352 HydrophobicContact CH2-CZ 3.95Å; W260-F352 HydrophobicContact CZ2-CE1 4.29Å; W260-F352 HydrophobicContact CZ3-CD1 4.29Å; W260-F352 AromaticContact CZ3-CE1 3.79Å; W260-F352 HydrophobicContact CZ3-CE1 3.79Å; L348-F352 PolarHBondContact O-N 3.4Å; K349-F352 WeakPolarHBondContact O-CB 3.43Å; K349-F352 PolarHBondContact O-N 2.84Å; K349-F352 VanDerWaalsContact O-N 3.13Å; R350-F352 VanDerWaalsContact C-N 3.31Å; R350-F352 PolarHBondContact O-N 3.4Å; F352-L354 VanDerWaalsContact C-N 3.3Å; F352-L354 PolarHBondContact O-N 3.34Å; F352-C355 PolarHBondContact O-N 3.45Å; F352-F356 VanDerWaalsContact O-CB 3.31Å; F352-F356 WeakPolarHBondContact O-CB 3.21Å; F352-F356 PolarHBondContact O-N 3.32Å; F352-L404 HydrophobicContact CD2-CD1 3.58Å; F352-L404 HydrophobicContact CD2-CD2 3.98Å; F352-L404 HydrophobicContact CD2-CG 3.75Å; F352-L404 HydrophobicContact CE2-CD1 3.99Å; F352-L404 HydrophobicContact CE2-CD2 3.7Å; F352-L404 HydrophobicContact CE2-CG 3.58Å; F352-L404 HydrophobicContact CG-CD1 4.45Å; F352-L404 HydrophobicContact CZ-CD2 4.17Å; F352-L404 HydrophobicContact CZ-CG 4.49Å; F352-F405 HydrophobicContact CZ-CE1 4.15Å; F352-R408 HydrophobicContact CD2-CG 3.85Å; F352-R408 HydrophobicContact CE2-CG 4.13Å
353	Y	84.5	Confident	85.4	Confident	22 Å²	22	63 Å²	63	9%	0.086	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-37.3	178.8	-68.9	-62.1	0	0	0	112.6	W260 I340 V341 E344 K349 R350 F356 A357	W260-Y353 HydrophobicContact CD2-CE1 4.48Å; W260-Y353 HydrophobicContact CE3-CD1 4.43Å; W260-Y353 AromaticContact CE3-CE1 3.21Å; W260-Y353 HydrophobicContact CE3-CE1 3.21Å; W260-Y353 AromaticContact CE3-CZ 3.52Å; W260-Y353 HydrophobicContact CH2-CE1 4.28Å; W260-Y353 HydrophobicContact CZ3-CD1 4.16Å; W260-Y353 AromaticContact CZ3-CE1 3.08Å; W260-Y353 HydrophobicContact CZ3-CE1 3.08Å; W260-Y353 HydrophobicContact CZ3-CE2 4.47Å; W260-Y353 AromaticContact CZ3-CZ 3.27Å; W260-Y353 WeakPolarHBondContact CZ3-OH 3.33Å; I340-Y353 HydrophobicContact CD1-CE1 4.45Å; I340-Y353 HydrophobicContact CG2-CD1 3.84Å; I340-Y353 HydrophobicContact CG2-CD2 3.81Å; I340-Y353 HydrophobicContact CG2-CE1 3.48Å; I340-Y353 VanDerWaalsContact CG2-CE1 3.48Å; I340-Y353 HydrophobicContact CG2-CE2 3.49Å; I340-Y353 VanDerWaalsContact CG2-CE2 3.49Å; I340-Y353 HydrophobicContact CG2-CG 3.99Å; V341-Y353 HydrophobicContact CG2-CG 4.4Å; E344-Y353 HydrophobicContact CB-CE2 4.46Å; E344-Y353 HydrophobicContact CG-CD2 4.49Å; E344-Y353 HydrophobicContact CG-CE2 4.11Å; K349-Y353 HydrophobicContact CB-CD2 4.49Å; K349-Y353 HydrophobicContact CB-CE2 4.1Å; K349-Y353 WeakPolarHBondContact O-CD2 3.31Å; K349-Y353 PolarHBondContact O-N 2.97Å; R350-Y353 PolarHBondContact O-N 3.29Å; Y353-F356 PolarHBondContact O-N 3.24Å; Y353-A357 WeakPolarHBondContact O-CB 3.4Å; Y353-A357 PolarHBondContact O-N 2.84Å
354	L	86.8	Confident	86	Confident	76 Å²	76	58.1 Å²	58.1	40%	0.398	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-43.1	176.1	-70.1	173.4	0	0	0	111.7	V341 R350 D351 F352 A357 K358	V341-L354 HydrophobicContact CG1-CD2 4.36Å; R350-L354 WeakPolarHBondContact O-CG 3.45Å; R350-L354 PolarHBondContact O-N 2.87Å; D351-L354 PolarHBondContact O-N 3.38Å; F352-L354 VanDerWaalsContact C-N 3.3Å; F352-L354 PolarHBondContact O-N 3.34Å; L354-A357 PolarHBondContact O-N 3.3Å; L354-K358 WeakPolarHBondContact O-CG 3.11Å; L354-K358 PolarHBondContact O-N 2.9Å
355	C	88.4	Confident	86.7	Confident	51 Å²	51	58.3 Å²	58.3	35%	0.345	28%	0.279	S	S	.	.	H	α-helix	trans	-66.5	-40.1	174.9	-71.6	0	0	0	0	112.3	D351 F352 K358 G359 L404	D351-C355 PolarHBondContact O-N 3.41Å; D351-C355 PolarHBondContact O-SG 2.96Å; F352-C355 PolarHBondContact O-N 3.45Å; C355-K358 WeakPolarHBondContact O-CB 3.43Å; C355-K358 PolarHBondContact O-N 3.22Å; C355-G359 PolarHBondContact O-N 3.26Å; C355-L404 HydrophobicContact CB-CD1 3.84Å; C355-L404 HydrophobicContact CB-CD2 4.42Å
356	F	89.4	Confident	87.5	Confident	10 Å²	10	47 Å²	47	4%	0.044	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-45.3	174.1	-179.3	-116.2	0	0	0	111.4	L253 L256 C257 L337 F352 Y353 K358 G359 C360 L401 L404 F405	L253-F356 HydrophobicContact CD2-CE2 4.22Å; L253-F356 HydrophobicContact CD2-CZ 4.41Å; L256-F356 HydrophobicContact CB-CZ 3.95Å; L256-F356 HydrophobicContact CD1-CE2 4.08Å; L256-F356 HydrophobicContact CD1-CZ 4.17Å; C257-F356 WeakPolarHBondContact SG-CE1 3.43Å; L337-F356 HydrophobicContact CD2-CD1 3.93Å; L337-F356 HydrophobicContact CD2-CE1 4.24Å; F352-F356 VanDerWaalsContact O-CB 3.31Å; F352-F356 WeakPolarHBondContact O-CB 3.21Å; F352-F356 PolarHBondContact O-N 3.32Å; Y353-F356 PolarHBondContact O-N 3.24Å; F356-K358 VanDerWaalsContact C-N 3.32Å; F356-K358 PolarHBondContact O-N 3.4Å; F356-G359 PolarHBondContact O-N 3.01Å; F356-C360 VanDerWaalsContact CZ-SG 3.53Å; F356-C360 PolarHBondContact O-N 3.32Å; F356-C360 PolarHBondContact O-SG 3.25Å; F356-L401 HydrophobicContact CD2-CD2 3.59Å; F356-L401 HydrophobicContact CE2-CD2 3.84Å; F356-L404 HydrophobicContact CB-CD2 3.61Å; F356-L404 HydrophobicContact CD2-CD2 4.18Å; F356-L404 HydrophobicContact CG-CD2 4.37Å; F356-F405 HydrophobicContact CD2-CZ 4.11Å; F356-F405 AromaticContact CE2-CZ 3.91Å; F356-F405 HydrophobicContact CE2-CZ 3.91Å
357	A	91.1	Very high	88.3	Confident	11 Å²	11	47 Å²	47	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-43.8	176.1	0	0	0	0	0	111.8	L337 Y353 L354 G359 C360 F361	L337-A357 HydrophobicContact CD1-CB 3.79Å; Y353-A357 WeakPolarHBondContact O-CB 3.4Å; Y353-A357 PolarHBondContact O-N 2.84Å; L354-A357 PolarHBondContact O-N 3.3Å; A357-G359 PolarHBondContact O-N 2.92Å; A357-C360 PolarHBondContact O-N 3.13Å; A357-F361 HydrophobicContact CB-CD2 4.12Å; A357-F361 HydrophobicContact CB-CE2 3.94Å; A357-F361 WeakPolarHBondContact O-CB 3.34Å; A357-F361 WeakPolarHBondContact O-CD2 3.23Å; A357-F361 WeakPolarHBondContact O-CG 3.32Å; A357-F361 PolarHBondContact O-N 2.8Å
358	K	92.4	Very high	89	Confident	140 Å²	140	43.9 Å²	43.9	61%	0.609	21%	0.213	S	C	*	.	H	α-helix	trans	-56.6	-47.5	176.1	-71.3	171.3	-177.4	-179.5	0	111.9	L354 C355 F356 L362	L354-K358 WeakPolarHBondContact O-CG 3.11Å; L354-K358 PolarHBondContact O-N 2.9Å; C355-K358 WeakPolarHBondContact O-CB 3.43Å; C355-K358 PolarHBondContact O-N 3.22Å; F356-K358 VanDerWaalsContact C-N 3.32Å; F356-K358 PolarHBondContact O-N 3.4Å; K358-L362 VanDerWaalsContact O-CB 3.25Å; K358-L362 WeakPolarHBondContact O-CB 3.34Å; K358-L362 PolarHBondContact O-N 3.41Å
359	G	93.2	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-49.2	176.5	0	0	0	0	0	111.8	C355 F356 A357 F361 L362 W363 S397	C355-G359 PolarHBondContact O-N 3.26Å; F356-G359 PolarHBondContact O-N 3.01Å; A357-G359 PolarHBondContact O-N 2.92Å; G359-F361 PolarHBondContact O-N 2.98Å; G359-L362 PolarHBondContact O-N 2.95Å; G359-W363 PolarHBondContact O-N 3.47Å; G359-S397 VanDerWaalsContact C-OG 3.29Å; G359-S397 PolarHBondContact O-OG 3.46Å
360	C	92.8	Very high	90.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-51.1	178.9	-66.3	0	0	0	0	112.6	L333 F356 A357 L362 W363 F364	L333-C360 HydrophobicContact CD2-CB 3.58Å; F356-C360 VanDerWaalsContact CZ-SG 3.53Å; F356-C360 PolarHBondContact O-N 3.32Å; F356-C360 PolarHBondContact O-SG 3.25Å; A357-C360 PolarHBondContact O-N 3.13Å; C360-L362 VanDerWaalsContact C-N 3.34Å; C360-L362 PolarHBondContact O-N 3.4Å; C360-W363 PolarHBondContact O-N 2.98Å; C360-W363 VanDerWaalsContact O-N 3.14Å; C360-F364 VanDerWaalsContact O-CD2 3.29Å; C360-F364 WeakPolarHBondContact O-CD2 3.23Å; C360-F364 PolarHBondContact O-N 3.46Å
361	F	94.3	Very high	91.2	Very high	62 Å²	62	38.5 Å²	38.5	27%	0.272	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-40.5	-179.5	-72	-53	0	0	0	112.1	A334 A357 G359 W363 F364 L365	A334-F361 HydrophobicContact CB-CE1 3.72Å; A334-F361 HydrophobicContact CB-CZ 3.52Å; A357-F361 HydrophobicContact CB-CD2 4.12Å; A357-F361 HydrophobicContact CB-CE2 3.94Å; A357-F361 WeakPolarHBondContact O-CB 3.34Å; A357-F361 WeakPolarHBondContact O-CD2 3.23Å; A357-F361 WeakPolarHBondContact O-CG 3.32Å; A357-F361 PolarHBondContact O-N 2.8Å; G359-F361 PolarHBondContact O-N 2.98Å; F361-W363 VanDerWaalsContact C-N 3.27Å; F361-W363 PolarHBondContact O-N 3.3Å; F361-F364 PolarHBondContact O-N 3.41Å; F361-L365 HydrophobicContact CB-CD1 4.44Å; F361-L365 HydrophobicContact CD1-CD1 4.15Å; F361-L365 VanDerWaalsContact O-CB 3.28Å; F361-L365 WeakPolarHBondContact O-CB 3.39Å; F361-L365 PolarHBondContact O-N 2.93Å
362	L	94.9	Very high	91.5	Very high	54 Å²	54	40.7 Å²	40.7	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-58.3	-42.2	174.1	-176.9	61.2	0	0	0	111.1	K358 G359 C360 C366 C393 I396 I400	K358-L362 VanDerWaalsContact O-CB 3.25Å; K358-L362 WeakPolarHBondContact O-CB 3.34Å; K358-L362 PolarHBondContact O-N 3.41Å; G359-L362 PolarHBondContact O-N 2.95Å; C360-L362 VanDerWaalsContact C-N 3.34Å; C360-L362 PolarHBondContact O-N 3.4Å; L362-C366 WeakPolarHBondContact O-CB 3.39Å; L362-C366 PolarHBondContact O-N 2.97Å; L362-C366 PolarHBondContact O-SG 3.49Å; L362-C393 HydrophobicContact CD1-CB 4.1Å; L362-C393 HydrophobicContact CG-CB 4.44Å; L362-I396 HydrophobicContact CD2-CB 4.23Å; L362-I396 HydrophobicContact CD2-CG2 3.8Å; L362-I400 HydrophobicContact CD2-CD1 4.17Å
363	W	95.2	Very high	91.8	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-71	-39.4	-179.6	-168.4	85.1	0	0	0	113.9	M249 L250 L253 G359 C360 F361 C366 S397	M249-W363 HydrophobicContact CB-CH2 4.34Å; M249-W363 HydrophobicContact CB-CZ2 3.76Å; L250-W363 HydrophobicContact CB-CH2 3.91Å; L250-W363 HydrophobicContact CB-CZ3 4.29Å; L250-W363 HydrophobicContact CD1-CZ3 4.15Å; L253-W363 HydrophobicContact CD1-CB 4.44Å; L253-W363 HydrophobicContact CD1-CD2 3.97Å; L253-W363 HydrophobicContact CD1-CE3 3.7Å; L253-W363 HydrophobicContact CD1-CG 4.29Å; L253-W363 HydrophobicContact CD1-CZ3 4.25Å; G359-W363 PolarHBondContact O-N 3.47Å; C360-W363 PolarHBondContact O-N 2.98Å; C360-W363 VanDerWaalsContact O-N 3.14Å; F361-W363 VanDerWaalsContact C-N 3.27Å; F361-W363 PolarHBondContact O-N 3.3Å; W363-C366 PolarHBondContact O-SG 2.79Å; W363-S397 WeakPolarHBondContact CB-OG 3.29Å
364	F	93.8	Very high	92	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-80.2	-43.2	-178.6	-82.5	-76.5	0	0	0	113	L250 L253 L254 L329 L333 C360 F361 P368	L250-F364 HydrophobicContact CD1-CE1 3.43Å; L250-F364 VanDerWaalsContact CD1-CE1 3.43Å; L250-F364 HydrophobicContact CD1-CZ 3.39Å; L253-F364 HydrophobicContact CB-CE2 4.3Å; L253-F364 HydrophobicContact CD1-CD2 4.47Å; L253-F364 HydrophobicContact CD1-CE2 3.87Å; L254-F364 HydrophobicContact CD2-CZ 4.48Å; L329-F364 HydrophobicContact CB-CD1 4.31Å; L329-F364 HydrophobicContact CB-CE1 3.89Å; L329-F364 HydrophobicContact CD1-CE1 4.13Å; L333-F364 HydrophobicContact CD2-CD2 4.04Å; L333-F364 HydrophobicContact CD2-CE2 3.79Å; C360-F364 VanDerWaalsContact O-CD2 3.29Å; C360-F364 WeakPolarHBondContact O-CD2 3.23Å; C360-F364 PolarHBondContact O-N 3.46Å; F361-F364 PolarHBondContact O-N 3.41Å; F364-P368 WeakPolarHBondContact O-CD 3.4Å
365	L	94.6	Very high	92	Very high	48 Å²	48	44.7 Å²	44.7	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-91.8	-12.8	-171.6	-68.6	171.6	0	0	0	113.5	S330 F361 H367 P368 I369	S330-L365 WeakPolarHBondContact OG-CD2 3.26Å; F361-L365 HydrophobicContact CB-CD1 4.44Å; F361-L365 HydrophobicContact CD1-CD1 4.15Å; F361-L365 VanDerWaalsContact O-CB 3.28Å; F361-L365 WeakPolarHBondContact O-CB 3.39Å; F361-L365 PolarHBondContact O-N 2.93Å; L365-H367 VanDerWaalsContact C-N 3.29Å; L365-H367 PolarHBondContact O-N 3.37Å; L365-P368 HydrophobicContact CD2-CG 4.2Å; L365-P368 WeakPolarHBondContact O-CD 3.31Å; L365-P368 WeakPolarHBondContact O-CG 3.23Å; L365-I369 HydrophobicContact CB-CD1 3.75Å; L365-I369 HydrophobicContact CB-CG1 4.33Å; L365-I369 VanDerWaalsContact O-CB 3.26Å; L365-I369 WeakPolarHBondContact O-CB 3.35Å; L365-I369 WeakPolarHBondContact O-CD1 3.33Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 2.92Å
366	C	94.9	Very high	92	Very high	7 Å²	7	47.9 Å²	47.9	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-45.1	179.1	61.2	0	0	0	0	112.1	L362 W363 L370 C393	L362-C366 WeakPolarHBondContact O-CB 3.39Å; L362-C366 PolarHBondContact O-N 2.97Å; L362-C366 PolarHBondContact O-SG 3.49Å; W363-C366 PolarHBondContact O-SG 2.79Å; C366-L370 HydrophobicContact CB-CD1 4.48Å; C366-L370 VanDerWaalsContact O-CB 3.23Å; C366-L370 WeakPolarHBondContact O-CB 3.4Å; C366-L370 WeakPolarHBondContact O-CD1 2.96Å; C366-L370 WeakPolarHBondContact O-CG 3.32Å; C366-L370 PolarHBondContact O-N 2.88Å; C366-C393 HydrophobicContact CB-CB 3.33Å
367	H	91.8	Very high	91.8	Very high	49 Å²	49	51.1 Å²	51.1	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-55.7	-178.3	-172.4	68.3	0	0	0	113	L323 L365 I369 L370 V371 V390	L323-H367 WeakPolarHBondContact CD2-CD2 3.35Å; L365-H367 VanDerWaalsContact C-N 3.29Å; L365-H367 PolarHBondContact O-N 3.37Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.28Å; H367-L370 PolarHBondContact O-N 3.47Å; H367-V371 WeakPolarHBondContact O-CG2 3.49Å; H367-V371 PolarHBondContact O-N 3.35Å; H367-V390 HydrophobicContact CB-CG2 4.05Å; H367-V390 WeakPolarHBondContact ND1-CG2 3.32Å
368	P	93.2	Very high	91.4	Very high	22 Å²	22	55.7 Å²	55.7	14%	0.143	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-34.1	177.9	24.4	-34.5	0	0	0	114.1	L323 V327 F364 L365 L372	L323-P368 VanDerWaalsContact CD2-CA 3.43Å; L323-P368 HydrophobicContact CD2-CB 3.75Å; V327-P368 HydrophobicContact CG2-CB 3.94Å; V327-P368 HydrophobicContact CG2-CG 3.98Å; F364-P368 WeakPolarHBondContact O-CD 3.4Å; L365-P368 HydrophobicContact CD2-CG 4.2Å; L365-P368 WeakPolarHBondContact O-CD 3.31Å; L365-P368 WeakPolarHBondContact O-CG 3.23Å; P368-L372 PolarHBondContact O-N 2.95Å; P368-L372 VanDerWaalsContact O-N 3.08Å
369	I	93.4	Very high	90.5	Very high	92 Å²	92	52.6 Å²	52.6	47%	0.472	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-44.8	175.6	-67.2	170.9	0	0	0	110.3	L365 H367 V371 L372 M373	L365-I369 HydrophobicContact CB-CD1 3.75Å; L365-I369 HydrophobicContact CB-CG1 4.33Å; L365-I369 VanDerWaalsContact O-CB 3.26Å; L365-I369 WeakPolarHBondContact O-CB 3.35Å; L365-I369 WeakPolarHBondContact O-CD1 3.33Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 2.92Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.28Å; I369-V371 VanDerWaalsContact C-N 3.35Å; I369-V371 PolarHBondContact O-N 3.47Å; I369-L372 PolarHBondContact O-N 3.26Å; I369-M373 HydrophobicContact CG2-CG 4.17Å; I369-M373 WeakPolarHBondContact O-CB 3.13Å; I369-M373 VanDerWaalsContact O-CG 3.25Å; I369-M373 WeakPolarHBondContact O-CG 3.48Å; I369-M373 PolarHBondContact O-N 3.23Å
370	L	92.8	Very high	89.7	Confident	33 Å²	33	53.8 Å²	53.8	17%	0.173	28%	0.284	C	S	.	.	H	α-helix	trans	-66.2	-37.3	179.9	-74.6	167.1	0	0	0	112.3	C366 H367 M373 S374 V390	C366-L370 HydrophobicContact CB-CD1 4.48Å; C366-L370 VanDerWaalsContact O-CB 3.23Å; C366-L370 WeakPolarHBondContact O-CB 3.4Å; C366-L370 WeakPolarHBondContact O-CD1 2.96Å; C366-L370 WeakPolarHBondContact O-CG 3.32Å; C366-L370 PolarHBondContact O-N 2.88Å; H367-L370 PolarHBondContact O-N 3.47Å; L370-M373 PolarHBondContact O-N 2.86Å; L370-S374 WeakPolarHBondContact O-CB 3.42Å; L370-S374 PolarHBondContact O-N 2.85Å; L370-V390 HydrophobicContact CD1-CB 4.4Å; L370-V390 HydrophobicContact CD1-CG2 3.74Å
371	V	90.5	Very high	89.1	Confident	30 Å²	30	57.4 Å²	57.4	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-44.8	172.6	171.4	0	0	0	0	110.6	L323 H367 I369 M373 S374 I386	L323-V371 HydrophobicContact CD1-CG1 4.18Å; L323-V371 HydrophobicContact CD1-CG2 4.31Å; L323-V371 HydrophobicContact CD2-CB 4.37Å; L323-V371 HydrophobicContact CD2-CG2 4.04Å; H367-V371 WeakPolarHBondContact O-CG2 3.49Å; H367-V371 PolarHBondContact O-N 3.35Å; I369-V371 VanDerWaalsContact C-N 3.35Å; I369-V371 PolarHBondContact O-N 3.47Å; V371-M373 PolarHBondContact O-N 3.31Å; V371-S374 WeakPolarHBondContact O-CB 3.42Å; V371-S374 PolarHBondContact O-N 3.41Å; V371-S374 PolarHBondContact O-OG 3.33Å; V371-I386 HydrophobicContact CG2-CD1 4.22Å; V371-I386 HydrophobicContact CG2-CG2 4.19Å
372	L	90.5	Very high	88.6	Confident	129 Å²	129	57.5 Å²	57.5	68%	0.675	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-42	176.8	-177.3	63.2	0	0	0	112.1	P368 I369 S374	P368-L372 PolarHBondContact O-N 2.95Å; P368-L372 VanDerWaalsContact O-N 3.08Å; I369-L372 PolarHBondContact O-N 3.26Å; L372-S374 VanDerWaalsContact C-N 3.3Å; L372-S374 PolarHBondContact O-N 3.46Å
373	M	89.4	Confident	88	Confident	103 Å²	103	60.5 Å²	60.5	51%	0.507	31%	0.312	S	S	.	.	H	α-helix	trans	-70.5	-26.2	178.1	-68	-56.4	-61.1	0	0	112.7	I369 L370 V371 V375 V376	I369-M373 HydrophobicContact CG2-CG 4.17Å; I369-M373 WeakPolarHBondContact O-CB 3.13Å; I369-M373 VanDerWaalsContact O-CG 3.25Å; I369-M373 WeakPolarHBondContact O-CG 3.48Å; I369-M373 PolarHBondContact O-N 3.23Å; L370-M373 PolarHBondContact O-N 2.86Å; V371-M373 PolarHBondContact O-N 3.31Å; M373-V375 PolarHBondContact O-N 2.77Å; M373-V376 PolarHBondContact O-N 2.95Å
374	S	88.7	Confident	87.5	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-60.6	-25.2	179.7	78.2	0	0	0	0	112.9	Q314 L370 V371 L372 V376 F377 R382	Q314-S374 PolarHBondContact NE2-OG 3.32Å; L370-S374 WeakPolarHBondContact O-CB 3.42Å; L370-S374 PolarHBondContact O-N 2.85Å; V371-S374 WeakPolarHBondContact O-CB 3.42Å; V371-S374 PolarHBondContact O-N 3.41Å; V371-S374 PolarHBondContact O-OG 3.33Å; L372-S374 VanDerWaalsContact C-N 3.3Å; L372-S374 PolarHBondContact O-N 3.46Å; S374-V376 PolarHBondContact O-N 2.69Å; S374-V376 VanDerWaalsContact O-N 3.1Å; S374-F377 WeakPolarHBondContact O-CB 3.31Å; S374-F377 PolarHBondContact O-N 3.43Å; S374-R382 WeakPolarHBondContact O-CG 3.46Å; S374-R382 PolarHBondContact O-NE 3.45Å
375	V	87.1	Confident	87.2	Confident	94 Å²	94	64.6 Å²	64.6	57%	0.57	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.1	179	-178.8	0	0	0	0	112.2	M373 F377 R382	M373-V375 PolarHBondContact O-N 2.77Å; V375-F377 VanDerWaalsContact C-N 3.31Å; V375-R382 PolarHBondContact O-NH2 2.9Å
376	V	88.9	Confident	87	Confident	118 Å²	118	62.9 Å²	62.9	72%	0.715	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-24.5	176.7	-175.8	0	0	0	0	112.2	M373 S374	M373-V376 PolarHBondContact O-N 2.95Å; S374-V376 PolarHBondContact O-N 2.69Å; S374-V376 VanDerWaalsContact O-N 3.1Å
377	F	85.2	Confident	86.8	Confident	79 Å²	79	64.8 Å²	64.8	35%	0.346	34%	0.336	S	S	.	.	S	Bend	trans	-86.7	156.8	179.4	-63.6	-89.8	0	0	0	111.1	S374 V375 Q381 R382 V385	S374-F377 WeakPolarHBondContact O-CB 3.31Å; S374-F377 PolarHBondContact O-N 3.43Å; V375-F377 VanDerWaalsContact C-N 3.31Å; F377-Q381 HydrophobicContact CB-CB 4.34Å; F377-R382 HydrophobicContact CB-CG 4.31Å; F377-R382 PolarHBondContact O-NE 3.36Å; F377-R382 PolarHBondContact O-NH2 3.46Å; F377-R382 VanDerWaalsContact O-NH2 3.14Å; F377-V385 HydrophobicContact CD1-CG2 4.35Å; F377-V385 HydrophobicContact CD2-CG1 4.38Å; F377-V385 HydrophobicContact CE1-CG2 4.43Å; F377-V385 HydrophobicContact CE2-CG1 4.09Å; F377-V385 HydrophobicContact CZ-CG1 4.31Å
378	N	82.3	Confident	86.7	Confident	106 Å²	106	64.4 Å²	64.4	57%	0.567	34%	0.335	S	S	*	.			trans	-67.9	150.2	172.3	-67.5	-14.1	0	0	0	110.3	H380 Q381 R382	N378-H380 VanDerWaalsContact CB-CE1 3.47Å; N378-H380 WeakPolarHBondContact CB-CE1 3.33Å; N378-H380 VanDerWaalsContact CB-ND1 3.28Å; N378-H380 WeakPolarHBondContact CB-ND1 2.95Å; N378-H380 PolarHBondContact O-N 2.96Å; N378-Q381 PolarHBondContact O-N 3Å; N378-R382 WeakPolarHBondContact O-CG 3.39Å; N378-R382 PolarHBondContact O-N 2.95Å
379	D	73.9	Confident	86.8	Confident	75 Å²	75	64 Å²	64	40%	0.401	34%	0.335	S	S	.	.	H	α-helix	trans	-49.2	-41.7	-173	-71.4	-31.6	0	0	0	113	Y311 Q381 R382	Y311-D379 WeakPolarHBondContact OH-CB 3.42Å; Y311-D379 VanDerWaalsContact OH-CG 3.23Å; Y311-D379 PolarHBondContact OH-OD2 2.94Å; D379-Q381 PolarHBondContact O-N 3.13Å; D379-Q381 VanDerWaalsContact O-N 3.13Å; D379-R382 PolarHBondContact O-N 3.05Å; D379-R382 IonicContact OD1-CZ 3.99Å; D379-R382 IonicContact OD1-NE 2.75Å; D379-R382 PolarHBondContact OD1-NE 3.39Å; D379-R382 IonicContact OD1-NH1 2.93Å; D379-R382 PolarHBondContact OD1-NH1 2.94Å; D379-R382 IonicContact OD1-NH2 2.64Å
380	H	74.6	Confident	86.8	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.12	32%	0.317	C	S	.	.	H	α-helix	trans	-65.7	-17.6	-179.8	73.3	-76	0	0	0	115.9	M44 E160 N378	M44-H380 HydrophobicContact CE-CB 3.71Å; M44-H380 HydrophobicContact SD-CB 3.17Å; M44-H380 WeakPolarHBondContact SD-CB 2.99Å; E160-H380 WeakPolarHBondContact CA-O 3.31Å; E160-H380 HydrophobicContact CG-CB 4.09Å; N378-H380 VanDerWaalsContact CB-CE1 3.47Å; N378-H380 WeakPolarHBondContact CB-CE1 3.33Å; N378-H380 VanDerWaalsContact CB-ND1 3.28Å; N378-H380 WeakPolarHBondContact CB-ND1 2.95Å; N378-H380 PolarHBondContact O-N 2.96Å
381	Q	80.9	Confident	86.8	Confident	75 Å²	75	59.9 Å²	59.9	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-103.2	-17.5	179.1	-64.4	-178.1	-21.7	0	0	112.2	F377 N378 D379 K384 V385	F377-Q381 HydrophobicContact CB-CB 4.34Å; N378-Q381 PolarHBondContact O-N 3Å; D379-Q381 PolarHBondContact O-N 3.13Å; D379-Q381 VanDerWaalsContact O-N 3.13Å; Q381-K384 PolarHBondContact O-N 3.34Å; Q381-V385 HydrophobicContact CB-CG2 4.36Å; Q381-V385 WeakPolarHBondContact O-CB 3.45Å; Q381-V385 WeakPolarHBondContact O-CG2 3.47Å; Q381-V385 PolarHBondContact O-N 3.17Å
382	R	84.4	Confident	87	Confident	65 Å²	65	62.1 Å²	62.1	25%	0.245	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-56.6	-170.3	-67	-173.1	173.2	171.5	-6.6	111.3	S374 V375 F377 N378 D379 K384 V385 I386	S374-R382 WeakPolarHBondContact O-CG 3.46Å; S374-R382 PolarHBondContact O-NE 3.45Å; V375-R382 PolarHBondContact O-NH2 2.9Å; F377-R382 HydrophobicContact CB-CG 4.31Å; F377-R382 PolarHBondContact O-NE 3.36Å; F377-R382 PolarHBondContact O-NH2 3.46Å; F377-R382 VanDerWaalsContact O-NH2 3.14Å; N378-R382 WeakPolarHBondContact O-CG 3.39Å; N378-R382 PolarHBondContact O-N 2.95Å; D379-R382 PolarHBondContact O-N 3.05Å; D379-R382 IonicContact OD1-CZ 3.99Å; D379-R382 IonicContact OD1-NE 2.75Å; D379-R382 PolarHBondContact OD1-NE 3.39Å; D379-R382 IonicContact OD1-NH1 2.93Å; D379-R382 PolarHBondContact OD1-NH1 2.94Å; D379-R382 IonicContact OD1-NH2 2.64Å; R382-K384 PolarHBondContact O-N 3.36Å; R382-V385 PolarHBondContact O-N 3.24Å; R382-I386 WeakPolarHBondContact O-CD1 3.37Å; R382-I386 WeakPolarHBondContact O-CG1 3.48Å; R382-I386 PolarHBondContact O-N 3.21Å
383	E	81	Confident	87.3	Confident	117 Å²	117	57.4 Å²	57.4	55%	0.547	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-48.1	-177.1	-169.3	-178.3	155.2	0	0	111.3	V385 I386 T387	E383-V385 PolarHBondContact O-N 3.26Å; E383-I386 PolarHBondContact O-N 2.88Å; E383-T387 WeakPolarHBondContact O-CB 3.44Å; E383-T387 PolarHBondContact O-N 2.97Å; E383-T387 PolarHBondContact O-OG1 2.98Å; E383-T387 VanDerWaalsContact O-OG1 3.1Å
384	K	84.6	Confident	87.5	Confident	44 Å²	44	52.9 Å²	52.9	19%	0.191	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-47.1	176.4	175.1	165.6	58.5	-145.1	0	112.9	A159 E160 A162 Q381 R382 I386 T387 I388	A159-K384 PolarHBondContact O-NZ 3.11Å; E160-K384 WeakPolarHBondContact O-CD 3.34Å; E160-K384 PolarHBondContact O-NZ 3.26Å; A162-K384 WeakPolarHBondContact O-CD 3.25Å; A162-K384 PolarHBondContact O-NZ 3.44Å; Q381-K384 PolarHBondContact O-N 3.34Å; R382-K384 PolarHBondContact O-N 3.36Å; K384-I386 VanDerWaalsContact C-N 3.34Å; K384-T387 PolarHBondContact O-N 3.08Å; K384-I388 HydrophobicContact CD-CD1 4.25Å; K384-I388 HydrophobicContact CG-CD1 3.62Å; K384-I388 HydrophobicContact CG-CG1 4.36Å; K384-I388 VanDerWaalsContact O-CB 3.3Å; K384-I388 WeakPolarHBondContact O-CB 3.46Å; K384-I388 VanDerWaalsContact O-CG1 3.28Å; K384-I388 WeakPolarHBondContact O-CG1 3.42Å; K384-I388 PolarHBondContact O-N 2.87Å
385	V	89.4	Confident	87.7	Confident	42 Å²	42	53.3 Å²	53.3	26%	0.255	28%	0.283	S	S	.	.	H	α-helix	trans	-65.3	-40.3	-179.8	168.8	0	0	0	0	110.7	F377 Q381 R382 E383 G389	F377-V385 HydrophobicContact CD1-CG2 4.35Å; F377-V385 HydrophobicContact CD2-CG1 4.38Å; F377-V385 HydrophobicContact CE1-CG2 4.43Å; F377-V385 HydrophobicContact CE2-CG1 4.09Å; F377-V385 HydrophobicContact CZ-CG1 4.31Å; Q381-V385 HydrophobicContact CB-CG2 4.36Å; Q381-V385 WeakPolarHBondContact O-CB 3.45Å; Q381-V385 WeakPolarHBondContact O-CG2 3.47Å; Q381-V385 PolarHBondContact O-N 3.17Å; R382-V385 PolarHBondContact O-N 3.24Å; E383-V385 PolarHBondContact O-N 3.26Å; V385-G389 WeakPolarHBondContact O-CA 3.19Å; V385-G389 PolarHBondContact O-N 3.04Å
386	I	89.8	Confident	88	Confident	12 Å²	12	53.1 Å²	53.1	6%	0.062	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-53.5	175.6	-65.6	160.1	0	0	0	109.6	Q314 V371 R382 E383 K384 G389 V390	Q314-I386 VanDerWaalsContact NE2-CD1 3.31Å; V371-I386 HydrophobicContact CG2-CD1 4.22Å; V371-I386 HydrophobicContact CG2-CG2 4.19Å; R382-I386 WeakPolarHBondContact O-CD1 3.37Å; R382-I386 WeakPolarHBondContact O-CG1 3.48Å; R382-I386 PolarHBondContact O-N 3.21Å; E383-I386 PolarHBondContact O-N 2.88Å; K384-I386 VanDerWaalsContact C-N 3.34Å; I386-G389 PolarHBondContact O-N 2.67Å; I386-V390 HydrophobicContact CG2-CG2 4.01Å; I386-V390 VanDerWaalsContact O-CB 3.29Å; I386-V390 WeakPolarHBondContact O-CB 3.14Å; I386-V390 WeakPolarHBondContact O-CG2 3.42Å; I386-V390 PolarHBondContact O-N 3.34Å
387	T	89.3	Confident	88.2	Confident	48 Å²	48	47.5 Å²	47.5	29%	0.294	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-52.1	-177.5	-62.8	0	0	0	0	111.7	L164 E383 K384 G389 V390 I391	L164-T387 HydrophobicContact CD1-CG2 4.45Å; E383-T387 WeakPolarHBondContact O-CB 3.44Å; E383-T387 PolarHBondContact O-N 2.97Å; E383-T387 PolarHBondContact O-OG1 2.98Å; E383-T387 VanDerWaalsContact O-OG1 3.1Å; K384-T387 PolarHBondContact O-N 3.08Å; T387-G389 PolarHBondContact O-N 2.91Å; T387-V390 PolarHBondContact O-N 3.23Å; T387-I391 HydrophobicContact CG2-CD1 3.93Å; T387-I391 VanDerWaalsContact O-CG1 3.29Å; T387-I391 WeakPolarHBondContact O-CG1 3.28Å; T387-I391 PolarHBondContact O-N 3.33Å; T387-I391 VanDerWaalsContact O-N 3.08Å
388	I	91.4	Very high	88.5	Confident	41 Å²	41	44 Å²	44	21%	0.21	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-47.8	177.2	-69.9	175.9	0	0	0	110.6	L164 F167 K384 V390 L392	L164-I388 HydrophobicContact CD1-CG1 4.19Å; F167-I388 HydrophobicContact CB-CD1 4.26Å; F167-I388 HydrophobicContact CB-CG1 4.41Å; F167-I388 HydrophobicContact CD1-CG1 3.99Å; F167-I388 HydrophobicContact CD2-CB 4.45Å; F167-I388 HydrophobicContact CD2-CD1 4.44Å; F167-I388 HydrophobicContact CD2-CG1 4.06Å; F167-I388 HydrophobicContact CD2-CG2 3.84Å; F167-I388 HydrophobicContact CE1-CG1 4.28Å; F167-I388 HydrophobicContact CE2-CB 4.34Å; F167-I388 HydrophobicContact CE2-CG1 4.35Å; F167-I388 HydrophobicContact CE2-CG2 3.71Å; F167-I388 HydrophobicContact CG-CD1 4.21Å; F167-I388 HydrophobicContact CG-CG1 3.87Å; F167-I388 HydrophobicContact CZ-CB 4.47Å; F167-I388 HydrophobicContact CZ-CG1 4.44Å; F167-I388 HydrophobicContact CZ-CG2 4.27Å; K384-I388 HydrophobicContact CD-CD1 4.25Å; K384-I388 HydrophobicContact CG-CD1 3.62Å; K384-I388 HydrophobicContact CG-CG1 4.36Å; K384-I388 VanDerWaalsContact O-CB 3.3Å; K384-I388 WeakPolarHBondContact O-CB 3.46Å; K384-I388 VanDerWaalsContact O-CG1 3.28Å; K384-I388 WeakPolarHBondContact O-CG1 3.42Å; K384-I388 PolarHBondContact O-N 2.87Å; I388-V390 PolarHBondContact O-N 2.92Å; I388-L392 HydrophobicContact CG2-CD1 3.75Å; I388-L392 HydrophobicContact CG2-CG 4.41Å; I388-L392 WeakPolarHBondContact O-CB 3.48Å; I388-L392 VanDerWaalsContact O-CG 3.25Å; I388-L392 WeakPolarHBondContact O-CG 3.13Å; I388-L392 PolarHBondContact O-N 2.99Å
389	G	94.2	Very high	88.9	Confident	13 Å²	13	41.9 Å²	41.9	13%	0.134	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-41.4	-177.5	0	0	0	0	0	112.8	V385 I386 T387 C393	V385-G389 WeakPolarHBondContact O-CA 3.19Å; V385-G389 PolarHBondContact O-N 3.04Å; I386-G389 PolarHBondContact O-N 2.67Å; T387-G389 PolarHBondContact O-N 2.91Å; G389-C393 VanDerWaalsContact O-CB 3.3Å; G389-C393 WeakPolarHBondContact O-CB 3.48Å; G389-C393 PolarHBondContact O-N 3.43Å; G389-C393 PolarHBondContact O-SG 3.4Å
390	V	93.9	Very high	89.7	Confident	16 Å²	16	41.1 Å²	41.1	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-50.5	179.7	169.7	0	0	0	0	109.7	H367 L370 I386 T387 I388 L392 C393 Q394	H367-V390 HydrophobicContact CB-CG2 4.05Å; H367-V390 WeakPolarHBondContact ND1-CG2 3.32Å; L370-V390 HydrophobicContact CD1-CB 4.4Å; L370-V390 HydrophobicContact CD1-CG2 3.74Å; I386-V390 HydrophobicContact CG2-CG2 4.01Å; I386-V390 VanDerWaalsContact O-CB 3.29Å; I386-V390 WeakPolarHBondContact O-CB 3.14Å; I386-V390 WeakPolarHBondContact O-CG2 3.42Å; I386-V390 PolarHBondContact O-N 3.34Å; T387-V390 PolarHBondContact O-N 3.23Å; I388-V390 PolarHBondContact O-N 2.92Å; V390-L392 VanDerWaalsContact C-N 3.34Å; V390-L392 PolarHBondContact O-N 3.18Å; V390-C393 PolarHBondContact O-N 3.26Å; V390-Q394 HydrophobicContact CG1-CG 4.29Å; V390-Q394 WeakPolarHBondContact O-CB 3.38Å; V390-Q394 VanDerWaalsContact O-CG 3.27Å; V390-Q394 WeakPolarHBondContact O-CG 3.49Å; V390-Q394 PolarHBondContact O-N 3.3Å
391	I	93.7	Very high	90.4	Very high	23 Å²	23	39.9 Å²	39.9	12%	0.118	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-49.9	179	-67.2	167.9	0	0	0	109.5	F167 Y168 L171 T387 C393 Q394 S395	F167-I391 HydrophobicContact CE1-CB 4.35Å; F167-I391 HydrophobicContact CE1-CD1 3.9Å; F167-I391 HydrophobicContact CE1-CG2 4.19Å; F167-I391 HydrophobicContact CZ-CB 4Å; F167-I391 HydrophobicContact CZ-CD1 4.42Å; F167-I391 HydrophobicContact CZ-CG2 3.81Å; Y168-I391 HydrophobicContact CE1-CD1 4.29Å; L171-I391 HydrophobicContact CD1-CG2 4.38Å; L171-I391 HydrophobicContact CD2-CG2 3.56Å; T387-I391 HydrophobicContact CG2-CD1 3.93Å; T387-I391 VanDerWaalsContact O-CG1 3.29Å; T387-I391 WeakPolarHBondContact O-CG1 3.28Å; T387-I391 PolarHBondContact O-N 3.33Å; T387-I391 VanDerWaalsContact O-N 3.08Å; I391-C393 PolarHBondContact O-N 3.03Å; I391-Q394 PolarHBondContact O-N 3.35Å; I391-S395 WeakPolarHBondContact O-CB 3.28Å; I391-S395 PolarHBondContact O-N 2.97Å; I391-S395 PolarHBondContact O-OG 3.4Å
392	L	94.4	Very high	90.8	Very high	76 Å²	76	37.2 Å²	37.2	40%	0.398	20%	0.196	S	C	.	.	H	α-helix	trans	-59.8	-48.1	178.8	-73	174.7	0	0	0	112.8	F167 I388 V390 Q394 S395 I396	F167-L392 HydrophobicContact CE2-CD1 4.19Å; F167-L392 HydrophobicContact CE2-CD2 3.94Å; F167-L392 HydrophobicContact CE2-CG 3.84Å; F167-L392 HydrophobicContact CZ-CG 4.28Å; I388-L392 HydrophobicContact CG2-CD1 3.75Å; I388-L392 HydrophobicContact CG2-CG 4.41Å; I388-L392 WeakPolarHBondContact O-CB 3.48Å; I388-L392 VanDerWaalsContact O-CG 3.25Å; I388-L392 WeakPolarHBondContact O-CG 3.13Å; I388-L392 PolarHBondContact O-N 2.99Å; V390-L392 VanDerWaalsContact C-N 3.34Å; V390-L392 PolarHBondContact O-N 3.18Å; L392-Q394 VanDerWaalsContact C-N 3.33Å; L392-Q394 PolarHBondContact O-N 3.29Å; L392-S395 PolarHBondContact O-N 3.42Å; L392-I396 WeakPolarHBondContact O-CB 3.47Å; L392-I396 WeakPolarHBondContact O-CD1 3.14Å; L392-I396 WeakPolarHBondContact O-CG1 3.49Å; L392-I396 PolarHBondContact O-N 2.89Å
393	C	95.4	Very high	91	Very high	30 Å²	30	38.6 Å²	38.6	20%	0.203	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-41	179.6	-70.9	0	0	0	0	111.8	L362 C366 G389 V390 I391 I396 S397	L362-C393 HydrophobicContact CD1-CB 4.1Å; L362-C393 HydrophobicContact CG-CB 4.44Å; C366-C393 HydrophobicContact CB-CB 3.33Å; G389-C393 VanDerWaalsContact O-CB 3.3Å; G389-C393 WeakPolarHBondContact O-CB 3.48Å; G389-C393 PolarHBondContact O-N 3.43Å; G389-C393 PolarHBondContact O-SG 3.4Å; V390-C393 PolarHBondContact O-N 3.26Å; I391-C393 PolarHBondContact O-N 3.03Å; C393-I396 PolarHBondContact O-N 3.03Å; C393-S397 WeakPolarHBondContact O-CB 3.43Å; C393-S397 PolarHBondContact O-N 3.36Å
394	Q	94.3	Very high	91.3	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-45.7	176.3	-72	-178	2.4	0	0	111.1	V390 I391 L392 I396 S397 M398	V390-Q394 HydrophobicContact CG1-CG 4.29Å; V390-Q394 WeakPolarHBondContact O-CB 3.38Å; V390-Q394 VanDerWaalsContact O-CG 3.27Å; V390-Q394 WeakPolarHBondContact O-CG 3.49Å; V390-Q394 PolarHBondContact O-N 3.3Å; I391-Q394 PolarHBondContact O-N 3.35Å; L392-Q394 VanDerWaalsContact C-N 3.33Å; L392-Q394 PolarHBondContact O-N 3.29Å; Q394-I396 PolarHBondContact O-N 3.37Å; Q394-S397 WeakPolarHBondContact O-CB 3.21Å; Q394-S397 PolarHBondContact O-N 2.98Å; Q394-M398 WeakPolarHBondContact O-CG 3.44Å; Q394-M398 PolarHBondContact O-N 3.47Å
395	S	92.4	Very high	91.3	Very high	11 Å²	11	31.8 Å²	31.8	8%	0.077	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-43.8	175.7	-56.2	0	0	0	0	111.9	Y175 I391 L392 S397 M398 V399	Y175-S395 PolarHBondContact OH-OG 3.47Å; I391-S395 WeakPolarHBondContact O-CB 3.28Å; I391-S395 PolarHBondContact O-N 2.97Å; I391-S395 PolarHBondContact O-OG 3.4Å; L392-S395 PolarHBondContact O-N 3.42Å; S395-S397 VanDerWaalsContact C-N 3.34Å; S395-S397 PolarHBondContact O-N 3.43Å; S395-M398 WeakPolarHBondContact O-CB 3.14Å; S395-M398 PolarHBondContact O-N 3.02Å; S395-V399 WeakPolarHBondContact O-CG2 3.26Å; S395-V399 PolarHBondContact O-N 3.3Å
396	I	93.1	Very high	90.8	Very high	90 Å²	90	30.5 Å²	30.5	46%	0.462	17%	0.166	S	C	.	.	H	α-helix	trans	-62.7	-43.5	176	-68.4	164.5	0	0	0	110.4	L362 L392 C393 Q394 M398 V399 I400	L362-I396 HydrophobicContact CD2-CB 4.23Å; L362-I396 HydrophobicContact CD2-CG2 3.8Å; L392-I396 WeakPolarHBondContact O-CB 3.47Å; L392-I396 WeakPolarHBondContact O-CD1 3.14Å; L392-I396 WeakPolarHBondContact O-CG1 3.49Å; L392-I396 PolarHBondContact O-N 2.89Å; C393-I396 PolarHBondContact O-N 3.03Å; Q394-I396 PolarHBondContact O-N 3.37Å; I396-M398 VanDerWaalsContact C-N 3.33Å; I396-M398 PolarHBondContact O-N 3.23Å; I396-V399 PolarHBondContact O-N 2.9Å; I396-I400 HydrophobicContact CG2-CD1 3.96Å; I396-I400 HydrophobicContact CG2-CG1 4.49Å; I396-I400 WeakPolarHBondContact O-CG1 3.32Å; I396-I400 PolarHBondContact O-N 3.18Å
397	S	94.3	Very high	90.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-43.7	175.1	177	0	0	0	0	112	G359 W363 C393 Q394 S395 V399 I400 L401	G359-S397 VanDerWaalsContact C-OG 3.29Å; G359-S397 PolarHBondContact O-OG 3.46Å; W363-S397 WeakPolarHBondContact CB-OG 3.29Å; C393-S397 WeakPolarHBondContact O-CB 3.43Å; C393-S397 PolarHBondContact O-N 3.36Å; Q394-S397 WeakPolarHBondContact O-CB 3.21Å; Q394-S397 PolarHBondContact O-N 2.98Å; S395-S397 VanDerWaalsContact C-N 3.34Å; S395-S397 PolarHBondContact O-N 3.43Å; S397-V399 VanDerWaalsContact C-N 3.32Å; S397-V399 PolarHBondContact O-N 2.89Å; S397-I400 PolarHBondContact O-N 3.4Å; S397-L401 WeakPolarHBondContact O-CG 3.2Å; S397-L401 PolarHBondContact O-N 3.45Å
398	M	91	Very high	89.3	Confident	5 Å²	5	32.9 Å²	32.9	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-56.9	-46.9	174.5	-64.3	-49.9	173.9	0	0	111.4	L203 M249 Q394 S395 I396 I400 L401 Y402	L203-M398 HydrophobicContact CD1-SD 3.69Å; M249-M398 HydrophobicContact CB-CE 4.08Å; M249-M398 HydrophobicContact CE-CE 3.47Å; M249-M398 VanDerWaalsContact CE-CE 3.47Å; M249-M398 HydrophobicContact CE-SD 3.17Å; M249-M398 WeakPolarHBondContact CE-SD 3.41Å; M249-M398 HydrophobicContact CG-CE 3.31Å; M249-M398 HydrophobicContact CG-SD 4.08Å; M249-M398 HydrophobicContact SD-CE 3.5Å; M249-M398 WeakPolarHBondContact SD-CE 3.32Å; M249-M398 HydrophobicContact SD-SD 3.38Å; Q394-M398 WeakPolarHBondContact O-CG 3.44Å; Q394-M398 PolarHBondContact O-N 3.47Å; S395-M398 WeakPolarHBondContact O-CB 3.14Å; S395-M398 PolarHBondContact O-N 3.02Å; I396-M398 VanDerWaalsContact C-N 3.33Å; I396-M398 PolarHBondContact O-N 3.23Å; M398-I400 VanDerWaalsContact C-N 3.35Å; M398-I400 PolarHBondContact O-N 3.32Å; M398-L401 PolarHBondContact O-N 3.04Å; M398-Y402 WeakPolarHBondContact O-CB 3.38Å; M398-Y402 PolarHBondContact O-N 3.12Å
399	V	90.1	Very high	87.8	Confident	63 Å²	63	32.4 Å²	32.4	38%	0.382	18%	0.179	S	C	.	.	H	α-helix	trans	-61.3	-43.9	179.6	173.9	0	0	0	0	111	S395 I396 S397 Y402 Q403	S395-V399 WeakPolarHBondContact O-CG2 3.26Å; S395-V399 PolarHBondContact O-N 3.3Å; I396-V399 PolarHBondContact O-N 2.9Å; S397-V399 VanDerWaalsContact C-N 3.32Å; S397-V399 PolarHBondContact O-N 2.89Å; V399-Y402 PolarHBondContact O-N 3.33Å; V399-Q403 HydrophobicContact CG1-CG 4.44Å; V399-Q403 WeakPolarHBondContact O-CB 3.3Å; V399-Q403 WeakPolarHBondContact O-CG 3.34Å; V399-Q403 PolarHBondContact O-N 2.94Å
400	I	91.1	Very high	86	Confident	58 Å²	58	36.5 Å²	36.5	30%	0.297	20%	0.197	S	C	.	.	H	α-helix	trans	-59.3	-49.5	176.6	-68.5	167.6	0	0	0	110.6	L362 I396 S397 M398 Y402 L404	L362-I400 HydrophobicContact CD2-CD1 4.17Å; I396-I400 HydrophobicContact CG2-CD1 3.96Å; I396-I400 HydrophobicContact CG2-CG1 4.49Å; I396-I400 WeakPolarHBondContact O-CG1 3.32Å; I396-I400 PolarHBondContact O-N 3.18Å; S397-I400 PolarHBondContact O-N 3.4Å; M398-I400 VanDerWaalsContact C-N 3.35Å; M398-I400 PolarHBondContact O-N 3.32Å; I400-Y402 VanDerWaalsContact C-N 3.32Å; I400-Y402 PolarHBondContact O-N 2.85Å; I400-L404 VanDerWaalsContact O-CB 3.32Å; I400-L404 WeakPolarHBondContact O-CB 3.43Å; I400-L404 PolarHBondContact O-N 3.38Å
401	L	90.7	Very high	84.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-41.8	179.1	-69	171.2	0	0	0	111.3	L203 M249 L253 F356 S397 M398 L404 F405	L203-L401 HydrophobicContact CD2-CB 4.35Å; M249-L401 HydrophobicContact CE-CD1 4.13Å; L253-L401 HydrophobicContact CD2-CD1 3.81Å; L253-L401 HydrophobicContact CD2-CD2 4.46Å; F356-L401 HydrophobicContact CD2-CD2 3.59Å; F356-L401 HydrophobicContact CE2-CD2 3.84Å; S397-L401 WeakPolarHBondContact O-CG 3.2Å; S397-L401 PolarHBondContact O-N 3.45Å; M398-L401 PolarHBondContact O-N 3.04Å; L401-L404 WeakPolarHBondContact O-CB 3.11Å; L401-L404 PolarHBondContact O-N 3Å; L401-F405 HydrophobicContact CB-CE2 4.19Å; L401-F405 HydrophobicContact CD2-CE2 4.42Å; L401-F405 WeakPolarHBondContact O-CD2 3.5Å; L401-F405 PolarHBondContact O-N 3.28Å
402	Y	89.1	Confident	82.2	Confident	19 Å²	19	45.8 Å²	45.8	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-47.7	-179.2	-166.3	-93.4	0	0	0	112.1	Y182 L186 L203 M398 V399 I400 L404 F405 L406	Y182-Y402 HydrophobicContact CD1-CE1 4.23Å; Y182-Y402 HydrophobicContact CG-CE1 4.2Å; L186-Y402 WeakPolarHBondContact CB-OH 3.45Å; L186-Y402 HydrophobicContact CD1-CE2 4.25Å; L186-Y402 WeakPolarHBondContact CD1-OH 3.17Å; L186-Y402 WeakPolarHBondContact CD2-OH 3.29Å; L186-Y402 WeakPolarHBondContact CG-OH 3.4Å; L203-Y402 HydrophobicContact CD2-CD2 3.63Å; L203-Y402 HydrophobicContact CD2-CG 4.21Å; L203-Y402 HydrophobicContact CG-CD2 3.94Å; M398-Y402 WeakPolarHBondContact O-CB 3.38Å; M398-Y402 PolarHBondContact O-N 3.12Å; V399-Y402 PolarHBondContact O-N 3.33Å; I400-Y402 VanDerWaalsContact C-N 3.32Å; I400-Y402 PolarHBondContact O-N 2.85Å; Y402-L404 VanDerWaalsContact C-N 3.29Å; Y402-L404 PolarHBondContact O-N 2.92Å; Y402-F405 PolarHBondContact O-N 2.88Å; Y402-L406 HydrophobicContact CD1-CD1 3.59Å; Y402-L406 HydrophobicContact CD1-CG 4.23Å; Y402-L406 HydrophobicContact CE1-CD1 3.24Å; Y402-L406 HydrophobicContact CE1-CG 4.09Å; Y402-L406 WeakPolarHBondContact O-CB 3.41Å; Y402-L406 WeakPolarHBondContact O-CG 3.37Å; Y402-L406 PolarHBondContact O-N 2.9Å
403	Q	87.8	Confident	80.4	Confident	94 Å²	94	45.4 Å²	45.4	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-61.3	-38.8	173.9	-72.5	-173.6	1.5	0	0	111.9	Y182 V399 S407	Y182-Q403 PolarHBondContact OH-NE2 3.15Å; V399-Q403 HydrophobicContact CG1-CG 4.44Å; V399-Q403 WeakPolarHBondContact O-CB 3.3Å; V399-Q403 WeakPolarHBondContact O-CG 3.34Å; V399-Q403 PolarHBondContact O-N 2.94Å; Q403-S407 VanDerWaalsContact O-CB 3.32Å; Q403-S407 WeakPolarHBondContact O-CB 3.38Å; Q403-S407 PolarHBondContact O-N 3.13Å; Q403-S407 PolarHBondContact O-OG 3.37Å
404	L	86.9	Confident	78.4	Confident	17 Å²	17	48.6 Å²	48.6	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-43.9	178	-174.4	68.7	0	0	0	111.9	F352 C355 F356 I400 L401 Y402 S407 R408	F352-L404 HydrophobicContact CD2-CD1 3.58Å; F352-L404 HydrophobicContact CD2-CD2 3.98Å; F352-L404 HydrophobicContact CD2-CG 3.75Å; F352-L404 HydrophobicContact CE2-CD1 3.99Å; F352-L404 HydrophobicContact CE2-CD2 3.7Å; F352-L404 HydrophobicContact CE2-CG 3.58Å; F352-L404 HydrophobicContact CG-CD1 4.45Å; F352-L404 HydrophobicContact CZ-CD2 4.17Å; F352-L404 HydrophobicContact CZ-CG 4.49Å; C355-L404 HydrophobicContact CB-CD1 3.84Å; C355-L404 HydrophobicContact CB-CD2 4.42Å; F356-L404 HydrophobicContact CB-CD2 3.61Å; F356-L404 HydrophobicContact CD2-CD2 4.18Å; F356-L404 HydrophobicContact CG-CD2 4.37Å; I400-L404 VanDerWaalsContact O-CB 3.32Å; I400-L404 WeakPolarHBondContact O-CB 3.43Å; I400-L404 PolarHBondContact O-N 3.38Å; L401-L404 WeakPolarHBondContact O-CB 3.11Å; L401-L404 PolarHBondContact O-N 3Å; Y402-L404 VanDerWaalsContact C-N 3.29Å; Y402-L404 PolarHBondContact O-N 2.92Å; L404-S407 PolarHBondContact O-OG 3.36Å; L404-R408 WeakPolarHBondContact O-CG 3.43Å; L404-R408 PolarHBondContact O-N 2.88Å
405	F	84.4	Confident	76.3	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	25%	0.253	C	S	.	.	H	α-helix	trans	-74.3	-36.9	179.8	-67.4	-57.6	0	0	0	113	M196 V199 L200 L203 L256 F352 F356 L401 Y402 S409	M196-F405 HydrophobicContact SD-CD1 4.11Å; M196-F405 HydrophobicContact SD-CE1 4.4Å; V199-F405 HydrophobicContact CG1-CD1 4.16Å; V199-F405 HydrophobicContact CG1-CD2 3.79Å; V199-F405 HydrophobicContact CG1-CE1 4.04Å; V199-F405 HydrophobicContact CG1-CE2 3.68Å; V199-F405 HydrophobicContact CG1-CG 4.07Å; V199-F405 HydrophobicContact CG1-CZ 3.83Å; L200-F405 HydrophobicContact CD2-CB 3.73Å; L200-F405 HydrophobicContact CG-CB 4.32Å; L203-F405 HydrophobicContact CD2-CD2 4.13Å; L256-F405 HydrophobicContact CD1-CE1 4.25Å; L256-F405 HydrophobicContact CD1-CE2 4.32Å; L256-F405 HydrophobicContact CD1-CZ 3.59Å; F352-F405 HydrophobicContact CZ-CE1 4.15Å; F356-F405 HydrophobicContact CD2-CZ 4.11Å; F356-F405 AromaticContact CE2-CZ 3.91Å; F356-F405 HydrophobicContact CE2-CZ 3.91Å; L401-F405 HydrophobicContact CB-CE2 4.19Å; L401-F405 HydrophobicContact CD2-CE2 4.42Å; L401-F405 WeakPolarHBondContact O-CD2 3.5Å; L401-F405 PolarHBondContact O-N 3.28Å; Y402-F405 PolarHBondContact O-N 2.88Å; F405-S409 PolarHBondContact O-N 2.86Å; F405-S409 VanDerWaalsContact O-N 3.08Å
406	L	80.6	Confident	74.4	Confident	15 Å²	15	52.1 Å²	52.1	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-46.3	175.8	-76	-178.3	0	0	0	112.7	Y182 A189 L200 Y402 R408 S409 L410	Y182-L406 HydrophobicContact CD1-CD1 4.36Å; A189-L406 HydrophobicContact CB-CD2 3.77Å; L200-L406 HydrophobicContact CD1-CD2 4.15Å; L200-L406 HydrophobicContact CD2-CD2 4.04Å; L200-L406 HydrophobicContact CD2-CG 4.22Å; Y402-L406 HydrophobicContact CD1-CD1 3.59Å; Y402-L406 HydrophobicContact CD1-CG 4.23Å; Y402-L406 HydrophobicContact CE1-CD1 3.24Å; Y402-L406 HydrophobicContact CE1-CG 4.09Å; Y402-L406 WeakPolarHBondContact O-CB 3.41Å; Y402-L406 WeakPolarHBondContact O-CG 3.37Å; Y402-L406 PolarHBondContact O-N 2.9Å; L406-R408 PolarHBondContact O-N 2.92Å; L406-S409 PolarHBondContact O-N 3.43Å; L406-S409 PolarHBondContact O-OG 3.24Å; L406-L410 PolarHBondContact O-N 2.88Å
407	S	77.5	Confident	72.4	Confident	61 Å²	61	53 Å²	53	43%	0.427	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-34.4	180	57.8	0	0	0	0	112.5	Q403 L404 Y411	Q403-S407 VanDerWaalsContact O-CB 3.32Å; Q403-S407 WeakPolarHBondContact O-CB 3.38Å; Q403-S407 PolarHBondContact O-N 3.13Å; Q403-S407 PolarHBondContact O-OG 3.37Å; L404-S407 PolarHBondContact O-OG 3.36Å; S407-Y411 PolarHBondContact O-N 3.35Å
408	R	68.9	Low	70.2	Confident	48 Å²	48	56.2 Å²	56.2	18%	0.181	30%	0.297	C	S	.	.	H	α-helix	trans	-82.9	-28.6	179	-67	-61.3	-170.7	177.7	2.7	113.9	L348 F352 L404 L406 L410 Y411 W412	L348-R408 PolarHBondContact O-NH2 2.98Å; F352-R408 HydrophobicContact CD2-CG 3.85Å; F352-R408 HydrophobicContact CE2-CG 4.13Å; L404-R408 WeakPolarHBondContact O-CG 3.43Å; L404-R408 PolarHBondContact O-N 2.88Å; L406-R408 PolarHBondContact O-N 2.92Å; R408-L410 PolarHBondContact O-N 2.93Å; R408-Y411 PolarHBondContact O-N 3.49Å; R408-W412 PolarHBondContact O-N 3.41Å
409	S	61	Low	68.2	Low	32 Å²	32	60 Å²	60	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-60.5	-38.4	170.7	78.1	0	0	0	0	110.7	F405 L406 E413	F405-S409 PolarHBondContact O-N 2.86Å; F405-S409 VanDerWaalsContact O-N 3.08Å; L406-S409 PolarHBondContact O-N 3.43Å; L406-S409 PolarHBondContact O-OG 3.24Å; S409-E413 PolarHBondContact O-N 3.2Å
410	L	55.9	Low	66.4	Low	98 Å²	98	63 Å²	63	51%	0.513	34%	0.342	S	S	.	.	H	α-helix	trans	-67.9	-39.7	173.8	-65.5	169.8	0	0	0	112.7	L406 R408 W412 E413 V414	L406-L410 PolarHBondContact O-N 2.88Å; R408-L410 PolarHBondContact O-N 2.93Å; L410-W412 PolarHBondContact O-N 3.06Å; L410-E413 VanDerWaalsContact O-CB 3.3Å; L410-E413 WeakPolarHBondContact O-CB 3.3Å; L410-E413 PolarHBondContact O-N 3.19Å; L410-V414 PolarHBondContact O-N 2.95Å
411	Y	54	Low	64.4	Low	105 Å²	105	64.1 Å²	64.1	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-40.6	176.3	179.3	-92.1	0	0	0	112.7	L348 S407 R408 E413 V414 S415	L348-Y411 HydrophobicContact CD1-CE2 4.09Å; S407-Y411 PolarHBondContact O-N 3.35Å; R408-Y411 PolarHBondContact O-N 3.49Å; Y411-E413 VanDerWaalsContact C-N 3.29Å; Y411-E413 PolarHBondContact O-N 3.37Å; Y411-V414 PolarHBondContact O-N 3.2Å; Y411-S415 VanDerWaalsContact CE1-OG 3.3Å; Y411-S415 WeakPolarHBondContact CE1-OG 3.16Å; Y411-S415 WeakPolarHBondContact O-CB 3.3Å; Y411-S415 PolarHBondContact O-N 3.29Å; Y411-S415 PolarHBondContact O-OG 2.97Å
412	W	53.5	Low	62.1	Low	129 Å²	129	70.9 Å²	70.9	49%	0.489	39%	0.39	S	S	.	.	H	α-helix	trans	-65.1	-34.6	174.8	-80.1	111.8	0	0	0	112	L273 R408 L410 S415 S416	L273-W412 HydrophobicContact CD1-CZ2 4.19Å; R408-W412 PolarHBondContact O-N 3.41Å; L410-W412 PolarHBondContact O-N 3.06Å; W412-S415 PolarHBondContact O-N 3.28Å; W412-S416 VanDerWaalsContact O-CB 3.3Å; W412-S416 WeakPolarHBondContact O-CB 3.31Å; W412-S416 PolarHBondContact O-N 3.5Å; W412-S416 PolarHBondContact O-OG 3.5Å
413	E	56.2	Low	60	Low	68 Å²	68	74.6 Å²	74.6	32%	0.318	42%	0.417	S	S	.	.	H	α-helix	trans	-59.4	-54.6	172.3	-175.7	173.4	-166.6	0	0	110.5	K192 S409 L410 Y411 S415 S416 L417	K192-E413 IonicContact NZ-OE1 2.78Å; K192-E413 PolarHBondContact NZ-OE1 3.44Å; K192-E413 IonicContact NZ-OE2 3.37Å; K192-E413 PolarHBondContact NZ-OE2 2.96Å; S409-E413 PolarHBondContact O-N 3.2Å; L410-E413 VanDerWaalsContact O-CB 3.3Å; L410-E413 WeakPolarHBondContact O-CB 3.3Å; L410-E413 PolarHBondContact O-N 3.19Å; Y411-E413 VanDerWaalsContact C-N 3.29Å; Y411-E413 PolarHBondContact O-N 3.37Å; E413-S415 VanDerWaalsContact C-N 3.32Å; E413-S415 PolarHBondContact O-N 3.48Å; E413-S416 PolarHBondContact O-N 3.05Å; E413-S416 PolarHBondContact O-OG 3.38Å; E413-L417 HydrophobicContact CG-CD1 4.07Å; E413-L417 VanDerWaalsContact O-CG 3.3Å; E413-L417 WeakPolarHBondContact O-CG 3.3Å; E413-L417 PolarHBondContact O-N 3.26Å
414	V	54.1	Low	58	Low	98 Å²	98	78.6 Å²	78.6	59%	0.594	44%	0.44	S	S	*	.	H	α-helix	trans	-62.1	-39.9	179.4	179.5	0	0	0	0	111.9	L410 Y411 L417 S418	L410-V414 PolarHBondContact O-N 2.95Å; Y411-V414 PolarHBondContact O-N 3.2Å; V414-L417 PolarHBondContact O-N 3.48Å; V414-S418 WeakPolarHBondContact O-CB 3.26Å; V414-S418 PolarHBondContact O-N 3.45Å
415	S	50.4	Low	56.3	Low	33 Å²	33	83.5 Å²	83.5	23%	0.231	47%	0.471	C	S	.	.	H	α-helix	trans	-66.6	-41.7	178.3	-58.8	0	0	0	0	112	Y411 W412 E413 S418 S419	Y411-S415 VanDerWaalsContact CE1-OG 3.3Å; Y411-S415 WeakPolarHBondContact CE1-OG 3.16Å; Y411-S415 WeakPolarHBondContact O-CB 3.3Å; Y411-S415 PolarHBondContact O-N 3.29Å; Y411-S415 PolarHBondContact O-OG 2.97Å; W412-S415 PolarHBondContact O-N 3.28Å; E413-S415 VanDerWaalsContact C-N 3.32Å; E413-S415 PolarHBondContact O-N 3.48Å; S415-S418 PolarHBondContact O-N 3.47Å; S415-S418 PolarHBondContact O-OG 3.37Å; S415-S419 PolarHBondContact O-N 2.97Å
416	S	51.6	Low	54.5	Low	60 Å²	60	92.5 Å²	92.5	42%	0.42	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-40.4	176.3	70.4	0	0	0	0	112	W412 E413 S419 V420	W412-S416 VanDerWaalsContact O-CB 3.3Å; W412-S416 WeakPolarHBondContact O-CB 3.31Å; W412-S416 PolarHBondContact O-N 3.5Å; W412-S416 PolarHBondContact O-OG 3.5Å; E413-S416 PolarHBondContact O-N 3.05Å; E413-S416 PolarHBondContact O-OG 3.38Å; S416-S419 PolarHBondContact O-N 2.79Å; S416-S419 PolarHBondContact O-OG 2.71Å; S416-V420 WeakPolarHBondContact O-CG2 3.38Å; S416-V420 PolarHBondContact O-N 3.31Å
417	L	51	Low	53	Low	109 Å²	109	96.7 Å²	96.7	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-67.1	-37	176	-68.5	169.1	0	0	0	112.2	E413 V414 S419 V420 S421	E413-L417 HydrophobicContact CG-CD1 4.07Å; E413-L417 VanDerWaalsContact O-CG 3.3Å; E413-L417 WeakPolarHBondContact O-CG 3.3Å; E413-L417 PolarHBondContact O-N 3.26Å; V414-L417 PolarHBondContact O-N 3.48Å; L417-S419 VanDerWaalsContact C-N 3.33Å; L417-S419 PolarHBondContact O-N 2.78Å; L417-V420 PolarHBondContact O-N 2.78Å; L417-S421 PolarHBondContact O-N 3.15Å; L417-S421 PolarHBondContact O-OG 3.44Å
418	S	48.4	Very low	51.4	Low	67 Å²	67	104.5 Å²	104.5	47%	0.469	57%	0.566	S	S	.	*	H	α-helix	trans	-67.2	-32.1	174.2	79.3	0	0	0	0	112.9	V414 S415 V420 S421	V414-S418 WeakPolarHBondContact O-CB 3.26Å; V414-S418 PolarHBondContact O-N 3.45Å; S415-S418 PolarHBondContact O-N 3.47Å; S415-S418 PolarHBondContact O-OG 3.37Å; S418-V420 VanDerWaalsContact C-N 3.31Å; S418-V420 PolarHBondContact O-N 3.37Å; S418-S421 WeakPolarHBondContact CA-OG 3.41Å; S418-S421 PolarHBondContact O-N 2.84Å; S418-S421 PolarHBondContact O-OG 3.44Å
419	S	48.8	Very low	50.3	Low	85 Å²	85	108.1 Å²	108.1	59%	0.594	59%	0.594	S	S	*	*	H	α-helix	trans	-74.6	-20.4	178.1	70.3	0	0	0	0	113.7	S415 S416 L417	S415-S419 PolarHBondContact O-N 2.97Å; S416-S419 PolarHBondContact O-N 2.79Å; S416-S419 PolarHBondContact O-OG 2.71Å; L417-S419 VanDerWaalsContact C-N 3.33Å; L417-S419 PolarHBondContact O-N 2.78Å
420	V	51.8	Low	49.4	Very low	125 Å²	125	113.4 Å²	113.4	76%	0.758	62%	0.62	S	S	*	*	H	α-helix	trans	-88	-16.4	177.2	175.2	0	0	0	0	112	S416 L417 S418	S416-V420 WeakPolarHBondContact O-CG2 3.38Å; S416-V420 PolarHBondContact O-N 3.31Å; L417-V420 PolarHBondContact O-N 2.78Å; S418-V420 VanDerWaalsContact C-N 3.31Å; S418-V420 PolarHBondContact O-N 3.37Å
421	S	49.3	Very low	48.9	Very low	82 Å²	82	117.3 Å²	117.3	57%	0.573	64%	0.635	S	S	*	*	S	Bend	trans	-95.5	9.6	-175	33.1	0	0	0	0	115.2	L417 S418 P423	L417-S421 PolarHBondContact O-N 3.15Å; L417-S421 PolarHBondContact O-OG 3.44Å; S418-S421 WeakPolarHBondContact CA-OG 3.41Å; S418-S421 PolarHBondContact O-N 2.84Å; S418-S421 PolarHBondContact O-OG 3.44Å; S421-P423 WeakPolarHBondContact O-CD 3.08Å
422	L	43.6	Very low	48.3	Very low	141 Å²	141	120 Å²	120	74%	0.738	65%	0.651	S	S	*	*			trans	-100.9	90.1	167.5	-89.4	152.6	0	0	0	110.2	L424	L422-L424 PolarHBondContact O-N 3.12Å; L422-L424 VanDerWaalsContact O-N 3.12Å
423	P	44.7	Very low	47.8	Very low	97 Å²	97	124.7 Å²	124.7	63%	0.63	67%	0.669	S	S	*	*			trans	-64.8	113.9	161.7	27.4	-29.1	0	0	0	107.2	S421 T425	S421-P423 WeakPolarHBondContact O-CD 3.08Å; P423-T425 PolarHBondContact O-N 2.82Å
424	L	46.3	Very low	47	Very low	178 Å²	178	124.8 Å²	124.8	93%	0.932	69%	0.688	S	S	*	*			trans	-68.3	77.1	163.6	-76	167.6	0	0	0	108.4	L422	L422-L424 PolarHBondContact O-N 3.12Å; L422-L424 VanDerWaalsContact O-N 3.12Å
425	T	50.1	Low	46.5	Very low	121 Å²	121	131.7 Å²	131.7	74%	0.742	70%	0.704	S	S	*	*			trans	-88.5	95.7	160.9	34.2	0	0	0	0	108.6	P423	P423-T425 PolarHBondContact O-N 2.82Å
426	M	47	Very low	45.9	Very low	190 Å²	190	141.8 Å²	141.8	94%	0.936	75%	0.754	S	S	*	*			trans	-123.9	99.6	143.2	-91.8	-158.7	166.7	0	0	108.7
427	S	47.9	Very low	45.6	Very low	104 Å²	104	145.9 Å²	145.9	73%	0.727	77%	0.77	S	S	*	*			trans	-59.8	138.1	159.5	48.7	0	0	0	0	109.7
428	R	43.9	Very low	45.3	Very low	224 Å²	224	147.8 Å²	147.8	85%	0.845	78%	0.781	S	S	*	*			trans	-138.6	77.9	147.1	-144.3	173.7	179.7	172.3	0.1	109.3	N430	R428-N430 PolarHBondContact O-N 3.27Å
429	T	46.1	Very low	45.2	Very low	125 Å²	125	152.3 Å²	152.3	77%	0.767	80%	0.798	S	S	*	*			trans	-53.8	113.7	152.4	12.8	0	0	0	0	108.2
430	N	41.8	Very low	45	Very low	143 Å²	143	156.3 Å²	156.3	77%	0.765	81%	0.81	S	S	*	*			trans	-123.4	100.7	158.2	-97.6	-4.7	0	0	0	107.4	R428	R428-N430 PolarHBondContact O-N 3.27Å
431	H	45.8	Very low	44.5	Very low	180 Å²	180	158.3 Å²	158.3	83%	0.833	81%	0.814	S	S	*	*			trans	-109.9	138.5	167.8	-137.3	-4.6	0	0	0	107.4
432	H	41.1	Very low	44.2	Very low	162 Å²	162	163.3 Å²	163.3	75%	0.75	83%	0.83	S	S	*	*			trans	110.2	135.2	177.2	-71.1	-29.2	0	0	0	113.4
433	R	43.1	Very low	44.3	Very low	226 Å²	226	164.9 Å²	164.9	85%	0.853	84%	0.836	S	S	*	*			cis	-170.9	146.8	5.8	-130.8	171.8	173.8	177	-1.4	107.2
434	G	40.8	Very low	44.2	Very low	70 Å²	70	170.2 Å²	170.2	72%	0.722	85%	0.852	S	S	*	*			trans	92.9	119.1	135.3	0	0	0	0	0	120.3
435	R	43	Very low	44.1	Very low	244 Å²	244	169.5 Å²	169.5	92%	0.921	85%	0.845	S	S	*	*			trans	46.4	115.2	140.9	-65.1	-177.6	-175.6	-178.9	0.4	118.7
436	L	38	Very low	43.5	Very low	245 Å²	245	173.9 Å²	173.9	100%	1.283	86%	0.855	S	S	*	*				-164.3	0	84.7	-106.7	153.6	0	0	0	109.6

Retrieved 436 of 436 residues in 280 ms (Link to these results)

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