A0A3Q0KQH3_SCHMA Loading...

Protein wntless homolog

AlphaFold DB , UniProt , Accession A0A3Q0KQH3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 627 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	54.3	Low	74.3	Confident	49 Å²	49	42.1 Å²	42.1	24%	0.241	24%	0.24	C	C	.	.				0	92.7	0	-74.6	177.4	-143	0	0	109	N279 L281 Y450 R457	M1-N279 HydrophobicContact CE-CB 3.99Å; M1-N279 VanDerWaalsContact CG-ND2 3.32Å; M1-N279 WeakPolarHBondContact CG-ND2 3.46Å; M1-L281 HydrophobicContact CE-CB 3.53Å; M1-L281 HydrophobicContact CE-CD2 3.76Å; M1-L281 HydrophobicContact CE-CG 4.28Å; M1-L281 HydrophobicContact SD-CD2 3.98Å; M1-Y450 PolarHBondContact N-OH 2.83Å; M1-Y450 VanDerWaalsContact N-OH 3.09Å; M1-R457 PolarHBondContact O-NH1 3.18Å; M1-R457 PolarHBondContact O-NH2 3.32Å
2	A	54.6	Low	75.7	Confident	29 Å²	29	55.8 Å²	55.8	24%	0.24	29%	0.285	C	S	.	.			trans	-88	143.8	168.4	0	0	0	0	0	109.2	Y450 F524	A2-Y450 HydrophobicContact CB-CD2 3.97Å; A2-Y450 HydrophobicContact CB-CE2 3.76Å; A2-F524 HydrophobicContact CB-CE1 4.06Å
3	G	62.4	Low	76.8	Confident	4 Å²	4	62.3 Å²	62.3	4%	0.041	31%	0.31	C	S	.	.			trans	91.8	37.4	161.7	0	0	0	0	0	118.4	E7 S521	G3-E7 PolarHBondContact N-OE2 2.98Å; G3-E7 VanDerWaalsContact N-OE2 3.11Å; G3-S521 WeakPolarHBondContact O-CB 3.49Å; G3-S521 PolarHBondContact O-N 3.15Å
4	V	78.5	Confident	77.6	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.03	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-85.2	153.8	168.5	164.5	0	0	0	0	110.5	L6 E7 T8 R457 L517 Y518	V4-L6 HydrophobicContact CG1-CB 4.17Å; V4-L6 PolarHBondContact O-N 3.04Å; V4-E7 WeakPolarHBondContact O-CB 3.41Å; V4-E7 PolarHBondContact O-N 2.84Å; V4-T8 PolarHBondContact O-N 2.98Å; V4-R457 VanDerWaalsContact CB-CZ 3.48Å; V4-L517 WeakPolarHBondContact CG1-O 3.43Å; V4-Y518 VanDerWaalsContact CG1-CA 3.45Å
5	V	80.6	Confident	78.4	Confident	32 Å²	32	59.8 Å²	59.8	19%	0.194	31%	0.31	C	S	.	.	H	α-helix	trans	-50.9	-44.1	-179.4	165.3	0	0	0	0	111.8	E7 T8 L9 S519	V5-E7 PolarHBondContact O-N 3.21Å; V5-T8 PolarHBondContact O-N 3.2Å; V5-T8 PolarHBondContact O-OG1 3.07Å; V5-L9 HydrophobicContact CG1-CD1 3.42Å; V5-L9 VanDerWaalsContact CG1-CD1 3.42Å; V5-L9 HydrophobicContact CG1-CD2 4.5Å; V5-L9 HydrophobicContact CG1-CG 3.8Å; V5-L9 WeakPolarHBondContact O-CG 3.5Å; V5-L9 PolarHBondContact O-N 3.23Å; V5-S519 WeakPolarHBondContact CG2-O 3.47Å; V5-S519 VanDerWaalsContact CG2-OG 3.27Å; V5-S519 WeakPolarHBondContact CG2-OG 3.36Å; V5-S519 PolarHBondContact N-O 3.29Å
6	L	80.9	Confident	79.3	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-54.1	-33.2	176.6	-173.7	58.3	0	0	0	114.5	V4 L14 Y456 R457 L517 Y518	V4-L6 HydrophobicContact CG1-CB 4.17Å; V4-L6 PolarHBondContact O-N 3.04Å; L6-L14 HydrophobicContact CD1-CD1 3.9Å; L6-L14 HydrophobicContact CD1-CD2 4.25Å; L6-Y456 HydrophobicContact CD1-CE1 4.38Å; L6-R457 HydrophobicContact CD2-CB 4.1Å; L6-R457 HydrophobicContact CD2-CG 3.9Å; L6-R457 HydrophobicContact CG-CG 4.32Å; L6-L517 HydrophobicContact CB-CB 4.3Å; L6-L517 WeakPolarHBondContact CB-O 3.37Å; L6-L517 HydrophobicContact CD1-CD1 4.36Å; L6-L517 HydrophobicContact CD1-CD2 4.17Å; L6-L517 PolarHBondContact N-O 2.74Å; L6-Y518 HydrophobicContact CD2-CE2 4.37Å
7	E	77.2	Confident	80	Confident	52 Å²	52	60.5 Å²	60.5	24%	0.243	32%	0.32	C	S	.	.	H	α-helix	trans	-79.6	-21.1	177.7	-102.4	176.8	-154.2	0	0	113.8	G3 V4 V5 R457	G3-E7 PolarHBondContact N-OE2 2.98Å; G3-E7 VanDerWaalsContact N-OE2 3.11Å; V4-E7 WeakPolarHBondContact O-CB 3.41Å; V4-E7 PolarHBondContact O-N 2.84Å; V5-E7 PolarHBondContact O-N 3.21Å; E7-R457 VanDerWaalsContact CD-CZ 3.41Å; E7-R457 HydrophobicContact CG-CG 4.43Å; E7-R457 IonicContact OE1-CZ 3.02Å; E7-R457 IonicContact OE1-NE 2.73Å; E7-R457 PolarHBondContact OE1-NE 3.28Å; E7-R457 IonicContact OE1-NH2 2.76Å; E7-R457 PolarHBondContact OE1-NH2 3.17Å; E7-R457 IonicContact OE2-CZ 3.65Å; E7-R457 IonicContact OE2-NE 3.86Å; E7-R457 IonicContact OE2-NH2 2.71Å; E7-R457 PolarHBondContact OE2-NH2 3.15Å
8	T	76.7	Confident	80.6	Confident	32 Å²	32	59.2 Å²	59.2	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-106	-10.7	-171.3	62.9	0	0	0	0	114	V4 V5 S521 F524	V4-T8 PolarHBondContact O-N 2.98Å; V5-T8 PolarHBondContact O-N 3.2Å; V5-T8 PolarHBondContact O-OG1 3.07Å; T8-S521 WeakPolarHBondContact OG1-CB 2.95Å; T8-S521 PolarHBondContact OG1-OG 3.45Å; T8-F524 HydrophobicContact CG2-CD2 4.11Å; T8-F524 HydrophobicContact CG2-CE2 3.63Å
9	L	81	Confident	81.3	Confident	57 Å²	57	60.6 Å²	60.6	30%	0.298	34%	0.337	S	S	.	.	S	Bend	trans	-75.1	138.6	178.6	-81.2	167	0	0	0	110.6	V5 K13 L517	V5-L9 HydrophobicContact CG1-CD1 3.42Å; V5-L9 VanDerWaalsContact CG1-CD1 3.42Å; V5-L9 HydrophobicContact CG1-CD2 4.5Å; V5-L9 HydrophobicContact CG1-CG 3.8Å; V5-L9 WeakPolarHBondContact O-CG 3.5Å; V5-L9 PolarHBondContact O-N 3.23Å; L9-K13 HydrophobicContact CD2-CB 3.82Å; L9-K13 HydrophobicContact CD2-CD 4.04Å; L9-L517 HydrophobicContact CD1-CD2 3.98Å
10	N	85.9	Confident	81.9	Confident	94 Å²	94	62.7 Å²	62.7	50%	0.503	35%	0.347	S	S	.	.			trans	-70	144.1	167.6	-172.9	-0.7	0	0	0	108.9	R12 K13 L14	N10-R12 PolarHBondContact O-N 3.27Å; N10-R12 VanDerWaalsContact O-N 3.14Å; N10-K13 HydrophobicContact CB-CG 4.43Å; N10-K13 WeakPolarHBondContact O-CA 3.17Å; N10-K13 WeakPolarHBondContact O-CB 3.38Å; N10-K13 PolarHBondContact O-N 3.39Å; N10-L14 PolarHBondContact O-N 3.22Å
11	V	85.4	Confident	82.4	Confident	104 Å²	104	61.1 Å²	61.1	63%	0.63	34%	0.337	S	S	*	.	H	α-helix	trans	-51.4	-39.5	178.6	178.1	0	0	0	0	111.5	K13 L14 A15	V11-K13 VanDerWaalsContact C-N 3.32Å; V11-K13 PolarHBondContact O-N 3.49Å; V11-L14 PolarHBondContact O-N 3.35Å; V11-A15 WeakPolarHBondContact O-CB 3.39Å; V11-A15 PolarHBondContact O-N 3.39Å
12	R	90.6	Very high	84.3	Confident	206 Å²	206	63.9 Å²	63.9	78%	0.777	35%	0.353	S	S	*	.	H	α-helix	trans	-59.1	-39.6	175.2	-65.6	-174.9	-177	173.7	0.6	113.4	N10 S16	N10-R12 PolarHBondContact O-N 3.27Å; N10-R12 VanDerWaalsContact O-N 3.14Å; R12-S16 WeakPolarHBondContact O-CB 3.4Å; R12-S16 PolarHBondContact O-N 3.17Å
13	K	90.7	Very high	86.3	Confident	141 Å²	141	64.8 Å²	64.8	61%	0.613	36%	0.36	S	S	*	.	H	α-helix	trans	-72.8	-38.3	177.8	-65.3	-170.2	176.6	-169.8	0	111.1	L9 N10 V11 S16 F17	L9-K13 HydrophobicContact CD2-CB 3.82Å; L9-K13 HydrophobicContact CD2-CD 4.04Å; N10-K13 HydrophobicContact CB-CG 4.43Å; N10-K13 WeakPolarHBondContact O-CA 3.17Å; N10-K13 WeakPolarHBondContact O-CB 3.38Å; N10-K13 PolarHBondContact O-N 3.39Å; V11-K13 VanDerWaalsContact C-N 3.32Å; V11-K13 PolarHBondContact O-N 3.49Å; K13-S16 PolarHBondContact O-N 2.86Å; K13-F17 WeakPolarHBondContact O-CB 3.49Å; K13-F17 PolarHBondContact O-N 3.01Å
14	L	88	Confident	87.8	Confident	33 Å²	33	67.2 Å²	67.2	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-44.6	175.6	-176.2	64.2	0	0	0	111.4	L6 N10 V11 F17 G18 Y456 L517	L6-L14 HydrophobicContact CD1-CD1 3.9Å; L6-L14 HydrophobicContact CD1-CD2 4.25Å; N10-L14 PolarHBondContact O-N 3.22Å; V11-L14 PolarHBondContact O-N 3.35Å; L14-F17 PolarHBondContact O-N 3.14Å; L14-G18 PolarHBondContact O-N 3.4Å; L14-Y456 WeakPolarHBondContact CD2-OH 3.33Å; L14-L517 HydrophobicContact CD1-CD2 3.96Å
15	A	89.8	Confident	88.6	Confident	54 Å²	54	67.8 Å²	67.8	45%	0.446	38%	0.377	S	S	.	.	H	α-helix	trans	-62.4	-44.7	175.4	0	0	0	0	0	111.6	V11 F17 G18 C19	V11-A15 WeakPolarHBondContact O-CB 3.39Å; V11-A15 PolarHBondContact O-N 3.39Å; A15-F17 VanDerWaalsContact C-N 3.33Å; A15-F17 PolarHBondContact O-N 3.06Å; A15-G18 PolarHBondContact O-N 3.31Å; A15-C19 PolarHBondContact O-N 2.91Å; A15-C19 PolarHBondContact O-SG 3.44Å; A15-C19 VanDerWaalsContact O-SG 3.36Å
16	S	91.9	Very high	89.3	Confident	82 Å²	82	70.2 Å²	70.2	57%	0.573	39%	0.388	S	S	*	.	H	α-helix	trans	-59.7	-42.2	174.6	174.8	0	0	0	0	112.4	R12 K13 C19 L20	R12-S16 WeakPolarHBondContact O-CB 3.4Å; R12-S16 PolarHBondContact O-N 3.17Å; K13-S16 PolarHBondContact O-N 2.86Å; S16-C19 PolarHBondContact O-N 3.44Å; S16-L20 PolarHBondContact O-N 3.28Å
17	F	91.7	Very high	89.9	Confident	50 Å²	50	73.2 Å²	73.2	22%	0.219	41%	0.408	C	S	.	.	H	α-helix	trans	-63.3	-43.6	173.8	-179.4	-100.3	0	0	0	111.9	K13 L14 A15 L20 M21 A513 C516 L517	K13-F17 WeakPolarHBondContact O-CB 3.49Å; K13-F17 PolarHBondContact O-N 3.01Å; L14-F17 PolarHBondContact O-N 3.14Å; A15-F17 VanDerWaalsContact C-N 3.33Å; A15-F17 PolarHBondContact O-N 3.06Å; F17-L20 WeakPolarHBondContact O-CB 3.29Å; F17-L20 PolarHBondContact O-N 3.28Å; F17-M21 HydrophobicContact CD1-CG 4.17Å; F17-M21 HydrophobicContact CE1-CG 3.75Å; F17-M21 HydrophobicContact CE1-SD 4.39Å; F17-M21 HydrophobicContact CE2-CE 3.97Å; F17-M21 HydrophobicContact CE2-CG 4.26Å; F17-M21 HydrophobicContact CE2-SD 4.23Å; F17-M21 HydrophobicContact CZ-CE 4.22Å; F17-M21 HydrophobicContact CZ-CG 3.79Å; F17-M21 HydrophobicContact CZ-SD 3.86Å; F17-M21 WeakPolarHBondContact O-CG 3.39Å; F17-M21 PolarHBondContact O-N 2.87Å; F17-A513 HydrophobicContact CE1-CB 3.99Å; F17-A513 HydrophobicContact CZ-CB 4.24Å; F17-C516 HydrophobicContact CZ-CB 4.32Å; F17-L517 HydrophobicContact CD1-CD2 4.23Å; F17-L517 HydrophobicContact CE1-CD1 4.17Å; F17-L517 HydrophobicContact CE1-CD2 4.23Å; F17-L517 HydrophobicContact CE1-CG 4.09Å
18	G	90.9	Very high	90.8	Very high	37 Å²	37	71.3 Å²	71.3	38%	0.381	40%	0.399	S	S	.	.	H	α-helix	trans	-60.1	-45.9	175.7	0	0	0	0	0	113	L14 A15 L20 M21 L22	L14-G18 PolarHBondContact O-N 3.4Å; A15-G18 PolarHBondContact O-N 3.31Å; G18-L20 VanDerWaalsContact C-N 3.33Å; G18-L20 PolarHBondContact O-N 3.13Å; G18-M21 PolarHBondContact O-N 2.78Å; G18-L22 WeakPolarHBondContact O-CB 3.43Å; G18-L22 PolarHBondContact O-N 3.25Å
19	C	93.2	Very high	91.6	Very high	86 Å²	86	72.2 Å²	72.2	58%	0.581	40%	0.4	S	S	*	.	H	α-helix	trans	-62.1	-39.4	175.5	-67.7	0	0	0	0	112.2	A15 S16 L22 A23	A15-C19 PolarHBondContact O-N 2.91Å; A15-C19 PolarHBondContact O-SG 3.44Å; A15-C19 VanDerWaalsContact O-SG 3.36Å; S16-C19 PolarHBondContact O-N 3.44Å; C19-L22 PolarHBondContact O-N 3.4Å; C19-A23 WeakPolarHBondContact O-CB 3.18Å; C19-A23 PolarHBondContact O-N 3.01Å
20	L	94.3	Very high	92.1	Very high	102 Å²	102	73.7 Å²	73.7	53%	0.534	41%	0.408	S	S	.	.	H	α-helix	trans	-62.6	-47.5	175.3	178.8	66.4	0	0	0	111.3	S16 F17 G18 L22 A23 V24	S16-L20 PolarHBondContact O-N 3.28Å; F17-L20 WeakPolarHBondContact O-CB 3.29Å; F17-L20 PolarHBondContact O-N 3.28Å; G18-L20 VanDerWaalsContact C-N 3.33Å; G18-L20 PolarHBondContact O-N 3.13Å; L20-L22 VanDerWaalsContact C-N 3.32Å; L20-L22 PolarHBondContact O-N 3.11Å; L20-A23 PolarHBondContact O-N 3.03Å; L20-V24 WeakPolarHBondContact O-CG2 3.36Å; L20-V24 PolarHBondContact O-N 3.49Å
21	M	92.7	Very high	92.5	Very high	29 Å²	29	71.6 Å²	71.6	14%	0.143	40%	0.396	C	S	.	.	H	α-helix	trans	-62.2	-39.3	177.4	-68.3	-59.1	98.6	0	0	111.9	F17 G18 V24 Q25 V509	F17-M21 HydrophobicContact CD1-CG 4.17Å; F17-M21 HydrophobicContact CE1-CG 3.75Å; F17-M21 HydrophobicContact CE1-SD 4.39Å; F17-M21 HydrophobicContact CE2-CE 3.97Å; F17-M21 HydrophobicContact CE2-CG 4.26Å; F17-M21 HydrophobicContact CE2-SD 4.23Å; F17-M21 HydrophobicContact CZ-CE 4.22Å; F17-M21 HydrophobicContact CZ-CG 3.79Å; F17-M21 HydrophobicContact CZ-SD 3.86Å; F17-M21 WeakPolarHBondContact O-CG 3.39Å; F17-M21 PolarHBondContact O-N 2.87Å; G18-M21 PolarHBondContact O-N 2.78Å; M21-V24 PolarHBondContact O-N 3.07Å; M21-Q25 WeakPolarHBondContact O-CB 3.39Å; M21-Q25 PolarHBondContact O-N 2.92Å; M21-V509 HydrophobicContact CB-CG1 3.67Å; M21-V509 HydrophobicContact CG-CG1 4.07Å; M21-V509 HydrophobicContact SD-CG1 3.79Å
22	L	93.9	Very high	92.8	Very high	107 Å²	107	66.7 Å²	66.7	56%	0.56	37%	0.366	S	S	*	.	H	α-helix	trans	-65.2	-42.2	175.2	-176.4	66.2	0	0	0	112	G18 C19 L20 V24 Q25 I26	G18-L22 WeakPolarHBondContact O-CB 3.43Å; G18-L22 PolarHBondContact O-N 3.25Å; C19-L22 PolarHBondContact O-N 3.4Å; L20-L22 VanDerWaalsContact C-N 3.32Å; L20-L22 PolarHBondContact O-N 3.11Å; L22-V24 VanDerWaalsContact C-N 3.35Å; L22-V24 PolarHBondContact O-N 3.21Å; L22-Q25 WeakPolarHBondContact O-CB 3.33Å; L22-Q25 PolarHBondContact O-N 3.47Å; L22-I26 HydrophobicContact CG-CD1 4.16Å; L22-I26 WeakPolarHBondContact O-CG1 3.13Å; L22-I26 PolarHBondContact O-N 3.42Å
23	A	95.4	Very high	92.7	Very high	49 Å²	49	57.1 Å²	57.1	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-61.5	-44.4	176	0	0	0	0	0	111.4	C19 L20 Q25 I26 C27	C19-A23 WeakPolarHBondContact O-CB 3.18Å; C19-A23 PolarHBondContact O-N 3.01Å; L20-A23 PolarHBondContact O-N 3.03Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 2.92Å; A23-I26 PolarHBondContact O-N 3.32Å; A23-C27 PolarHBondContact O-N 3.34Å; A23-C27 PolarHBondContact O-SG 2.91Å
24	V	95.1	Very high	92.6	Very high	54 Å²	54	55.2 Å²	55.2	33%	0.327	33%	0.328	S	S	.	.	H	α-helix	trans	-59.5	-42.8	174	172	0	0	0	0	110.9	L20 M21 L22 I26 C27 F28 V509	L20-V24 WeakPolarHBondContact O-CG2 3.36Å; L20-V24 PolarHBondContact O-N 3.49Å; M21-V24 PolarHBondContact O-N 3.07Å; L22-V24 VanDerWaalsContact C-N 3.35Å; L22-V24 PolarHBondContact O-N 3.21Å; V24-I26 PolarHBondContact O-N 2.92Å; V24-C27 WeakPolarHBondContact O-CB 3.47Å; V24-C27 PolarHBondContact O-N 3.13Å; V24-F28 HydrophobicContact CG1-CD2 3.98Å; V24-F28 HydrophobicContact CG1-CE2 3.61Å; V24-F28 VanDerWaalsContact O-CD2 3.23Å; V24-F28 WeakPolarHBondContact O-CD2 3.29Å; V24-F28 PolarHBondContact O-N 3.11Å; V24-F28 VanDerWaalsContact O-N 3.15Å; V24-V509 HydrophobicContact CB-CG2 4.4Å; V24-V509 HydrophobicContact CG1-CG2 3.76Å
25	Q	94.8	Very high	92.8	Very high	18 Å²	18	59.2 Å²	59.2	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-43.7	176.9	-177.5	56.3	31.8	0	0	112.8	M21 L22 A23 C27 F28 F29 G502 G505	M21-Q25 WeakPolarHBondContact O-CB 3.39Å; M21-Q25 PolarHBondContact O-N 2.92Å; L22-Q25 WeakPolarHBondContact O-CB 3.33Å; L22-Q25 PolarHBondContact O-N 3.47Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 2.92Å; Q25-C27 VanDerWaalsContact C-N 3.3Å; Q25-C27 PolarHBondContact O-N 3.23Å; Q25-F28 PolarHBondContact O-N 3.37Å; Q25-F29 HydrophobicContact CG-CD2 4.2Å; Q25-F29 HydrophobicContact CG-CE2 3.96Å; Q25-F29 WeakPolarHBondContact O-CD2 3.31Å; Q25-F29 PolarHBondContact O-N 2.88Å; Q25-G502 PolarHBondContact NE2-O 2.76Å; Q25-G505 PolarHBondContact OE1-O 2.93Å
26	I	94.6	Very high	92.9	Very high	83 Å²	83	56.8 Å²	56.8	43%	0.426	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-41.5	176.1	-68	164.9	0	0	0	110	L22 A23 V24 F28 F29 L30	L22-I26 HydrophobicContact CG-CD1 4.16Å; L22-I26 WeakPolarHBondContact O-CG1 3.13Å; L22-I26 PolarHBondContact O-N 3.42Å; A23-I26 PolarHBondContact O-N 3.32Å; V24-I26 PolarHBondContact O-N 2.92Å; I26-F28 VanDerWaalsContact C-N 3.33Å; I26-F28 PolarHBondContact O-N 3.33Å; I26-F29 PolarHBondContact O-N 3.4Å; I26-L30 HydrophobicContact CG2-CD1 3.86Å; I26-L30 HydrophobicContact CG2-CG 4.15Å; I26-L30 WeakPolarHBondContact O-CG 3.3Å; I26-L30 PolarHBondContact O-N 3.49Å
27	C	95.3	Very high	92.9	Very high	67 Å²	67	54.8 Å²	54.8	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-58.1	-42.1	175.4	-67.5	0	0	0	0	112.5	A23 V24 Q25 F29 L30 I31	A23-C27 PolarHBondContact O-N 3.34Å; A23-C27 PolarHBondContact O-SG 2.91Å; V24-C27 WeakPolarHBondContact O-CB 3.47Å; V24-C27 PolarHBondContact O-N 3.13Å; Q25-C27 VanDerWaalsContact C-N 3.3Å; Q25-C27 PolarHBondContact O-N 3.23Å; C27-F29 VanDerWaalsContact C-N 3.35Å; C27-F29 PolarHBondContact O-N 3Å; C27-L30 PolarHBondContact O-N 3.37Å; C27-I31 WeakPolarHBondContact O-CB 3.41Å; C27-I31 WeakPolarHBondContact O-CD1 3.45Å; C27-I31 WeakPolarHBondContact O-CG1 3.5Å; C27-I31 PolarHBondContact O-N 2.91Å
28	F	95.2	Very high	92.8	Very high	13 Å²	13	53.6 Å²	53.6	6%	0.057	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-40.2	176.5	-80.4	-73.7	0	0	0	113	V24 Q25 I26 G32 L252 T501 Y504 G505 V509	V24-F28 HydrophobicContact CG1-CD2 3.98Å; V24-F28 HydrophobicContact CG1-CE2 3.61Å; V24-F28 VanDerWaalsContact O-CD2 3.23Å; V24-F28 WeakPolarHBondContact O-CD2 3.29Å; V24-F28 PolarHBondContact O-N 3.11Å; V24-F28 VanDerWaalsContact O-N 3.15Å; Q25-F28 PolarHBondContact O-N 3.37Å; I26-F28 VanDerWaalsContact C-N 3.33Å; I26-F28 PolarHBondContact O-N 3.33Å; F28-G32 PolarHBondContact O-N 3.4Å; F28-L252 HydrophobicContact CD1-CD2 3.88Å; F28-L252 HydrophobicContact CE1-CD2 3.81Å; F28-T501 WeakPolarHBondContact O-CB 3.34Å; F28-T501 PolarHBondContact O-OG1 3.49Å; F28-Y504 HydrophobicContact CD1-CD1 4.48Å; F28-Y504 HydrophobicContact CE1-CD1 4.19Å; F28-Y504 HydrophobicContact CE1-CE1 4.14Å; F28-G505 VanDerWaalsContact CD2-CA 3.45Å; F28-G505 VanDerWaalsContact CG-CA 3.49Å; F28-V509 HydrophobicContact CE2-CG2 4.39Å
29	F	92.8	Very high	92.8	Very high	50 Å²	50	52.5 Å²	52.5	22%	0.219	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-44.6	174.2	-80.1	-67.6	0	0	0	112	Q25 I26 C27 I31 G32 G33 F475 A498	Q25-F29 HydrophobicContact CG-CD2 4.2Å; Q25-F29 HydrophobicContact CG-CE2 3.96Å; Q25-F29 WeakPolarHBondContact O-CD2 3.31Å; Q25-F29 PolarHBondContact O-N 2.88Å; I26-F29 PolarHBondContact O-N 3.4Å; C27-F29 VanDerWaalsContact C-N 3.35Å; C27-F29 PolarHBondContact O-N 3Å; F29-I31 PolarHBondContact O-N 3.49Å; F29-G32 PolarHBondContact O-N 3.13Å; F29-G33 PolarHBondContact O-N 2.87Å; F29-F475 HydrophobicContact CE1-CD2 4.4Å; F29-F475 HydrophobicContact CE1-CE2 4.19Å; F29-F475 HydrophobicContact CE1-CZ 4.28Å; F29-F475 HydrophobicContact CE2-CE2 4.44Å; F29-F475 HydrophobicContact CZ-CD2 4.07Å; F29-F475 AromaticContact CZ-CE2 3.62Å; F29-F475 HydrophobicContact CZ-CE2 3.62Å; F29-F475 AromaticContact CZ-CZ 3.96Å; F29-F475 HydrophobicContact CZ-CZ 3.96Å; F29-A498 VanDerWaalsContact CD1-O 3.28Å; F29-A498 WeakPolarHBondContact CD1-O 3.19Å
30	L	92.8	Very high	92.7	Very high	89 Å²	89	52.6 Å²	52.6	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-64.7	-39.1	179.3	-68.4	175.7	0	0	0	112.2	I26 C27 G32 G33 L34	I26-L30 HydrophobicContact CG2-CD1 3.86Å; I26-L30 HydrophobicContact CG2-CG 4.15Å; I26-L30 WeakPolarHBondContact O-CG 3.3Å; I26-L30 PolarHBondContact O-N 3.49Å; C27-L30 PolarHBondContact O-N 3.37Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-G33 PolarHBondContact O-N 2.87Å; L30-L34 HydrophobicContact CB-CD1 4.43Å; L30-L34 HydrophobicContact CD2-CD1 3.88Å; L30-L34 VanDerWaalsContact O-CB 3.26Å; L30-L34 WeakPolarHBondContact O-CB 3.4Å; L30-L34 PolarHBondContact O-N 3.43Å
31	I	94.3	Very high	92.6	Very high	50 Å²	50	49.9 Å²	49.9	26%	0.256	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-43.1	176	-69.1	163.4	0	0	0	110.5	C27 F29 I35 A36 V248 L252	C27-I31 WeakPolarHBondContact O-CB 3.41Å; C27-I31 WeakPolarHBondContact O-CD1 3.45Å; C27-I31 WeakPolarHBondContact O-CG1 3.5Å; C27-I31 PolarHBondContact O-N 2.91Å; F29-I31 PolarHBondContact O-N 3.49Å; I31-I35 HydrophobicContact CG1-CD1 4.23Å; I31-I35 HydrophobicContact CG2-CD1 4.45Å; I31-I35 VanDerWaalsContact O-CB 3.28Å; I31-I35 WeakPolarHBondContact O-CB 3.35Å; I31-I35 PolarHBondContact O-N 2.94Å; I31-A36 PolarHBondContact O-N 3.22Å; I31-V248 HydrophobicContact CG2-CG1 3.54Å; I31-L252 HydrophobicContact CD1-CD2 4.04Å; I31-L252 HydrophobicContact CG2-CD1 4.37Å; I31-L252 HydrophobicContact CG2-CD2 4.11Å; I31-L252 HydrophobicContact CG2-CG 4.49Å
32	G	90.5	Very high	92.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-52.8	175.6	0	0	0	0	0	112.2	F28 F29 L30 A36 S497 T501	F28-G32 PolarHBondContact O-N 3.4Å; F29-G32 PolarHBondContact O-N 3.13Å; L30-G32 VanDerWaalsContact C-N 3.34Å; G32-A36 WeakPolarHBondContact O-CB 3.44Å; G32-A36 PolarHBondContact O-N 2.95Å; G32-S497 PolarHBondContact O-OG 3.13Å; G32-T501 WeakPolarHBondContact CA-OG1 3.35Å; G32-T501 PolarHBondContact N-OG1 2.69Å
33	G	88.6	Confident	92.4	Very high	5 Å²	5	48.6 Å²	48.6	5%	0.052	28%	0.279	C	S	.	.	H	α-helix	trans	-75.6	-26	-171.3	0	0	0	0	0	115.9	F29 L30 E494	F29-G33 PolarHBondContact O-N 2.87Å; L30-G33 PolarHBondContact O-N 2.87Å; G33-E494 PolarHBondContact O-N 2.72Å
34	L	89.9	Confident	92.3	Very high	101 Å²	101	52.5 Å²	52.5	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-111.1	-19.2	-175.1	-57.3	179	0	0	0	114.4	L30 V493	L30-L34 HydrophobicContact CB-CD1 4.43Å; L30-L34 HydrophobicContact CD2-CD1 3.88Å; L30-L34 VanDerWaalsContact O-CB 3.26Å; L30-L34 WeakPolarHBondContact O-CB 3.4Å; L30-L34 PolarHBondContact O-N 3.43Å; L34-V493 HydrophobicContact CD2-CG2 4.16Å
35	I	91.7	Very high	92.2	Very high	117 Å²	117	50.2 Å²	50.2	60%	0.6	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-43.9	-176.2	-53	176.2	0	0	0	110.9	I31 V248	I31-I35 HydrophobicContact CG1-CD1 4.23Å; I31-I35 HydrophobicContact CG2-CD1 4.45Å; I31-I35 VanDerWaalsContact O-CB 3.28Å; I31-I35 WeakPolarHBondContact O-CB 3.35Å; I31-I35 PolarHBondContact O-N 2.94Å; I35-V248 HydrophobicContact CG2-CG2 4.11Å
36	A	91.4	Very high	92.1	Very high	3 Å²	3	51.9 Å²	51.9	3%	0.025	28%	0.284	C	S	.	.	S	Bend	trans	-82	128.8	-177.4	0	0	0	0	0	111.1	I31 G32 F245 V248 S497	I31-A36 PolarHBondContact O-N 3.22Å; G32-A36 WeakPolarHBondContact O-CB 3.44Å; G32-A36 PolarHBondContact O-N 2.95Å; A36-F245 HydrophobicContact CB-CD2 4Å; A36-V248 HydrophobicContact CB-CB 4.08Å; A36-V248 HydrophobicContact CB-CG1 4.03Å; A36-V248 HydrophobicContact CB-CG2 4.09Å; A36-S497 PolarHBondContact O-OG 2.92Å
37	P	91.7	Very high	92	Very high	41 Å²	41	48 Å²	48	27%	0.266	26%	0.264	S	S	.	.			trans	-68.5	177.6	171.1	33.1	-36.8	0	0	0	110.7	N242 F245 S497	P37-N242 HydrophobicContact CG-CB 4.4Å; P37-F245 HydrophobicContact CG-CB 4.22Å; P37-S497 WeakPolarHBondContact O-CB 3.27Å
38	A	90.1	Very high	91.9	Very high	25 Å²	25	47 Å²	47	21%	0.207	26%	0.257	C	S	.	.			trans	-49	139.1	170.9	0	0	0	0	0	111.1	N40 N242	A38-N40 VanDerWaalsContact C-N 3.29Å; A38-N40 PolarHBondContact O-N 3.25Å; A38-N242 WeakPolarHBondContact O-CB 3.12Å
39	P	90.9	Very high	91.7	Very high	14 Å²	14	46.8 Å²	46.8	9%	0.091	26%	0.256	C	S	.	.	S	Bend	trans	-63.3	-34.1	-172.8	23.9	-34.1	0	0	0	113.4	Q241 N242 F245 T496 I500	P39-Q241 WeakPolarHBondContact O-CA 3.41Å; P39-Q241 VanDerWaalsContact O-CG 3.3Å; P39-Q241 WeakPolarHBondContact O-CG 3.37Å; P39-N242 PolarHBondContact O-N 3.06Å; P39-F245 HydrophobicContact CB-CD1 4.07Å; P39-F245 HydrophobicContact CB-CD2 4.15Å; P39-F245 HydrophobicContact CB-CE1 4.07Å; P39-F245 HydrophobicContact CB-CE2 4.15Å; P39-F245 HydrophobicContact CB-CG 4.13Å; P39-F245 HydrophobicContact CB-CZ 4.12Å; P39-T496 HydrophobicContact CG-CG2 3.64Å; P39-I500 HydrophobicContact CB-CD1 3.81Å; P39-I500 HydrophobicContact CG-CD1 3.86Å
40	N	91.8	Very high	91.7	Very high	88 Å²	88	44.4 Å²	44.4	47%	0.471	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	157.8	-179.9	-61	-23.3	0	0	0	110.2	A38 I239 H240	A38-N40 VanDerWaalsContact C-N 3.29Å; A38-N40 PolarHBondContact O-N 3.25Å; N40-I239 HydrophobicContact CB-CG2 4.21Å; N40-H240 CarbonylContact C-O 3.56Å; N40-H240 VanDerWaalsContact CA-O 3.3Å; N40-H240 WeakPolarHBondContact CA-O 3.41Å
41	T	91.5	Very high	91.6	Very high	45 Å²	45	40.2 Å²	40.2	28%	0.276	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	143.1	172.4	-62	0	0	0	0	108.4	I239 H240	T41-I239 WeakPolarHBondContact O-CA 3.28Å; T41-H240 PolarHBondContact N-O 3.49Å; T41-H240 PolarHBondContact O-N 2.89Å; T41-H240 VanDerWaalsContact O-N 3.07Å
42	T	91.8	Very high	91.3	Very high	84 Å²	84	38 Å²	38	52%	0.515	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.6	-178.1	58.1	0	0	0	0	110	E238 I239	T42-E238 CarbonylContact C-O 3.49Å; T42-E238 VanDerWaalsContact CA-O 3.28Å; T42-E238 WeakPolarHBondContact CA-O 3.37Å; T42-I239 HydrophobicContact CG2-CD1 4.47Å; T42-I239 HydrophobicContact CG2-CG1 4.06Å; T42-I239 HydrophobicContact CG2-CG2 4.16Å
43	D	91.2	Very high	91	Very high	24 Å²	24	44.4 Å²	44.4	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.6	172.3	-156.1	27.9	0	0	0	109.3	R103 E238	D43-R103 IonicContact OD1-CZ 3.17Å; D43-R103 IonicContact OD1-NH2 3.58Å; D43-R103 PolarHBondContact OD1-NH2 3.49Å; D43-R103 IonicContact OD2-NH2 2.71Å; D43-E238 HydrophobicContact CB-CB 4.47Å; D43-E238 PolarHBondContact N-O 3.19Å; D43-E238 PolarHBondContact O-N 2.84Å
44	Q	92.4	Very high	90.7	Very high	131 Å²	131	47 Å²	47	61%	0.612	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.9	178.2	-64.7	-175.4	-6.9	0	0	108.9	V237	Q44-V237 HydrophobicContact CG-CG1 4.49Å; Q44-V237 HydrophobicContact CG-CG2 4.26Å
45	I	92.3	Very high	90.1	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.2	-173.3	-58.4	173.6	0	0	0	108.3	M47 A97 F99 M236 E238	I45-M47 PolarHBondContact O-N 3.38Å; I45-A97 HydrophobicContact CG2-CB 4.23Å; I45-F99 HydrophobicContact CD1-CB 3.68Å; I45-M236 HydrophobicContact CB-CE 4.46Å; I45-M236 HydrophobicContact CD1-CE 3.76Å; I45-M236 PolarHBondContact N-O 3.34Å; I45-M236 PolarHBondContact O-N 3.38Å; I45-E238 HydrophobicContact CD1-CB 4.35Å
46	L	93.4	Very high	89.7	Confident	53 Å²	53	43 Å²	43	28%	0.277	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.6	166	-179.3	59.4	0	0	0	108.8	D233 W235	L46-D233 HydrophobicContact CD1-CB 3.87Å; L46-W235 HydrophobicContact CB-CD2 4.37Å; L46-W235 HydrophobicContact CB-CE3 3.88Å; L46-W235 HydrophobicContact CB-CH2 3.91Å; L46-W235 HydrophobicContact CB-CZ2 4.39Å; L46-W235 HydrophobicContact CB-CZ3 3.64Å; L46-W235 HydrophobicContact CD1-CD2 3.97Å; L46-W235 HydrophobicContact CD1-CE3 4.35Å; L46-W235 HydrophobicContact CD1-CG 4.47Å; L46-W235 HydrophobicContact CD1-CH2 4.3Å; L46-W235 HydrophobicContact CD1-CZ2 3.92Å; L46-W235 HydrophobicContact CD2-CH2 4.32Å; L46-W235 HydrophobicContact CD2-CZ2 4.39Å; L46-W235 HydrophobicContact CG-CH2 4.4Å; L46-W235 HydrophobicContact CG-CZ2 4.46Å
47	M	93.4	Very high	89.1	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-75.6	128.2	-179.2	-58.9	-170.2	70.7	0	0	110.6	I45 F95 I96 A97 L121 L212 L214 V234 M236	I45-M47 PolarHBondContact O-N 3.38Å; M47-F95 HydrophobicContact CB-CB 3.96Å; M47-F95 HydrophobicContact CB-CD1 4.44Å; M47-F95 HydrophobicContact CE-CB 3.82Å; M47-F95 WeakPolarHBondContact CE-O 3.41Å; M47-F95 HydrophobicContact SD-CB 4.14Å; M47-I96 CarbonylContact C-O 3.43Å; M47-I96 WeakPolarHBondContact CA-O 3.48Å; M47-A97 HydrophobicContact CE-CB 3.86Å; M47-A97 HydrophobicContact CG-CB 4.09Å; M47-L121 HydrophobicContact SD-CD1 4.19Å; M47-L212 HydrophobicContact CE-CD2 3.83Å; M47-L212 HydrophobicContact CE-CG 4.37Å; M47-L214 HydrophobicContact CE-CB 3.8Å; M47-L214 HydrophobicContact CE-CD1 4.49Å; M47-L214 HydrophobicContact SD-CD1 4.33Å; M47-V234 HydrophobicContact CB-CB 4.37Å; M47-V234 VanDerWaalsContact CB-O 3.32Å; M47-V234 WeakPolarHBondContact CB-O 3.49Å; M47-V234 HydrophobicContact CG-CB 4.41Å; M47-V234 HydrophobicContact CG-CG1 4.19Å; M47-V234 VanDerWaalsContact CG-O 3.24Å; M47-V234 WeakPolarHBondContact CG-O 3.24Å; M47-V234 PolarHBondContact N-O 3.4Å; M47-V234 HydrophobicContact SD-CB 4.16Å; M47-V234 HydrophobicContact SD-CG1 3.44Å; M47-V234 WeakPolarHBondContact SD-CG1 3.45Å; M47-M236 HydrophobicContact CG-CB 4.38Å; M47-M236 HydrophobicContact SD-CB 4.45Å
48	S	92.1	Very high	88.8	Confident	45 Å²	45	48.6 Å²	48.6	32%	0.315	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.4	177.4	-54.1	0	0	0	0	110.6	I96	S48-I96 PolarHBondContact N-O 3.23Å; S48-I96 PolarHBondContact O-N 2.83Å
49	K	92.2	Very high	88.6	Confident	9 Å²	9	49.9 Å²	49.9	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.9	-178.9	-51.1	170.8	-146.1	-171.3	0	109.1	I74 L75 G78 I80 F95 Q232 D233	K49-I74 WeakPolarHBondContact O-CA 3.28Å; K49-L75 HydrophobicContact CB-CB 4.1Å; K49-L75 HydrophobicContact CB-CD1 3.93Å; K49-L75 PolarHBondContact O-N 3.15Å; K49-G78 PolarHBondContact NZ-O 3.23Å; K49-I80 HydrophobicContact CD-CD1 4.07Å; K49-I80 HydrophobicContact CD-CG1 4.22Å; K49-F95 HydrophobicContact CD-CE1 4.33Å; K49-F95 HydrophobicContact CG-CD1 3.99Å; K49-F95 HydrophobicContact CG-CE1 3.76Å; K49-Q232 WeakPolarHBondContact CE-O 3.47Å; K49-Q232 PolarHBondContact NZ-O 2.99Å; K49-D233 WeakPolarHBondContact CE-OD1 3.31Å; K49-D233 IonicContact NZ-OD1 3.85Å; K49-D233 PolarHBondContact NZ-OD1 2.75Å
50	C	91.6	Very high	88.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.2	-178.6	-179.9	0	0	0	0	111.9	C71 I93 V94 I96	C50-C71 WeakPolarHBondContact CA-SG 3.31Å; C50-C71 HydrophobicContact CB-CB 3.92Å; C50-C71 WeakPolarHBondContact CB-SG 3.49Å; C50-C71 VanDerWaalsContact SG-CA 3.53Å; C50-C71 WeakPolarHBondContact SG-CB 3.44Å; C50-C71 CovalentContact SG-SG 2.01Å; C50-C71 PolarHBondContact SG-SG 3.26Å; C50-I93 WeakPolarHBondContact O-CA 3.4Å; C50-V94 HydrophobicContact CB-CB 4.4Å; C50-V94 WeakPolarHBondContact CB-O 3.47Å; C50-V94 PolarHBondContact N-O 3.04Å; C50-V94 PolarHBondContact O-N 3.26Å; C50-I96 HydrophobicContact CB-CD1 3.37Å; C50-I96 HydrophobicContact CB-CG1 4.04Å
51	I	90.6	Very high	88.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.1	173.3	-59.5	169.6	0	0	0	110.5	R53 E73 L75 P85 V88	I51-R53 HydrophobicContact CG2-CG 3.85Å; I51-E73 HydrophobicContact CB-CB 4.49Å; I51-E73 HydrophobicContact CD1-CG 4.2Å; I51-E73 PolarHBondContact N-O 3.16Å; I51-E73 VanDerWaalsContact N-O 3.1Å; I51-L75 HydrophobicContact CD1-CD1 4.23Å; I51-L75 HydrophobicContact CD1-CD2 3.72Å; I51-L75 HydrophobicContact CD1-CG 4.04Å; I51-L75 HydrophobicContact CG1-CD1 4.1Å; I51-L75 HydrophobicContact CG1-CD2 4.43Å; I51-L75 HydrophobicContact CG1-CG 4.21Å; I51-P85 HydrophobicContact CD1-CG 4.38Å; I51-V88 HydrophobicContact CD1-CG2 4.1Å; I51-V88 HydrophobicContact CG1-CG1 4.38Å; I51-V88 HydrophobicContact CG2-CG1 4.01Å; I51-V88 HydrophobicContact CG2-CG2 4.01Å
52	D	88.4	Confident	88.5	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.016	25%	0.245	C	C	.	.			trans	-95.4	93.8	171.9	-176.4	12.5	0	0	0	111.5	S54 G55 H61 S92 V94 R215	D52-S54 VanDerWaalsContact C-N 3.33Å; D52-S54 WeakPolarHBondContact OD1-CB 3.29Å; D52-S54 PolarHBondContact OD1-N 3.3Å; D52-S54 PolarHBondContact OD1-OG 3.01Å; D52-G55 PolarHBondContact OD1-N 3.46Å; D52-H61 WeakPolarHBondContact CB-NE2 3.36Å; D52-H61 VanDerWaalsContact CG-CE1 3.44Å; D52-H61 IonicContact OD1-CE1 3.68Å; D52-H61 PolarHBondContact OD1-CE1 3.14Å; D52-H61 IonicContact OD1-NE2 3.36Å; D52-H61 IonicContact OD2-CE1 3.83Å; D52-H61 IonicContact OD2-NE2 3.55Å; D52-H61 PolarHBondContact OD2-NE2 2.78Å; D52-S92 WeakPolarHBondContact CB-O 3.3Å; D52-S92 PolarHBondContact N-O 2.97Å; D52-S92 WeakPolarHBondContact O-CB 3.34Å; D52-S92 PolarHBondContact O-OG 3.12Å; D52-V94 HydrophobicContact CB-CG2 3.93Å; D52-R215 IonicContact OD2-CZ 2.79Å; D52-R215 VanDerWaalsContact OD2-CZ 3.25Å; D52-R215 IonicContact OD2-NH1 3.43Å; D52-R215 PolarHBondContact OD2-NH1 2.61Å; D52-R215 IonicContact OD2-NH2 3.97Å; D52-R215 PolarHBondContact OD2-NH2 3.47Å
53	R	84.9	Confident	88.2	Confident	135 Å²	135	41.4 Å²	41.4	51%	0.509	23%	0.226	S	C	.	.			trans	-81.5	-11.6	173.4	-55.6	-174.7	-175.6	-135.3	2.7	113.4	I51 G55 E73 D87	I51-R53 HydrophobicContact CG2-CG 3.85Å; R53-G55 VanDerWaalsContact C-N 3.32Å; R53-E73 IonicContact CZ-OE2 3.2Å; R53-E73 IonicContact NE-OE2 2.66Å; R53-E73 IonicContact NH2-OE2 2.69Å; R53-E73 PolarHBondContact NH2-OE2 2.89Å; R53-D87 IonicContact NH1-OD2 2.83Å
54	S	81.4	Confident	87.9	Confident	59 Å²	59	44.3 Å²	44.3	41%	0.413	24%	0.235	S	C	.	.	S	Bend	trans	-75.9	-24.3	-175.7	71.9	0	0	0	0	112.7	D52 D56	D52-S54 VanDerWaalsContact C-N 3.33Å; D52-S54 WeakPolarHBondContact OD1-CB 3.29Å; D52-S54 PolarHBondContact OD1-N 3.3Å; D52-S54 PolarHBondContact OD1-OG 3.01Å; S54-D56 PolarHBondContact O-N 3.41Å; S54-D56 VanDerWaalsContact O-N 3.16Å; S54-D56 PolarHBondContact OG-N 2.95Å
55	G	77.3	Confident	87.3	Confident	56 Å²	56	40.2 Å²	40.2	58%	0.577	22%	0.22	S	C	*	.			trans	68.2	1.2	-172.7	0	0	0	0	0	113.7	D52 R53 V57	D52-G55 PolarHBondContact OD1-N 3.46Å; R53-G55 VanDerWaalsContact C-N 3.32Å; G55-V57 PolarHBondContact O-N 3.32Å
56	D	83.1	Confident	86.6	Confident	78 Å²	78	47.1 Å²	47.1	42%	0.417	26%	0.255	S	S	.	.			trans	-83.4	102.9	178.8	-174.2	6.2	0	0	0	110.4	S54 L58 K59 R215	S54-D56 PolarHBondContact O-N 3.41Å; S54-D56 VanDerWaalsContact O-N 3.16Å; S54-D56 PolarHBondContact OG-N 2.95Å; D56-L58 PolarHBondContact O-N 3.32Å; D56-L58 WeakPolarHBondContact OD1-CB 3.45Å; D56-L58 PolarHBondContact OD1-N 3.18Å; D56-K59 HydrophobicContact CB-CB 4.21Å; D56-K59 PolarHBondContact O-N 2.89Å; D56-R215 PolarHBondContact O-NH2 3.03Å
57	V	80.1	Confident	85.8	Confident	55 Å²	55	46 Å²	46	33%	0.333	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.8	178.3	-161.9	0	0	0	0	111.8	G55 R143	G55-V57 PolarHBondContact O-N 3.32Å; V57-R143 PolarHBondContact O-NH1 3.09Å
58	L	83.5	Confident	85	Confident	108 Å²	108	53.8 Å²	53.8	57%	0.565	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.5	179.9	-63.8	173.2	0	0	0	113.5	D56 W60 R143 R161	D56-L58 PolarHBondContact O-N 3.32Å; D56-L58 WeakPolarHBondContact OD1-CB 3.45Å; D56-L58 PolarHBondContact OD1-N 3.18Å; L58-W60 PolarHBondContact O-N 2.88Å; L58-R143 VanDerWaalsContact CA-NH1 3.28Å; L58-R143 PolarHBondContact O-NH1 2.76Å; L58-R143 PolarHBondContact O-NH2 2.94Å; L58-R143 VanDerWaalsContact O-NH2 3.15Å; L58-R161 VanDerWaalsContact CD2-NH1 3.31Å
59	K	87.7	Confident	84.3	Confident	52 Å²	52	56.9 Å²	56.9	23%	0.226	30%	0.303	C	S	.	.	S	Bend	trans	-67	131.6	176.9	-171.6	177.8	176.3	-170.9	0	111.4	D56 R143	D56-K59 HydrophobicContact CB-CB 4.21Å; D56-K59 PolarHBondContact O-N 2.89Å; K59-R143 PolarHBondContact O-NH1 2.73Å
60	W	90.1	Very high	83.7	Confident	34 Å²	34	56.6 Å²	56.6	13%	0.129	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-79.5	118.7	169.3	-72.3	108.2	0	0	0	109.5	L58 R143 L144 W156 E158 L211 N213	L58-W60 PolarHBondContact O-N 2.88Å; W60-R143 HydrophobicContact CH2-CB 3.62Å; W60-R143 HydrophobicContact CZ3-CB 3.73Å; W60-L144 VanDerWaalsContact CH2-C 3.49Å; W60-W156 HydrophobicContact CB-CB 4.27Å; W60-W156 HydrophobicContact CD2-CB 4.02Å; W60-W156 HydrophobicContact CG-CB 3.78Å; W60-W156 HydrophobicContact CG-CG 4.47Å; W60-W156 PolarHBondContact NE1-O 3.38Å; W60-E158 HydrophobicContact CH2-CG 4.45Å; W60-E158 HydrophobicContact CZ2-CB 3.82Å; W60-E158 HydrophobicContact CZ2-CG 3.92Å; W60-L211 HydrophobicContact CB-CD2 4.28Å; W60-L211 HydrophobicContact CD2-CD2 4.27Å; W60-L211 HydrophobicContact CE3-CD2 3.61Å; W60-L211 HydrophobicContact CE3-CG 4.23Å; W60-L211 HydrophobicContact CZ3-CD2 4.34Å; W60-N213 HydrophobicContact CZ3-CB 4.46Å
61	H	91	Very high	83.3	Confident	2 Å²	2	57 Å²	57	1%	0.009	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-93.9	135.6	168	-56.5	-73.4	0	0	0	109.2	D52 I96 L211 N213 R215	D52-H61 WeakPolarHBondContact CB-NE2 3.36Å; D52-H61 VanDerWaalsContact CG-CE1 3.44Å; D52-H61 IonicContact OD1-CE1 3.68Å; D52-H61 PolarHBondContact OD1-CE1 3.14Å; D52-H61 IonicContact OD1-NE2 3.36Å; D52-H61 IonicContact OD2-CE1 3.83Å; D52-H61 IonicContact OD2-NE2 3.55Å; D52-H61 PolarHBondContact OD2-NE2 2.78Å; H61-I96 HydrophobicContact CB-CD1 3.57Å; H61-I96 HydrophobicContact CB-CG1 4.23Å; H61-L211 WeakPolarHBondContact O-CD2 3.45Å; H61-N213 PolarHBondContact N-ND2 3.39Å; H61-N213 PolarHBondContact O-ND2 3.38Å; H61-N213 PolarHBondContact O-OD1 3.18Å; H61-R215 PolarHBondContact NE2-NH2 2.91Å
62	F	90.5	Very high	82.6	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.009	33%	0.33	C	S	.	.			trans	-145.7	148.9	-175.9	61.4	-97.5	0	0	0	109.2	R64 P65 E69 S70 C71 Q98 H154 W156 L211	F62-R64 WeakPolarHBondContact CD2-O 3.47Å; F62-P65 WeakPolarHBondContact CE2-O 3.21Å; F62-E69 HydrophobicContact CE1-CB 4.44Å; F62-E69 HydrophobicContact CZ-CB 4.19Å; F62-S70 WeakPolarHBondContact O-CB 3.36Å; F62-C71 PolarHBondContact O-N 3.44Å; F62-Q98 VanDerWaalsContact CB-NE2 3.29Å; F62-H154 HydrophobicContact CZ-CB 4.11Å; F62-H154 AromaticContact CZ-ND1 3.7Å; F62-W156 AromaticContact CD1-CD1 3.9Å; F62-W156 AromaticContact CD1-NE1 3.7Å; F62-W156 AromaticContact CG-NE1 3.72Å; F62-L211 HydrophobicContact CB-CD1 4.04Å; F62-L211 HydrophobicContact CB-CD2 3.93Å
63	A	85.5	Confident	82.4	Confident	15 Å²	15	65.4 Å²	65.4	12%	0.124	34%	0.344	C	S	.	.	S	Bend	trans	-87	-32.3	-176.4	0	0	0	0	0	112.3	I74	A63-I74 HydrophobicContact CB-CD1 4.22Å
64	R	83.8	Confident	82.4	Confident	84 Å²	84	62.7 Å²	62.7	32%	0.317	34%	0.339	S	S	.	.	S	Bend	trans	-136.3	144.2	-178.5	-59.9	172.3	-65.9	-140.2	1.8	111.5	F62 Q98 P102	F62-R64 WeakPolarHBondContact CD2-O 3.47Å; R64-Q98 PolarHBondContact O-NE2 2.82Å; R64-P102 VanDerWaalsContact CZ-CG 3.42Å
65	P	80.7	Confident	82.6	Confident	45 Å²	45	60.3 Å²	60.3	29%	0.292	32%	0.322	S	S	.	.	S	Bend	cis	-70.9	146.7	-9.1	30.6	-34.5	0	0	0	111.8	F62 S67 K153	F62-P65 WeakPolarHBondContact CE2-O 3.21Å; P65-S67 PolarHBondContact O-N 3.28Å; P65-S67 PolarHBondContact O-OG 3.49Å; P65-K153 HydrophobicContact CG-CB 4.18Å; P65-K153 HydrophobicContact CG-CD 4.46Å
66	I	78	Confident	82.8	Confident	151 Å²	151	61.8 Å²	61.8	77%	0.774	32%	0.321	S	S	*	.			trans	-64.1	120.8	176.8	-57.5	172.2	0	0	0	108.4
67	S	76.7	Confident	82.6	Confident	30 Å²	30	64.5 Å²	64.5	21%	0.21	34%	0.336	C	S	.	.	S	Bend	trans	-153.9	167.8	-177.6	58	0	0	0	0	110.2	P65 E69 S70 H154	P65-S67 PolarHBondContact O-N 3.28Å; P65-S67 PolarHBondContact O-OG 3.49Å; S67-E69 PolarHBondContact O-N 3.34Å; S67-E69 VanDerWaalsContact O-N 3.07Å; S67-S70 PolarHBondContact N-OG 3.02Å; S67-S70 WeakPolarHBondContact O-CB 3.5Å; S67-S70 PolarHBondContact O-N 2.8Å; S67-S70 PolarHBondContact O-OG 3.5Å; S67-S70 PolarHBondContact OG-N 3.47Å; S67-H154 VanDerWaalsContact CB-CE1 3.42Å; S67-H154 WeakPolarHBondContact CB-CE1 3.34Å; S67-H154 PolarHBondContact OG-CE1 2.85Å; S67-H154 VanDerWaalsContact OG-CE1 3.31Å; S67-H154 PolarHBondContact OG-ND1 2.88Å
68	N	75.7	Confident	82.5	Confident	165 Å²	165	63.3 Å²	63.3	88%	0.882	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.7	175.7	-67.9	-7.4	0	0	0	112.8
69	E	77	Confident	82.2	Confident	110 Å²	110	60.1 Å²	60.1	51%	0.514	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-17.7	176.5	-62.1	-172.9	178.8	0	0	113	F62 S67 H154	F62-E69 HydrophobicContact CE1-CB 4.44Å; F62-E69 HydrophobicContact CZ-CB 4.19Å; S67-E69 PolarHBondContact O-N 3.34Å; S67-E69 VanDerWaalsContact O-N 3.07Å; E69-H154 HydrophobicContact CB-CB 4.41Å; E69-H154 WeakPolarHBondContact OE2-CB 3.25Å; E69-H154 IonicContact OE2-CD2 3.9Å; E69-H154 IonicContact OE2-CG 3.45Å
70	S	79.4	Confident	81.9	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.021	31%	0.313	C	S	.	.	S	Bend	trans	-69.8	-177.5	175.3	73.9	0	0	0	0	111.2	F62 S67 Q72	F62-S70 WeakPolarHBondContact O-CB 3.36Å; S67-S70 PolarHBondContact N-OG 3.02Å; S67-S70 WeakPolarHBondContact O-CB 3.5Å; S67-S70 PolarHBondContact O-N 2.8Å; S67-S70 PolarHBondContact O-OG 3.5Å; S67-S70 PolarHBondContact OG-N 3.47Å; S70-Q72 PolarHBondContact O-N 3.34Å
71	C	83.9	Confident	81.2	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.061	33%	0.332	C	S	.	.			trans	-50.8	129.1	170.7	-177.1	0	0	0	0	110.7	C50 F62 E73 I74 I96	C50-C71 WeakPolarHBondContact CA-SG 3.31Å; C50-C71 HydrophobicContact CB-CB 3.92Å; C50-C71 WeakPolarHBondContact CB-SG 3.49Å; C50-C71 VanDerWaalsContact SG-CA 3.53Å; C50-C71 WeakPolarHBondContact SG-CB 3.44Å; C50-C71 CovalentContact SG-SG 2.01Å; C50-C71 PolarHBondContact SG-SG 3.26Å; F62-C71 PolarHBondContact O-N 3.44Å; C71-E73 VanDerWaalsContact SG-C 3.54Å; C71-E73 PolarHBondContact SG-O 3.46Å; C71-I74 HydrophobicContact CB-CD1 4.41Å; C71-I74 HydrophobicContact CB-CG1 3.85Å; C71-I96 HydrophobicContact CB-CD1 4.19Å
72	Q	76.2	Confident	80.6	Confident	113 Å²	113	70.2 Å²	70.2	53%	0.528	37%	0.368	S	S	.	.	S	Bend	trans	-67	-39.6	-177.9	-71.3	-179.5	-15.5	0	0	111.7	S70	S70-Q72 PolarHBondContact O-N 3.34Å
73	E	83.9	Confident	80.2	Confident	68 Å²	68	71.8 Å²	71.8	32%	0.318	38%	0.377	S	S	.	.			trans	-147	109.8	-174.4	-173.7	173.6	-173.2	0	0	108.4	I51 R53 C71	I51-E73 HydrophobicContact CB-CB 4.49Å; I51-E73 HydrophobicContact CD1-CG 4.2Å; I51-E73 PolarHBondContact N-O 3.16Å; I51-E73 VanDerWaalsContact N-O 3.1Å; R53-E73 IonicContact CZ-OE2 3.2Å; R53-E73 IonicContact NE-OE2 2.66Å; R53-E73 IonicContact NH2-OE2 2.69Å; R53-E73 PolarHBondContact NH2-OE2 2.89Å; C71-E73 VanDerWaalsContact SG-C 3.54Å; C71-E73 PolarHBondContact SG-O 3.46Å
74	I	84.2	Confident	80.2	Confident	77 Å²	77	72.5 Å²	72.5	40%	0.395	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-92.2	122.7	172.2	-59.8	174	0	0	0	106.6	K49 A63 C71	K49-I74 WeakPolarHBondContact O-CA 3.28Å; A63-I74 HydrophobicContact CB-CD1 4.22Å; C71-I74 HydrophobicContact CB-CD1 4.41Å; C71-I74 HydrophobicContact CB-CG1 3.85Å
75	L	86.3	Confident	80.2	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.052	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-71.7	139.7	-179.4	-68.2	162.7	0	0	0	110.4	K49 I51 V83 V84	K49-L75 HydrophobicContact CB-CB 4.1Å; K49-L75 HydrophobicContact CB-CD1 3.93Å; K49-L75 PolarHBondContact O-N 3.15Å; I51-L75 HydrophobicContact CD1-CD1 4.23Å; I51-L75 HydrophobicContact CD1-CD2 3.72Å; I51-L75 HydrophobicContact CD1-CG 4.04Å; I51-L75 HydrophobicContact CG1-CD1 4.1Å; I51-L75 HydrophobicContact CG1-CD2 4.43Å; I51-L75 HydrophobicContact CG1-CG 4.21Å; L75-V83 HydrophobicContact CB-CG1 3.73Å; L75-V83 HydrophobicContact CD2-CG1 3.66Å; L75-V83 WeakPolarHBondContact CD2-O 3.35Å; L75-V83 HydrophobicContact CG-CG1 4.23Å; L75-V84 HydrophobicContact CD1-CG2 3.76Å
76	P	82.7	Confident	80.2	Confident	86 Å²	86	74.5 Å²	74.5	56%	0.558	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-64.2	160.4	173.6	27	-35.1	0	0	0	112	G78 V83	P76-G78 PolarHBondContact O-N 3.47Å; P76-V83 VanDerWaalsContact CD-CG1 3.41Å; P76-V83 HydrophobicContact CG-CG1 3.54Å; P76-V83 HydrophobicContact CG-CG2 4.32Å
77	D	78.7	Confident	80.4	Confident	136 Å²	136	72.4 Å²	72.4	73%	0.727	40%	0.398	S	S	*	.	S	Bend	trans	-64.9	129.8	172.1	-59.4	-29.1	0	0	0	109.5
78	G	77.5	Confident	80.8	Confident	30 Å²	30	72 Å²	72	31%	0.309	39%	0.394	S	S	.	.	S	Bend	trans	157.2	173.8	-175.9	0	0	0	0	0	112	K49 P76 I80	K49-G78 PolarHBondContact NZ-O 3.23Å; P76-G78 PolarHBondContact O-N 3.47Å; G78-I80 PolarHBondContact O-N 2.91Å
79	D	77.4	Confident	81.3	Confident	40 Å²	40	69.8 Å²	69.8	21%	0.214	38%	0.382	C	S	.	.			trans	-60.8	127.6	177.9	-84.7	11.6	0	0	0	109.8	E81 E82 V83 K126	D79-E81 PolarHBondContact O-N 3.08Å; D79-E81 VanDerWaalsContact O-N 3.12Å; D79-E82 HydrophobicContact CB-CG 4.18Å; D79-E82 PolarHBondContact O-N 3.24Å; D79-V83 WeakPolarHBondContact O-CG2 3.44Å; D79-V83 PolarHBondContact O-N 2.97Å; D79-K126 IonicContact OD2-NZ 2.65Å; D79-K126 PolarHBondContact OD2-NZ 3Å
80	I	80.6	Confident	81.6	Confident	25 Å²	25	67.1 Å²	67.1	13%	0.128	38%	0.379	C	S	.	.	H	α-helix	trans	-54.4	-35.5	-179.6	-73.4	-155.6	0	0	0	111.4	K49 G78 E82 V83 V84 I231 Q232	K49-I80 HydrophobicContact CD-CD1 4.07Å; K49-I80 HydrophobicContact CD-CG1 4.22Å; G78-I80 PolarHBondContact O-N 2.91Å; I80-E82 VanDerWaalsContact C-N 3.25Å; I80-E82 PolarHBondContact O-N 3.02Å; I80-V83 PolarHBondContact O-N 3.48Å; I80-V84 HydrophobicContact CB-CG2 4.45Å; I80-V84 HydrophobicContact CG2-CB 4.42Å; I80-V84 HydrophobicContact CG2-CG2 3.67Å; I80-V84 VanDerWaalsContact O-CB 3.26Å; I80-V84 WeakPolarHBondContact O-CB 3.33Å; I80-V84 WeakPolarHBondContact O-CG2 3.18Å; I80-V84 PolarHBondContact O-N 3.46Å; I80-I231 WeakPolarHBondContact CD1-O 3.43Å; I80-Q232 VanDerWaalsContact CD1-O 3.27Å; I80-Q232 WeakPolarHBondContact CD1-O 3.42Å; I80-Q232 WeakPolarHBondContact CG1-O 3.28Å
81	E	75.9	Confident	82	Confident	113 Å²	113	70.4 Å²	70.4	53%	0.528	40%	0.396	S	S	.	.	H	α-helix	trans	-67.6	-23.7	179.3	-63.7	-174.2	157.2	0	0	112.9	D79 K128	D79-E81 PolarHBondContact O-N 3.08Å; D79-E81 VanDerWaalsContact O-N 3.12Å; E81-K128 IonicContact OE1-NZ 2.74Å; E81-K128 PolarHBondContact OE1-NZ 3.42Å
82	E	78.6	Confident	82.2	Confident	163 Å²	163	71.6 Å²	71.6	76%	0.762	41%	0.405	S	S	*	.	H	α-helix	trans	-93.5	-34	177.2	-61.7	-174	170.6	0	0	112.4	D79 I80	D79-E82 HydrophobicContact CB-CG 4.18Å; D79-E82 PolarHBondContact O-N 3.24Å; I80-E82 VanDerWaalsContact C-N 3.25Å; I80-E82 PolarHBondContact O-N 3.02Å
83	V	82	Confident	82.9	Confident	34 Å²	34	67 Å²	67	21%	0.206	38%	0.383	C	S	.	.	H	α-helix	trans	-91.6	-32.1	-169.4	176.9	0	0	0	0	112.5	L75 P76 D79 I80 P85	L75-V83 HydrophobicContact CB-CG1 3.73Å; L75-V83 HydrophobicContact CD2-CG1 3.66Å; L75-V83 WeakPolarHBondContact CD2-O 3.35Å; L75-V83 HydrophobicContact CG-CG1 4.23Å; P76-V83 VanDerWaalsContact CD-CG1 3.41Å; P76-V83 HydrophobicContact CG-CG1 3.54Å; P76-V83 HydrophobicContact CG-CG2 4.32Å; D79-V83 WeakPolarHBondContact O-CG2 3.44Å; D79-V83 PolarHBondContact O-N 2.97Å; I80-V83 PolarHBondContact O-N 3.48Å; V83-P85 WeakPolarHBondContact O-CD 3.35Å
84	V	84.3	Confident	83.4	Confident	30 Å²	30	63.8 Å²	63.8	18%	0.182	37%	0.368	C	S	.	.	S	Bend	trans	-78.2	125.2	-178.1	176.2	0	0	0	0	110.9	L75 I80 V88 I93	L75-V84 HydrophobicContact CD1-CG2 3.76Å; I80-V84 HydrophobicContact CB-CG2 4.45Å; I80-V84 HydrophobicContact CG2-CB 4.42Å; I80-V84 HydrophobicContact CG2-CG2 3.67Å; I80-V84 VanDerWaalsContact O-CB 3.26Å; I80-V84 WeakPolarHBondContact O-CB 3.33Å; I80-V84 WeakPolarHBondContact O-CG2 3.18Å; I80-V84 PolarHBondContact O-N 3.46Å; V84-V88 HydrophobicContact CG1-CB 3.92Å; V84-V88 HydrophobicContact CG1-CG1 4.24Å; V84-I93 HydrophobicContact CG1-CD1 4.41Å; V84-I93 HydrophobicContact CG2-CD1 4.06Å
85	P	84.4	Confident	83.8	Confident	37 Å²	37	60.6 Å²	60.6	24%	0.24	35%	0.351	C	S	.	.			trans	-59.3	142.3	173.6	-24.5	35.3	0	0	0	112.2	I51 V83 D87 V88	I51-P85 HydrophobicContact CD1-CG 4.38Å; V83-P85 WeakPolarHBondContact O-CD 3.35Å; P85-D87 WeakPolarHBondContact CB-OD1 3.5Å; P85-D87 PolarHBondContact O-N 2.81Å; P85-V88 HydrophobicContact CB-CG2 4.11Å; P85-V88 HydrophobicContact CG-CG2 4.33Å; P85-V88 PolarHBondContact O-N 3.46Å; P85-V88 VanDerWaalsContact O-N 3.08Å
86	S	80.3	Confident	84.2	Confident	134 Å²	134	60.2 Å²	60.2	94%	0.937	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.4	-176.6	53.9	0	0	0	0	115.1
87	D	83.6	Confident	84.8	Confident	108 Å²	108	56.1 Å²	56.1	58%	0.578	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.5	178.4	61.9	-52.1	0	0	0	114.2	R53 P85	R53-D87 IonicContact NH1-OD2 2.83Å; P85-D87 WeakPolarHBondContact CB-OD1 3.5Å; P85-D87 PolarHBondContact O-N 2.81Å
88	V	84.2	Confident	85.4	Confident	22 Å²	22	50.6 Å²	50.6	13%	0.133	29%	0.293	C	S	.	.			trans	-101.2	118.4	-175.4	179.5	0	0	0	0	111.1	I51 V84 P85 I93	I51-V88 HydrophobicContact CD1-CG2 4.1Å; I51-V88 HydrophobicContact CG1-CG1 4.38Å; I51-V88 HydrophobicContact CG2-CG1 4.01Å; I51-V88 HydrophobicContact CG2-CG2 4.01Å; V84-V88 HydrophobicContact CG1-CB 3.92Å; V84-V88 HydrophobicContact CG1-CG1 4.24Å; P85-V88 HydrophobicContact CB-CG2 4.11Å; P85-V88 HydrophobicContact CG-CG2 4.33Å; P85-V88 PolarHBondContact O-N 3.46Å; P85-V88 VanDerWaalsContact O-N 3.08Å; V88-I93 HydrophobicContact CG1-CG1 4.19Å
89	D	85.4	Confident	86.1	Confident	118 Å²	118	49.2 Å²	49.2	63%	0.631	28%	0.278	S	S	*	.			trans	-72.9	151	171.6	-73.1	-22.7	0	0	0	111.3	N91 S92	D89-N91 PolarHBondContact O-N 3.18Å; D89-N91 VanDerWaalsContact O-N 3.09Å; D89-S92 WeakPolarHBondContact O-CB 3.48Å; D89-S92 PolarHBondContact O-N 2.83Å
90	A	85.2	Confident	86.9	Confident	54 Å²	54	48 Å²	48	45%	0.446	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-55.5	-30.7	176.1	0	0	0	0	0	113.3	S92 I93 V218	A90-S92 PolarHBondContact O-N 3.24Å; A90-I93 PolarHBondContact O-N 3.08Å; A90-V218 HydrophobicContact CB-CG2 3.77Å
91	N	86.8	Confident	87.1	Confident	72 Å²	72	50.8 Å²	50.8	39%	0.385	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-67.6	-20.7	177.6	-72.3	-29	0	0	0	114	D89 P217 V218	D89-N91 PolarHBondContact O-N 3.18Å; D89-N91 VanDerWaalsContact O-N 3.09Å; N91-P217 WeakPolarHBondContact OD1-CA 3.41Å; N91-V218 PolarHBondContact ND2-O 3.42Å; N91-V218 VanDerWaalsContact ND2-O 3.13Å; N91-V218 PolarHBondContact OD1-N 3.28Å; N91-V218 PolarHBondContact OD1-O 2.87Å
92	S	89.1	Confident	87.6	Confident	34 Å²	34	46.7 Å²	46.7	24%	0.238	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-85.4	-10.1	177.9	-68.9	0	0	0	0	112.6	D52 D89 A90	D52-S92 WeakPolarHBondContact CB-O 3.3Å; D52-S92 PolarHBondContact N-O 2.97Å; D52-S92 WeakPolarHBondContact O-CB 3.34Å; D52-S92 PolarHBondContact O-OG 3.12Å; D89-S92 WeakPolarHBondContact O-CB 3.48Å; D89-S92 PolarHBondContact O-N 2.83Å; A90-S92 PolarHBondContact O-N 3.24Å
93	I	90.6	Very high	87.9	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.082	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.7	178.5	-56.7	176.1	0	0	0	109.6	C50 V84 V88 A90 F95	C50-I93 WeakPolarHBondContact O-CA 3.4Å; V84-I93 HydrophobicContact CG1-CD1 4.41Å; V84-I93 HydrophobicContact CG2-CD1 4.06Å; V88-I93 HydrophobicContact CG1-CG1 4.19Å; A90-I93 PolarHBondContact O-N 3.08Å; I93-F95 HydrophobicContact CG2-CD2 4.48Å; I93-F95 HydrophobicContact CG2-CE2 4.04Å; I93-F95 HydrophobicContact CG2-CZ 4.17Å
94	V	92.8	Very high	87.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.4	175.9	-169.8	0	0	0	0	108.4	C50 D52 I96 N213 R215	C50-V94 HydrophobicContact CB-CB 4.4Å; C50-V94 WeakPolarHBondContact CB-O 3.47Å; C50-V94 PolarHBondContact N-O 3.04Å; C50-V94 PolarHBondContact O-N 3.26Å; D52-V94 HydrophobicContact CB-CG2 3.93Å; V94-I96 HydrophobicContact CG1-CG1 4.36Å; V94-N213 HydrophobicContact CG1-CB 3.94Å; V94-R215 HydrophobicContact CB-CG 4.38Å; V94-R215 HydrophobicContact CG1-CG 4.08Å; V94-R215 HydrophobicContact CG2-CG 3.95Å
95	F	94.4	Very high	87.6	Confident	10 Å²	10	53 Å²	53	4%	0.044	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.1	171.4	-62.7	-89.8	0	0	0	108.6	M47 K49 I93 L214 I216 V234	M47-F95 HydrophobicContact CB-CB 3.96Å; M47-F95 HydrophobicContact CB-CD1 4.44Å; M47-F95 HydrophobicContact CE-CB 3.82Å; M47-F95 WeakPolarHBondContact CE-O 3.41Å; M47-F95 HydrophobicContact SD-CB 4.14Å; K49-F95 HydrophobicContact CD-CE1 4.33Å; K49-F95 HydrophobicContact CG-CD1 3.99Å; K49-F95 HydrophobicContact CG-CE1 3.76Å; I93-F95 HydrophobicContact CG2-CD2 4.48Å; I93-F95 HydrophobicContact CG2-CE2 4.04Å; I93-F95 HydrophobicContact CG2-CZ 4.17Å; F95-L214 HydrophobicContact CB-CB 4.25Å; F95-L214 HydrophobicContact CB-CD2 4.16Å; F95-L214 HydrophobicContact CD2-CD2 3.82Å; F95-L214 HydrophobicContact CG-CD2 4.32Å; F95-L214 PolarHBondContact N-O 3.32Å; F95-L214 PolarHBondContact O-N 2.92Å; F95-I216 HydrophobicContact CD2-CD1 4.32Å; F95-I216 HydrophobicContact CD2-CG1 4.43Å; F95-I216 HydrophobicContact CE2-CD1 3.86Å; F95-I216 HydrophobicContact CE2-CG1 4.23Å; F95-V234 HydrophobicContact CD1-CB 3.92Å; F95-V234 HydrophobicContact CD1-CG2 3.68Å; F95-V234 HydrophobicContact CD2-CG2 4.3Å; F95-V234 HydrophobicContact CE1-CB 4.25Å; F95-V234 HydrophobicContact CE1-CG2 3.6Å; F95-V234 HydrophobicContact CE2-CG2 4.25Å; F95-V234 HydrophobicContact CG-CB 4.33Å; F95-V234 HydrophobicContact CG-CG2 4.04Å; F95-V234 HydrophobicContact CZ-CG2 3.9Å
96	I	94.5	Very high	87.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126	-175.1	-56.3	171.4	0	0	0	109.5	M47 S48 C50 H61 C71 V94 Q98 L211 L212	M47-I96 CarbonylContact C-O 3.43Å; M47-I96 WeakPolarHBondContact CA-O 3.48Å; S48-I96 PolarHBondContact N-O 3.23Å; S48-I96 PolarHBondContact O-N 2.83Å; C50-I96 HydrophobicContact CB-CD1 3.37Å; C50-I96 HydrophobicContact CB-CG1 4.04Å; H61-I96 HydrophobicContact CB-CD1 3.57Å; H61-I96 HydrophobicContact CB-CG1 4.23Å; C71-I96 HydrophobicContact CB-CD1 4.19Å; V94-I96 HydrophobicContact CG1-CG1 4.36Å; I96-Q98 HydrophobicContact CG2-CG 4.37Å; I96-L211 HydrophobicContact CG2-CD1 3.51Å; I96-L212 WeakPolarHBondContact CA-O 3.47Å
97	A	94.4	Very high	87.5	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.5	164.2	0	0	0	0	0	110.2	I45 M47 L211 L212 M236	I45-A97 HydrophobicContact CG2-CB 4.23Å; M47-A97 HydrophobicContact CE-CB 3.86Å; M47-A97 HydrophobicContact CG-CB 4.09Å; A97-L211 WeakPolarHBondContact O-CA 3.22Å; A97-L212 HydrophobicContact CB-CB 4.26Å; A97-L212 HydrophobicContact CB-CD2 4.47Å; A97-L212 PolarHBondContact N-O 2.97Å; A97-L212 PolarHBondContact O-N 2.97Å; A97-M236 HydrophobicContact CB-CE 3.66Å; A97-M236 HydrophobicContact CB-SD 3.97Å
98	Q	92.3	Very high	87.8	Confident	20 Å²	20	54 Å²	54	9%	0.093	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.5	169.9	-73.2	-175.2	-14	0	0	109.1	F62 R64 I96 Y210 L211	F62-Q98 VanDerWaalsContact CB-NE2 3.29Å; R64-Q98 PolarHBondContact O-NE2 2.82Å; I96-Q98 HydrophobicContact CG2-CG 4.37Å; Q98-Y210 WeakPolarHBondContact CA-O 3.18Å; Q98-L211 HydrophobicContact CG-CD1 3.51Å
99	F	92.3	Very high	88.1	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.009	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.6	175.8	60.9	-81.7	0	0	0	111.1	I45 V117 L144 F200 Y210 M236 E238	I45-F99 HydrophobicContact CD1-CB 3.68Å; F99-V117 HydrophobicContact CE2-CG1 4.04Å; F99-L144 HydrophobicContact CE1-CD1 4.42Å; F99-L144 HydrophobicContact CZ-CD1 4.37Å; F99-F200 HydrophobicContact CE1-CZ 4.13Å; F99-F200 HydrophobicContact CZ-CE1 4.49Å; F99-F200 HydrophobicContact CZ-CE2 4.39Å; F99-F200 AromaticContact CZ-CZ 3.68Å; F99-F200 HydrophobicContact CZ-CZ 3.68Å; F99-Y210 HydrophobicContact CD2-CD2 4.05Å; F99-Y210 HydrophobicContact CD2-CG 4.32Å; F99-Y210 VanDerWaalsContact CE2-CB 3.43Å; F99-Y210 AromaticContact CE2-CD2 3.59Å; F99-Y210 HydrophobicContact CE2-CD2 3.59Å; F99-Y210 AromaticContact CE2-CG 3.62Å; F99-Y210 HydrophobicContact CE2-CG 3.62Å; F99-Y210 HydrophobicContact CZ-CD1 4.43Å; F99-Y210 HydrophobicContact CZ-CD2 4.2Å; F99-Y210 AromaticContact CZ-CG 3.73Å; F99-Y210 HydrophobicContact CZ-CG 3.73Å; F99-Y210 PolarHBondContact N-O 3.22Å; F99-Y210 PolarHBondContact O-N 2.73Å; F99-M236 HydrophobicContact CD1-CE 3.69Å; F99-M236 HydrophobicContact CE1-CE 4.04Å; F99-M236 HydrophobicContact CG-CE 4.41Å; F99-E238 HydrophobicContact CD2-CG 3.97Å; F99-E238 HydrophobicContact CE2-CG 4.33Å; F99-E238 HydrophobicContact CG-CG 4.33Å
100	P	92.5	Very high	88.4	Confident	13 Å²	13	52 Å²	52	8%	0.084	29%	0.29	C	S	.	.	S	Bend	cis	-72	149.8	8.2	30	-32.2	0	0	0	113.9	L108 M110 E208	P100-L108 HydrophobicContact CB-CB 3.84Å; P100-L108 HydrophobicContact CG-CB 3.81Å; P100-L108 WeakPolarHBondContact CG-O 3.5Å; P100-M110 HydrophobicContact CB-CE 3.6Å; P100-M110 HydrophobicContact CB-CG 4.49Å; P100-M110 HydrophobicContact CG-CE 4.33Å; P100-M110 HydrophobicContact CG-CG 4.31Å; P100-E208 WeakPolarHBondContact CD-O 3.47Å
101	H	86.5	Confident	88.7	Confident	85 Å²	85	52.1 Å²	52.1	39%	0.394	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-76	130.5	172.4	-162.4	83.4	0	0	0	110	L108	H101-L108 WeakPolarHBondContact O-CD1 3.26Å
102	P	85.9	Confident	89	Confident	26 Å²	26	53.8 Å²	53.8	17%	0.169	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-55.8	137.5	172.4	-27	35.6	0	0	0	111.6	R64 M106	R64-P102 VanDerWaalsContact CZ-CG 3.42Å; P102-M106 VanDerWaalsContact CA-O 3.31Å; P102-M106 WeakPolarHBondContact CA-O 3.44Å; P102-M106 WeakPolarHBondContact CB-O 3.11Å
103	R	83.6	Confident	89.2	Confident	120 Å²	120	55 Å²	55	45%	0.453	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-126.1	135.6	177	-64.5	-177.6	-179.9	-178.2	-2.4	108.5	D43 G105 M106 L108	D43-R103 IonicContact OD1-CZ 3.17Å; D43-R103 IonicContact OD1-NH2 3.58Å; D43-R103 PolarHBondContact OD1-NH2 3.49Å; D43-R103 IonicContact OD2-NH2 2.71Å; R103-G105 PolarHBondContact O-N 3.27Å; R103-G105 VanDerWaalsContact O-N 3.15Å; R103-M106 PolarHBondContact N-O 2.96Å; R103-M106 PolarHBondContact O-N 3.29Å; R103-L108 HydrophobicContact CB-CD1 4.13Å; R103-L108 HydrophobicContact CG-CD1 3.91Å
104	D	82.1	Confident	89.3	Confident	158 Å²	158	55.8 Å²	55.8	85%	0.845	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	34.3	180	-55.8	-39	0	0	0	114.3	M106	D104-M106 HydrophobicContact CB-CE 4.36Å; D104-M106 PolarHBondContact O-N 3.49Å
105	G	78.7	Confident	89.2	Confident	81 Å²	81	56.8 Å²	56.8	84%	0.835	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	7.9	-179	0	0	0	0	0	115	R103	R103-G105 PolarHBondContact O-N 3.27Å; R103-G105 VanDerWaalsContact O-N 3.15Å
106	M	82.3	Confident	89	Confident	119 Å²	119	58.5 Å²	58.5	59%	0.586	30%	0.301	S	S	*	.	B	Isolated β-bridge	trans	-98.4	127.7	173.6	-65.7	-177.9	-74.7	0	0	110.5	P102 R103 D104 L108	P102-M106 VanDerWaalsContact CA-O 3.31Å; P102-M106 WeakPolarHBondContact CA-O 3.44Å; P102-M106 WeakPolarHBondContact CB-O 3.11Å; R103-M106 PolarHBondContact N-O 2.96Å; R103-M106 PolarHBondContact O-N 3.29Å; D104-M106 HydrophobicContact CB-CE 4.36Å; D104-M106 PolarHBondContact O-N 3.49Å; M106-L108 PolarHBondContact O-N 3.24Å
107	D	81	Confident	88.9	Confident	117 Å²	117	58.4 Å²	58.4	63%	0.626	30%	0.301	S	S	*	.			trans	-69.9	114.5	168	-70.3	-30.4	0	0	0	108.4
108	L	88.3	Confident	88.9	Confident	65 Å²	65	60.6 Å²	60.6	34%	0.34	31%	0.312	S	S	.	.			trans	-84.4	160.2	177.9	-61.9	-178.7	0	0	0	109.7	P100 H101 R103 M106	P100-L108 HydrophobicContact CB-CB 3.84Å; P100-L108 HydrophobicContact CG-CB 3.81Å; P100-L108 WeakPolarHBondContact CG-O 3.5Å; H101-L108 WeakPolarHBondContact O-CD1 3.26Å; R103-L108 HydrophobicContact CB-CD1 4.13Å; R103-L108 HydrophobicContact CG-CD1 3.91Å; M106-L108 PolarHBondContact O-N 3.24Å
109	H	90.4	Very high	89	Confident	82 Å²	82	59.7 Å²	59.7	38%	0.38	31%	0.308	S	S	.	.			trans	-129	137.3	173.5	-62.3	-57.4	0	0	0	110.1	E208 E209	H109-E208 HydrophobicContact CB-CB 4.22Å; H109-E209 IonicContact CE1-OE1 2.76Å; H109-E209 IonicContact ND1-OE1 3.75Å
110	M	92	Very high	89.1	Confident	15 Å²	15	61 Å²	61	7%	0.074	32%	0.316	C	S	.	.			trans	-66.6	144.4	169.5	-73.8	-77.3	120.2	0	0	109.8	P100 F114 H207 E208 Y210	P100-M110 HydrophobicContact CB-CE 3.6Å; P100-M110 HydrophobicContact CB-CG 4.49Å; P100-M110 HydrophobicContact CG-CE 4.33Å; P100-M110 HydrophobicContact CG-CG 4.31Å; M110-F114 HydrophobicContact CB-CD2 4.37Å; M110-F114 HydrophobicContact CE-CD2 4.1Å; M110-F114 HydrophobicContact CE-CE2 3.71Å; M110-F114 HydrophobicContact SD-CD2 3.44Å; M110-F114 WeakPolarHBondContact SD-CD2 3.48Å; M110-F114 HydrophobicContact SD-CE2 3.65Å; M110-H207 WeakPolarHBondContact CB-O 3.3Å; M110-E208 WeakPolarHBondContact CB-O 3.34Å; M110-E208 PolarHBondContact N-O 2.84Å; M110-Y210 HydrophobicContact CB-CE2 4.25Å; M110-Y210 HydrophobicContact CG-CD2 4.29Å; M110-Y210 HydrophobicContact CG-CE2 4.26Å
111	T	92.4	Very high	89.2	Confident	57 Å²	57	60.4 Å²	60.4	35%	0.35	31%	0.313	S	S	.	.			trans	-118.7	150.2	-179.1	73.8	0	0	0	0	110.8	W113 F114	T111-W113 PolarHBondContact O-N 3.33Å; T111-F114 WeakPolarHBondContact O-CB 3.17Å; T111-F114 WeakPolarHBondContact O-CG 3.46Å; T111-F114 PolarHBondContact O-N 2.99Å
112	R	92.8	Very high	89.6	Confident	107 Å²	107	59.1 Å²	59.1	40%	0.404	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-60.5	-15.7	176.4	-55.7	-175.4	-174.1	175.2	2.9	114.5	F114 Q115 C205 H206 L304	R112-F114 PolarHBondContact O-N 3.35Å; R112-Q115 PolarHBondContact O-N 2.97Å; R112-Q115 PolarHBondContact O-NE2 2.79Å; R112-C205 VanDerWaalsContact CA-O 3.26Å; R112-C205 WeakPolarHBondContact CA-O 3.42Å; R112-H206 VanDerWaalsContact CZ-CE1 3.44Å; R112-L304 HydrophobicContact CB-CD2 3.93Å; R112-L304 WeakPolarHBondContact CD-O 3.33Å; R112-L304 PolarHBondContact NH1-O 3.14Å; R112-L304 WeakPolarHBondContact O-CD2 3.17Å
113	W	93.4	Very high	89.9	Confident	61 Å²	61	58.3 Å²	58.3	23%	0.231	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-69.4	-17.6	173.6	-67.2	102.8	0	0	0	113.5	T111 Q115 T246 K247 F250 W301 L304	T111-W113 PolarHBondContact O-N 3.33Å; W113-Q115 VanDerWaalsContact C-N 3.25Å; W113-Q115 PolarHBondContact O-N 3.49Å; W113-T246 HydrophobicContact CE3-CG2 4.06Å; W113-T246 WeakPolarHBondContact O-CB 3.2Å; W113-T246 WeakPolarHBondContact O-CG2 3.44Å; W113-T246 PolarHBondContact O-OG1 3.18Å; W113-K247 HydrophobicContact CD2-CD 4.41Å; W113-K247 HydrophobicContact CD2-CG 3.81Å; W113-K247 HydrophobicContact CE3-CG 3.47Å; W113-K247 VanDerWaalsContact CE3-CG 3.47Å; W113-K247 HydrophobicContact CH2-CG 3.8Å; W113-K247 HydrophobicContact CZ2-CG 4.14Å; W113-K247 HydrophobicContact CZ3-CB 4.31Å; W113-K247 HydrophobicContact CZ3-CG 3.46Å; W113-K247 VanDerWaalsContact CZ3-CG 3.46Å; W113-F250 AromaticContact CZ3-CD2 4Å; W113-F250 HydrophobicContact CZ3-CD2 4Å; W113-F250 HydrophobicContact CZ3-CE2 4.37Å; W113-W301 HydrophobicContact CH2-CE3 4.44Å; W113-W301 AromaticContact CH2-CH2 3.99Å; W113-W301 HydrophobicContact CH2-CH2 3.99Å; W113-W301 AromaticContact CH2-CZ3 3.65Å; W113-W301 HydrophobicContact CH2-CZ3 3.65Å; W113-W301 HydrophobicContact CZ3-CZ3 4.4Å; W113-L304 HydrophobicContact CD2-CD1 4.48Å; W113-L304 HydrophobicContact CD2-CD2 4.12Å; W113-L304 HydrophobicContact CE3-CD1 4.23Å; W113-L304 HydrophobicContact CE3-CD2 4.14Å; W113-L304 HydrophobicContact CH2-CD1 3.56Å; W113-L304 HydrophobicContact CZ2-CD1 3.82Å; W113-L304 HydrophobicContact CZ3-CD1 3.77Å; W113-L304 HydrophobicContact CZ3-CD2 4.49Å
114	F	92.5	Very high	90.2	Very high	31 Å²	31	55 Å²	55	14%	0.136	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-75	-15	178.7	-61.9	-25.5	0	0	0	113.9	M110 T111 R112 Q116 C205 H240 Q241	M110-F114 HydrophobicContact CB-CD2 4.37Å; M110-F114 HydrophobicContact CE-CD2 4.1Å; M110-F114 HydrophobicContact CE-CE2 3.71Å; M110-F114 HydrophobicContact SD-CD2 3.44Å; M110-F114 WeakPolarHBondContact SD-CD2 3.48Å; M110-F114 HydrophobicContact SD-CE2 3.65Å; T111-F114 WeakPolarHBondContact O-CB 3.17Å; T111-F114 WeakPolarHBondContact O-CG 3.46Å; T111-F114 PolarHBondContact O-N 2.99Å; R112-F114 PolarHBondContact O-N 3.35Å; F114-Q116 VanDerWaalsContact C-N 3.27Å; F114-Q116 PolarHBondContact O-N 3.41Å; F114-Q116 VanDerWaalsContact O-O 3.11Å; F114-C205 HydrophobicContact CB-CB 3.98Å; F114-H240 HydrophobicContact CB-CB 4.17Å; F114-H240 AromaticContact CD1-CD2 3.79Å; F114-H240 AromaticContact CG-CD2 3.8Å; F114-Q241 VanDerWaalsContact CA-O 3.26Å; F114-Q241 WeakPolarHBondContact CA-O 3.34Å; F114-Q241 VanDerWaalsContact CD1-O 3.22Å; F114-Q241 WeakPolarHBondContact CD1-O 3.45Å; F114-Q241 WeakPolarHBondContact O-CB 3.27Å; F114-Q241 PolarHBondContact O-N 3.36Å
115	Q	90.5	Very high	90.4	Very high	21 Å²	21	47.5 Å²	47.5	10%	0.098	25%	0.253	C	S	.	.			trans	53.1	-77.5	173.3	-61.9	-69.8	-57.4	0	0	113.7	R112 W113 A203 S204 C205 T246 F250 S303	R112-Q115 PolarHBondContact O-N 2.97Å; R112-Q115 PolarHBondContact O-NE2 2.79Å; W113-Q115 VanDerWaalsContact C-N 3.25Å; W113-Q115 PolarHBondContact O-N 3.49Å; Q115-A203 CarbonylContact O-C 3.54Å; Q115-S204 CarbonylContact O-C 3.58Å; Q115-S204 WeakPolarHBondContact O-CA 3.27Å; Q115-S204 PolarHBondContact O-N 2.81Å; Q115-C205 PolarHBondContact O-N 3.43Å; Q115-T246 HydrophobicContact CG-CG2 3.69Å; Q115-F250 HydrophobicContact CG-CZ 4.24Å; Q115-S303 PolarHBondContact NE2-OG 3.11Å; Q115-S303 PolarHBondContact OE1-OG 2.93Å
116	Q	90.8	Very high	90.7	Very high	46 Å²	46	45.5 Å²	45.5	22%	0.215	22%	0.221	C	C	.	.			trans	-101.7	143.1	179.9	173.2	174	0.6	0	0	111.7	F114 I118 L202 H240 Q241	F114-Q116 VanDerWaalsContact C-N 3.27Å; F114-Q116 PolarHBondContact O-N 3.41Å; F114-Q116 VanDerWaalsContact O-O 3.11Å; Q116-I118 HydrophobicContact CG-CG1 4.02Å; Q116-I118 VanDerWaalsContact NE2-CD1 3.26Å; Q116-L202 WeakPolarHBondContact CA-O 3.25Å; Q116-H240 VanDerWaalsContact O-CA 3.3Å; Q116-H240 WeakPolarHBondContact O-CA 3.05Å; Q116-Q241 PolarHBondContact O-N 2.91Å
117	V	93.2	Very high	90.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130	169.5	-174.9	0	0	0	0	109.1	F99 F200 L202 C205 E238 I239 H240	F99-V117 HydrophobicContact CE2-CG1 4.04Å; V117-F200 HydrophobicContact CG1-CE2 4.03Å; V117-F200 HydrophobicContact CG1-CZ 4.45Å; V117-L202 HydrophobicContact CB-CB 4.27Å; V117-L202 HydrophobicContact CB-CD1 4.41Å; V117-L202 PolarHBondContact N-O 2.82Å; V117-L202 VanDerWaalsContact N-O 3.09Å; V117-L202 PolarHBondContact O-N 3.14Å; V117-C205 HydrophobicContact CG2-CB 3.79Å; V117-E238 HydrophobicContact CG1-CG 4.03Å; V117-I239 CarbonylContact C-O 3.56Å; V117-I239 WeakPolarHBondContact CA-O 3.4Å; V117-H240 HydrophobicContact CG2-CB 4.29Å
118	I	93.9	Very high	89.8	Confident	46 Å²	46	40.6 Å²	40.6	24%	0.236	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.9	177.7	-50.1	174.8	0	0	0	108	Q116 V120 T201 I239	Q116-I118 HydrophobicContact CG-CG1 4.02Å; Q116-I118 VanDerWaalsContact NE2-CD1 3.26Å; I118-V120 HydrophobicContact CG2-CG2 4.29Å; I118-T201 HydrophobicContact CG1-CG2 4.28Å; I118-I239 HydrophobicContact CB-CB 4.26Å; I118-I239 PolarHBondContact N-O 3.37Å; I118-I239 PolarHBondContact O-N 3.39Å
119	G	94.2	Very high	88.7	Confident	1 Å²	1	43 Å²	43	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.4	169.2	0	0	0	0	0	110.6	L199 F200	G119-L199 VanDerWaalsContact O-CB 3.3Å; G119-L199 WeakPolarHBondContact O-CB 3.36Å; G119-L199 PolarHBondContact O-N 3.05Å; G119-F200 PolarHBondContact N-O 3.04Å; G119-F200 PolarHBondContact O-N 2.98Å
120	V	94.7	Very high	87.3	Confident	29 Å²	29	42.2 Å²	42.2	18%	0.176	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.2	170.5	-164.5	0	0	0	0	108.5	I118 V196 L197 M236 V237 I239	I118-V120 HydrophobicContact CG2-CG2 4.29Å; V120-V196 HydrophobicContact CG1-CB 3.84Å; V120-V196 HydrophobicContact CG1-CG2 4.19Å; V120-L197 WeakPolarHBondContact CG1-O 3.34Å; V120-M236 CarbonylContact O-C 3.57Å; V120-M236 WeakPolarHBondContact O-CA 2.88Å; V120-V237 PolarHBondContact N-O 2.74Å; V120-V237 PolarHBondContact O-N 3.11Å; V120-I239 HydrophobicContact CG2-CD1 4.32Å
121	L	94.6	Very high	86.2	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.4	-178.1	-162.3	74.1	0	0	0	110.3	M47 L123 F140 L197 L214 V234 W235	M47-L121 HydrophobicContact SD-CD1 4.19Å; L121-L123 HydrophobicContact CD2-CD2 3.74Å; L121-L123 HydrophobicContact CD2-CG 4.27Å; L121-L123 HydrophobicContact CG-CD2 4.07Å; L121-F140 HydrophobicContact CD2-CE1 3.91Å; L121-F140 HydrophobicContact CD2-CE2 4.12Å; L121-F140 HydrophobicContact CD2-CZ 3.59Å; L121-L197 HydrophobicContact CB-CB 4.22Å; L121-L197 PolarHBondContact N-O 3.17Å; L121-L197 PolarHBondContact O-N 2.99Å; L121-L214 HydrophobicContact CD1-CD1 3.96Å; L121-L214 HydrophobicContact CD2-CD1 4.01Å; L121-V234 HydrophobicContact CD1-CG1 3.36Å; L121-V234 HydrophobicContact CD2-CG1 4.39Å; L121-V234 HydrophobicContact CG-CG1 4.02Å; L121-W235 CarbonylContact C-O 3.56Å; L121-W235 WeakPolarHBondContact CA-O 3.46Å
122	M	93.8	Very high	85.1	Confident	57 Å²	57	49.3 Å²	49.3	28%	0.281	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129	168.8	-45	-178	-65.1	0	0	107.6	V196 W235 V237	M122-V196 HydrophobicContact CG-CG1 4.04Å; M122-V196 HydrophobicContact SD-CG1 4.33Å; M122-W235 HydrophobicContact CB-CB 4.15Å; M122-W235 HydrophobicContact CE-CB 3.83Å; M122-W235 HydrophobicContact CE-CG 4.43Å; M122-W235 PolarHBondContact N-O 2.7Å; M122-W235 PolarHBondContact O-N 2.9Å; M122-V237 HydrophobicContact CE-CG2 3.51Å; M122-V237 HydrophobicContact CG-CG2 4.35Å; M122-V237 HydrophobicContact SD-CG2 3.91Å
123	L	92	Very high	84	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.047	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.7	-175.6	-61.8	175	0	0	0	109.4	L121 I125 I138 F140 L168 L197 V234	L121-L123 HydrophobicContact CD2-CD2 3.74Å; L121-L123 HydrophobicContact CD2-CG 4.27Å; L121-L123 HydrophobicContact CG-CD2 4.07Å; L123-I125 HydrophobicContact CB-CD1 4.29Å; L123-I125 HydrophobicContact CB-CG1 4.06Å; L123-I125 HydrophobicContact CD1-CD1 4.49Å; L123-I138 HydrophobicContact CD1-CD1 3.93Å; L123-F140 HydrophobicContact CD1-CZ 4.15Å; L123-L168 HydrophobicContact CD1-CD1 3.94Å; L123-L197 HydrophobicContact CD1-CD1 3.77Å; L123-L197 HydrophobicContact CG-CD1 4.34Å; L123-V234 HydrophobicContact CD2-CB 4.43Å; L123-V234 HydrophobicContact CD2-CG1 3.98Å; L123-V234 HydrophobicContact CD2-CG2 3.91Å
124	D	89.8	Confident	82.8	Confident	51 Å²	51	49.2 Å²	49.2	27%	0.273	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	104.9	172.8	-69	-13.4	0	0	0	108.2	Y191 Q232 D233 W235	D124-Y191 HydrophobicContact CB-CD1 4.03Å; D124-Y191 HydrophobicContact CB-CE1 4.16Å; D124-Q232 PolarHBondContact O-N 3.45Å; D124-D233 HydrophobicContact CB-CB 4.16Å; D124-D233 PolarHBondContact N-O 3.23Å; D124-W235 VanDerWaalsContact OD2-CD1 3.28Å; D124-W235 PolarHBondContact OD2-NE1 2.94Å
125	I	87.9	Confident	81.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.2	-176.8	-51	-177.6	0	0	0	108.7	L123 L168 Y191 Y192 S230 I231	L123-I125 HydrophobicContact CB-CD1 4.29Å; L123-I125 HydrophobicContact CB-CG1 4.06Å; L123-I125 HydrophobicContact CD1-CD1 4.49Å; I125-L168 HydrophobicContact CD1-CD1 4.28Å; I125-L168 HydrophobicContact CD1-CD2 3.69Å; I125-Y191 CarbonylContact O-C 3.5Å; I125-Y191 WeakPolarHBondContact O-CA 3.32Å; I125-Y192 HydrophobicContact CB-CD2 4.04Å; I125-Y192 HydrophobicContact CG2-CD2 3.82Å; I125-Y192 HydrophobicContact CG2-CE2 4.33Å; I125-Y192 WeakPolarHBondContact O-CD2 3.37Å; I125-Y192 PolarHBondContact O-N 3.48Å; I125-S230 CarbonylContact C-O 3.59Å; I125-I231 HydrophobicContact CG1-CG1 4.24Å
126	K	83.5	Confident	81.5	Confident	39 Å²	39	55.8 Å²	55.8	17%	0.17	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	133.8	174.3	-171.9	176.1	-173.2	178.8	0	109.7	D79 K128 Y191 S230 Q232	D79-K126 IonicContact OD2-NZ 2.65Å; D79-K126 PolarHBondContact OD2-NZ 3Å; K126-K128 PolarHBondContact O-N 3.29Å; K126-Y191 HydrophobicContact CB-CE1 4.35Å; K126-S230 PolarHBondContact N-O 2.91Å; K126-Q232 HydrophobicContact CB-CG 3.67Å; K126-Q232 HydrophobicContact CD-CG 4.47Å
127	Q	75.3	Confident	81.4	Confident	18 Å²	18	59.2 Å²	59.2	8%	0.084	29%	0.288	C	S	.	.			trans	-70.3	111.5	-177.7	-172.1	-177.3	-5.7	0	0	110.8	Y129 L172 L186 F190 Y192	Q127-Y129 VanDerWaalsContact CG-O 3.28Å; Q127-Y129 WeakPolarHBondContact CG-O 3.43Å; Q127-Y129 PolarHBondContact NE2-O 3.32Å; Q127-L172 VanDerWaalsContact CD-CD2 3.42Å; Q127-L172 HydrophobicContact CG-CD2 4.19Å; Q127-L186 HydrophobicContact CG-CD2 4.02Å; Q127-F190 VanDerWaalsContact CB-O 3.32Å; Q127-F190 WeakPolarHBondContact CB-O 3.4Å; Q127-F190 PolarHBondContact N-O 3.39Å; Q127-Y192 HydrophobicContact CB-CD2 4.45Å; Q127-Y192 HydrophobicContact CB-CE2 4.13Å; Q127-Y192 HydrophobicContact CG-CE2 4.08Å
128	K	69.5	Low	81.3	Confident	115 Å²	115	59.2 Å²	59.2	50%	0.5	29%	0.288	S	S	.	.			trans	-101.1	-19.4	171.3	-163.6	162.6	-167.9	148.5	0	112.9	E81 K126	E81-K128 IonicContact OE1-NZ 2.74Å; E81-K128 PolarHBondContact OE1-NZ 3.42Å; K126-K128 PolarHBondContact O-N 3.29Å
129	Y	66.1	Low	81.3	Confident	117 Å²	117	58 Å²	58	46%	0.459	28%	0.283	S	S	.	.	S	Bend	trans	-126.7	138.5	-174.1	-54.1	-74	0	0	0	110.3	Q127 K131 Y192	Q127-Y129 VanDerWaalsContact CG-O 3.28Å; Q127-Y129 WeakPolarHBondContact CG-O 3.43Å; Q127-Y129 PolarHBondContact NE2-O 3.32Å; Y129-K131 PolarHBondContact O-N 2.87Å; Y129-Y192 PolarHBondContact O-OH 2.88Å
130	S	60.3	Low	81.3	Confident	64 Å²	64	58.1 Å²	58.1	45%	0.448	28%	0.283	S	S	.	.	S	Bend	trans	-75.3	26.1	174.6	-54.3	0	0	0	0	114	L186	S130-L186 WeakPolarHBondContact OG-CD1 3.34Å
131	K	68.7	Low	81.3	Confident	161 Å²	161	57.7 Å²	57.7	70%	0.7	28%	0.28	S	S	*	.	S	Bend	trans	-124.4	142.4	-177	-163.7	-177	174.7	-174.7	0	110.1	Y129 Y192	Y129-K131 PolarHBondContact O-N 2.87Å; K131-Y192 PolarHBondContact O-OH 3.25Å
132	E	69.2	Low	81.3	Confident	61 Å²	61	57.6 Å²	57.6	29%	0.285	28%	0.279	S	S	.	.			trans	-65.3	141.1	168.7	-66.7	-179.8	161.5	0	0	110.1	E134 L172 K177	E132-E134 VanDerWaalsContact C-N 3.31Å; E132-E134 HydrophobicContact CB-CG 4.36Å; E132-E134 PolarHBondContact O-N 3.4Å; E132-E134 VanDerWaalsContact O-N 3.16Å; E132-L172 HydrophobicContact CG-CD1 3.99Å; E132-L172 HydrophobicContact CG-CG 3.91Å; E132-K177 WeakPolarHBondContact OE1-CE 3.34Å; E132-K177 IonicContact OE1-NZ 3.7Å; E132-K177 PolarHBondContact OE1-NZ 3.06Å
133	L	70.7	Confident	81.3	Confident	14 Å²	14	55.5 Å²	55.5	7%	0.073	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	74.5	177.6	-73.4	150.9	0	0	0	108.4	T136 C170 Y192	L133-T136 HydrophobicContact CD2-CG2 4.42Å; L133-T136 WeakPolarHBondContact CD2-OG1 3.32Å; L133-C170 HydrophobicContact CB-CB 4.27Å; L133-C170 HydrophobicContact CD1-CB 4.33Å; L133-Y192 HydrophobicContact CD1-CD1 4.36Å; L133-Y192 HydrophobicContact CD1-CD2 4Å; L133-Y192 HydrophobicContact CD1-CE1 4.08Å; L133-Y192 HydrophobicContact CD1-CE2 3.69Å; L133-Y192 HydrophobicContact CD1-CG 4.31Å
134	E	67.1	Low	81.5	Confident	151 Å²	151	55 Å²	55	71%	0.706	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	125.3	174.2	-67.8	-170.5	151.2	0	0	110.7	E132	E132-E134 VanDerWaalsContact C-N 3.31Å; E132-E134 HydrophobicContact CB-CG 4.36Å; E132-E134 PolarHBondContact O-N 3.4Å; E132-E134 VanDerWaalsContact O-N 3.16Å
135	N	72.8	Confident	81.7	Confident	162 Å²	162	52.6 Å²	52.6	87%	0.866	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	65.8	28.9	179.7	-54.8	-40.4	0	0	0	115.9
136	T	84	Confident	82	Confident	29 Å²	29	55.1 Å²	55.1	18%	0.178	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	135.2	170.5	-57.7	0	0	0	0	109.5	L133 L168 V228	L133-T136 HydrophobicContact CD2-CG2 4.42Å; L133-T136 WeakPolarHBondContact CD2-OG1 3.32Å; T136-L168 WeakPolarHBondContact O-CB 3.38Å; T136-L168 PolarHBondContact O-N 3.41Å; T136-V228 HydrophobicContact CG2-CB 4.47Å; T136-V228 HydrophobicContact CG2-CG1 3.7Å
137	E	88.3	Confident	82.4	Confident	118 Å²	118	54.6 Å²	54.6	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	133	173.3	-66.9	-179.7	164.1	0	0	109.1	V165 R166	E137-V165 HydrophobicContact CB-CG1 3.9Å; E137-V165 HydrophobicContact CG-CG1 4.34Å; E137-R166 WeakPolarHBondContact CA-O 3.4Å
138	I	91.3	Very high	83.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.9	173.3	-170.7	164.9	0	0	0	109.3	L123 F140 V165 R166 L168 L197 I216 N225 I231	L123-I138 HydrophobicContact CD1-CD1 3.93Å; I138-F140 HydrophobicContact CB-CE2 4.48Å; I138-F140 HydrophobicContact CB-CZ 4.32Å; I138-F140 HydrophobicContact CD1-CE1 3.73Å; I138-F140 HydrophobicContact CD1-CZ 3.66Å; I138-F140 HydrophobicContact CG1-CE1 3.95Å; I138-F140 HydrophobicContact CG1-CE2 4.29Å; I138-F140 HydrophobicContact CG1-CZ 3.79Å; I138-F140 HydrophobicContact CG2-CD2 4.44Å; I138-F140 HydrophobicContact CG2-CE2 3.53Å; I138-F140 HydrophobicContact CG2-CZ 3.6Å; I138-V165 CarbonylContact O-C 3.49Å; I138-V165 WeakPolarHBondContact O-CA 3.44Å; I138-R166 HydrophobicContact CG2-CB 4.03Å; I138-R166 PolarHBondContact N-O 3.4Å; I138-R166 PolarHBondContact O-N 2.9Å; I138-L168 HydrophobicContact CG2-CB 4.36Å; I138-L197 HydrophobicContact CG2-CD1 4.33Å; I138-I216 HydrophobicContact CD1-CG2 4.3Å; I138-I216 HydrophobicContact CG1-CG2 4.37Å; I138-N225 WeakPolarHBondContact CA-OD1 3.48Å; I138-I231 HydrophobicContact CD1-CD1 3.76Å
139	T	93.4	Very high	83.8	Confident	20 Å²	20	56.7 Å²	56.7	12%	0.123	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.7	178.6	-56.6	0	0	0	0	109.6	V163 V165 I224 N225	T139-V163 HydrophobicContact CG2-CG1 3.51Å; T139-V165 HydrophobicContact CG2-CG2 4.24Å; T139-I224 HydrophobicContact CG2-CG2 4.28Å; T139-N225 PolarHBondContact N-OD1 3.37Å; T139-N225 PolarHBondContact O-ND2 3.41Å
140	F	94.4	Very high	84.7	Confident	3 Å²	3	58.5 Å²	58.5	1%	0.013	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.2	176.1	-58.5	-71.2	0	0	0	110.3	L121 L123 I138 L142 V163 E164 R166 L197 L214 R215 I216	L121-F140 HydrophobicContact CD2-CE1 3.91Å; L121-F140 HydrophobicContact CD2-CE2 4.12Å; L121-F140 HydrophobicContact CD2-CZ 3.59Å; L123-F140 HydrophobicContact CD1-CZ 4.15Å; I138-F140 HydrophobicContact CB-CE2 4.48Å; I138-F140 HydrophobicContact CB-CZ 4.32Å; I138-F140 HydrophobicContact CD1-CE1 3.73Å; I138-F140 HydrophobicContact CD1-CZ 3.66Å; I138-F140 HydrophobicContact CG1-CE1 3.95Å; I138-F140 HydrophobicContact CG1-CE2 4.29Å; I138-F140 HydrophobicContact CG1-CZ 3.79Å; I138-F140 HydrophobicContact CG2-CD2 4.44Å; I138-F140 HydrophobicContact CG2-CE2 3.53Å; I138-F140 HydrophobicContact CG2-CZ 3.6Å; F140-L142 HydrophobicContact CB-CD1 4.22Å; F140-L142 HydrophobicContact CB-CD2 3.83Å; F140-L142 HydrophobicContact CB-CG 3.78Å; F140-V163 CarbonylContact O-C 3.59Å; F140-V163 VanDerWaalsContact O-CA 3.27Å; F140-V163 WeakPolarHBondContact O-CA 3.37Å; F140-E164 PolarHBondContact N-O 3.46Å; F140-E164 PolarHBondContact O-N 2.7Å; F140-R166 HydrophobicContact CD2-CG 4.07Å; F140-R166 HydrophobicContact CE2-CB 4.12Å; F140-R166 HydrophobicContact CE2-CG 3.93Å; F140-L197 HydrophobicContact CE2-CD1 4.18Å; F140-L197 HydrophobicContact CZ-CD1 4.19Å; F140-L214 HydrophobicContact CD1-CD1 4.07Å; F140-L214 HydrophobicContact CD1-CD2 3.9Å; F140-L214 HydrophobicContact CD1-CG 4.05Å; F140-L214 HydrophobicContact CE1-CD1 4.4Å; F140-L214 HydrophobicContact CE1-CD2 4.3Å; F140-R215 WeakPolarHBondContact CA-O 3.4Å; F140-I216 HydrophobicContact CD1-CD1 4.45Å; F140-I216 HydrophobicContact CD1-CG1 3.99Å; F140-I216 HydrophobicContact CE1-CD1 4.05Å; F140-I216 HydrophobicContact CE1-CG1 4.09Å
141	D	94.3	Very high	86	Confident	20 Å²	20	57 Å²	57	11%	0.107	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	108.9	161.1	-176.6	8.8	0	0	0	107.6	R161 V163 R215	D141-R161 IonicContact OD1-NE 3.57Å; D141-R161 IonicContact OD1-NH2 2.82Å; D141-R161 IonicContact OD2-NH2 3.64Å; D141-R161 PolarHBondContact OD2-NH2 3.07Å; D141-V163 HydrophobicContact CB-CG2 4.22Å; D141-R215 HydrophobicContact CB-CB 4.27Å; D141-R215 PolarHBondContact N-O 2.97Å; D141-R215 PolarHBondContact O-N 3.24Å
142	L	95	Very high	86.8	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.8	-171.6	-60.2	173.6	0	0	0	110.2	F140 R161 S162 E164 L199 L214 F391	F140-L142 HydrophobicContact CB-CD1 4.22Å; F140-L142 HydrophobicContact CB-CD2 3.83Å; F140-L142 HydrophobicContact CB-CG 3.78Å; L142-R161 WeakPolarHBondContact O-CA 3.34Å; L142-S162 PolarHBondContact N-O 2.84Å; L142-S162 PolarHBondContact O-N 3.32Å; L142-E164 HydrophobicContact CD1-CB 4.1Å; L142-E164 HydrophobicContact CD1-CG 4.07Å; L142-L199 HydrophobicContact CD1-CD1 3.6Å; L142-L199 HydrophobicContact CD2-CD1 3.83Å; L142-L199 HydrophobicContact CG-CD1 4.39Å; L142-L214 HydrophobicContact CD2-CB 3.87Å; L142-L214 HydrophobicContact CD2-CD1 3.66Å; L142-L214 HydrophobicContact CD2-CG 3.59Å; L142-F391 HydrophobicContact CB-CD1 4.09Å; L142-F391 HydrophobicContact CB-CE1 3.72Å; L142-F391 HydrophobicContact CB-CE2 4.23Å; L142-F391 HydrophobicContact CB-CG 4.5Å; L142-F391 HydrophobicContact CB-CZ 3.75Å; L142-F391 HydrophobicContact CD1-CB 4.42Å; L142-F391 HydrophobicContact CD1-CD1 3.5Å; L142-F391 VanDerWaalsContact CD1-CD1 3.5Å; L142-F391 HydrophobicContact CD1-CE1 3.86Å; L142-F391 HydrophobicContact CD1-CG 4.08Å; L142-F391 HydrophobicContact CG-CD1 4.41Å; L142-F391 HydrophobicContact CG-CE1 4.34Å
143	R	94.8	Very high	87.4	Confident	12 Å²	12	57 Å²	57	5%	0.045	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	122.1	172.2	-64	-176.8	69.6	-151.4	-3.2	109.3	V57 L58 K59 W60 E158 R161 L212 N213	V57-R143 PolarHBondContact O-NH1 3.09Å; L58-R143 VanDerWaalsContact CA-NH1 3.28Å; L58-R143 PolarHBondContact O-NH1 2.76Å; L58-R143 PolarHBondContact O-NH2 2.94Å; L58-R143 VanDerWaalsContact O-NH2 3.15Å; K59-R143 PolarHBondContact O-NH1 2.73Å; W60-R143 HydrophobicContact CH2-CB 3.62Å; W60-R143 HydrophobicContact CZ3-CB 3.73Å; R143-E158 IonicContact CZ-OE2 3.09Å; R143-E158 IonicContact NE-OE2 2.86Å; R143-E158 PolarHBondContact NE-OE2 3.23Å; R143-E158 VanDerWaalsContact NE-OE2 3.14Å; R143-E158 IonicContact NH2-OE2 2.64Å; R143-E158 PolarHBondContact NH2-OE2 2.84Å; R143-R161 HydrophobicContact CG-CB 4.15Å; R143-R161 HydrophobicContact CG-CG 3.76Å; R143-L212 WeakPolarHBondContact O-CA 3.3Å; R143-N213 HydrophobicContact CB-CB 4.36Å; R143-N213 PolarHBondContact N-O 2.71Å; R143-N213 PolarHBondContact O-N 3.11Å
144	L	94.9	Very high	87.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122	176.2	-179.8	63.9	0	0	0	108.7	W60 F99 L159 A160 L202 L211 L212 F391	W60-L144 VanDerWaalsContact CH2-C 3.49Å; F99-L144 HydrophobicContact CE1-CD1 4.42Å; F99-L144 HydrophobicContact CZ-CD1 4.37Å; L144-L159 HydrophobicContact CD2-CD2 3.88Å; L144-L159 HydrophobicContact CG-CB 4.42Å; L144-L159 HydrophobicContact CG-CD2 4.22Å; L144-L159 WeakPolarHBondContact O-CA 3.5Å; L144-L159 WeakPolarHBondContact O-CB 3.32Å; L144-L159 PolarHBondContact O-N 3.24Å; L144-A160 PolarHBondContact N-O 3.26Å; L144-A160 PolarHBondContact O-N 3.24Å; L144-A160 VanDerWaalsContact O-N 3.13Å; L144-L202 HydrophobicContact CD2-CD1 4.14Å; L144-L202 HydrophobicContact CD2-CD2 3.87Å; L144-L202 HydrophobicContact CD2-CG 4.34Å; L144-L211 CarbonylContact C-O 3.54Å; L144-L211 WeakPolarHBondContact CA-O 3.48Å; L144-L212 HydrophobicContact CB-CD1 4.48Å; L144-L212 HydrophobicContact CD1-CB 4.41Å; L144-F391 HydrophobicContact CB-CE1 4.44Å; L144-F391 HydrophobicContact CB-CE2 4.29Å; L144-F391 HydrophobicContact CB-CZ 3.6Å
145	G	94	Very high	88.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	162.7	177.3	0	0	0	0	0	111.6	H157 Y210 L211	G145-H157 CarbonylContact C-O 3.49Å; G145-H157 WeakPolarHBondContact CA-O 2.87Å; G145-Y210 WeakPolarHBondContact O-CA 3.43Å; G145-L211 PolarHBondContact N-O 3.44Å; G145-L211 PolarHBondContact O-N 3.46Å
146	Y	94	Very high	89.7	Confident	52 Å²	52	48.5 Å²	48.5	20%	0.204	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.6	175	71.8	-94.9	0	0	0	111.4	H157 L159 H207 E209	Y146-H157 HydrophobicContact CD1-CB 4.02Å; Y146-H157 HydrophobicContact CD2-CB 4.16Å; Y146-H157 HydrophobicContact CE1-CB 3.55Å; Y146-H157 HydrophobicContact CE2-CB 3.68Å; Y146-H157 HydrophobicContact CG-CB 4.32Å; Y146-H157 PolarHBondContact N-O 2.95Å; Y146-H157 PolarHBondContact O-N 2.93Å; Y146-L159 HydrophobicContact CD1-CB 4.13Å; Y146-L159 HydrophobicContact CD1-CD1 4.11Å; Y146-L159 HydrophobicContact CE1-CD1 4.36Å; Y146-H207 AromaticContact CD1-CD2 3.74Å; Y146-H207 AromaticContact CD1-NE2 3.72Å; Y146-H207 HydrophobicContact CD2-CB 4.05Å; Y146-H207 AromaticContact CD2-CD2 3.64Å; Y146-H207 AromaticContact CD2-CE1 3.45Å; Y146-H207 VanDerWaalsContact CD2-CE1 3.45Å; Y146-H207 WeakPolarHBondContact CD2-CE1 3.43Å; Y146-H207 AromaticContact CD2-CG 3.36Å; Y146-H207 AromaticContact CD2-ND1 3.26Å; Y146-H207 VanDerWaalsContact CD2-ND1 3.26Å; Y146-H207 WeakPolarHBondContact CD2-ND1 3.32Å; Y146-H207 AromaticContact CD2-NE2 3.73Å; Y146-H207 AromaticContact CE1-NE2 3.8Å; Y146-H207 AromaticContact CE2-CE1 3.35Å; Y146-H207 WeakPolarHBondContact CE2-CE1 3.34Å; Y146-H207 AromaticContact CE2-ND1 3.55Å; Y146-H207 AromaticContact CE2-NE2 3.84Å; Y146-H207 HydrophobicContact CG-CB 4.13Å; Y146-H207 AromaticContact CG-CD2 3.36Å; Y146-H207 AromaticContact CG-CE1 3.9Å; Y146-H207 AromaticContact CG-CG 3.49Å; Y146-H207 VanDerWaalsContact CG-CG 3.49Å; Y146-H207 AromaticContact CG-ND1 3.85Å; Y146-H207 AromaticContact CG-NE2 3.67Å; Y146-H207 AromaticContact CZ-CE1 3.68Å; Y146-H207 AromaticContact CZ-NE2 3.85Å; Y146-E209 VanDerWaalsContact CA-O 3.27Å; Y146-E209 WeakPolarHBondContact CA-O 3.14Å
147	R	92	Very high	90.1	Very high	28 Å²	28	50.4 Å²	50.4	11%	0.106	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	140.8	173	-168.9	174.9	73.8	101.8	-7.8	109.4	D151 W156 E209	R147-D151 HydrophobicContact CG-CB 3.94Å; R147-W156 HydrophobicContact CB-CD2 4.22Å; R147-W156 HydrophobicContact CB-CE3 3.73Å; R147-W156 HydrophobicContact CB-CH2 4.02Å; R147-W156 HydrophobicContact CB-CZ2 4.49Å; R147-W156 HydrophobicContact CB-CZ3 3.61Å; R147-E209 HydrophobicContact CB-CB 4.35Å; R147-E209 IonicContact CZ-OE1 3.81Å; R147-E209 IonicContact CZ-OE2 3.94Å; R147-E209 PolarHBondContact N-O 3.5Å; R147-E209 IonicContact NE-OE2 3.43Å; R147-E209 PolarHBondContact NE-OE2 3.28Å; R147-E209 IonicContact NH2-OE1 3.83Å; R147-E209 PolarHBondContact NH2-OE1 2.96Å; R147-E209 IonicContact NH2-OE2 3.66Å; R147-E209 PolarHBondContact NH2-OE2 3.18Å; R147-E209 PolarHBondContact O-N 3.06Å; R147-E209 VanDerWaalsContact O-N 3.12Å
148	N	91.7	Very high	90.3	Very high	39 Å²	39	49.2 Å²	49.2	21%	0.209	24%	0.244	C	C	.	.			trans	-111.4	165.8	170.4	-47.2	-75.1	0	0	0	109.6	D150 D151 H207	N148-D150 PolarHBondContact O-N 2.93Å; N148-D151 PolarHBondContact N-OD2 3.5Å; N148-D151 PolarHBondContact ND2-OD2 3.15Å; N148-D151 WeakPolarHBondContact O-CB 3.04Å; N148-D151 PolarHBondContact O-N 3.3Å; N148-H207 WeakPolarHBondContact OD1-CA 3.47Å; N148-H207 WeakPolarHBondContact OD1-CB 3.48Å; N148-H207 PolarHBondContact OD1-ND1 3.18Å
149	H	83.9	Confident	90.4	Very high	139 Å²	139	52.3 Å²	52.3	64%	0.644	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-35.1	179.2	-166.1	81	0	0	0	114.4	D151 E208	H149-D151 VanDerWaalsContact C-N 3.27Å; H149-D151 PolarHBondContact O-N 2.9Å; H149-E208 VanDerWaalsContact CB-OE2 3.28Å; H149-E208 WeakPolarHBondContact CB-OE2 3.22Å; H149-E208 PolarHBondContact N-OE2 3.14Å
150	D	84.7	Confident	90.3	Very high	154 Å²	154	52 Å²	52	82%	0.824	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-17	-179.3	-63.2	-35.5	0	0	0	113.1	N148	N148-D150 PolarHBondContact O-N 2.93Å
151	D	87.3	Confident	90.3	Very high	33 Å²	33	56.4 Å²	56.4	18%	0.176	28%	0.276	C	S	.	.	S	Bend	trans	-79.3	142.4	-179.3	-61.3	-41.3	0	0	0	110.4	R147 N148 H149 H157	R147-D151 HydrophobicContact CG-CB 3.94Å; N148-D151 PolarHBondContact N-OD2 3.5Å; N148-D151 PolarHBondContact ND2-OD2 3.15Å; N148-D151 WeakPolarHBondContact O-CB 3.04Å; N148-D151 PolarHBondContact O-N 3.3Å; H149-D151 VanDerWaalsContact C-N 3.27Å; H149-D151 PolarHBondContact O-N 2.9Å; D151-H157 IonicContact OD1-CD2 3.99Å; D151-H157 IonicContact OD1-NE2 3.68Å; D151-H157 IonicContact OD2-CD2 2.87Å
152	P	85.6	Confident	90.3	Very high	84 Å²	84	56.1 Å²	56.1	55%	0.545	28%	0.276	S	S	.	.			trans	-55.3	143.4	175.6	-23.1	32.2	0	0	0	111.8	H154 V155	P152-H154 PolarHBondContact O-N 3.1Å; P152-V155 HydrophobicContact CB-CB 4.28Å; P152-V155 HydrophobicContact CB-CG2 3.92Å; P152-V155 HydrophobicContact CG-CB 4.45Å; P152-V155 HydrophobicContact CG-CG2 4.14Å; P152-V155 PolarHBondContact O-N 2.98Å
153	K	80.8	Confident	90.2	Very high	138 Å²	138	60.4 Å²	60.4	60%	0.6	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-22.9	-172	-69.4	-171.9	178.3	-173.8	0	116	P65	P65-K153 HydrophobicContact CG-CB 4.18Å; P65-K153 HydrophobicContact CG-CD 4.46Å
154	H	81.8	Confident	90.1	Very high	71 Å²	71	60.7 Å²	60.7	33%	0.329	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-4.2	-176.5	-48.2	-62.7	0	0	0	113.6	F62 S67 E69 P152	F62-H154 HydrophobicContact CZ-CB 4.11Å; F62-H154 AromaticContact CZ-ND1 3.7Å; S67-H154 VanDerWaalsContact CB-CE1 3.42Å; S67-H154 WeakPolarHBondContact CB-CE1 3.34Å; S67-H154 PolarHBondContact OG-CE1 2.85Å; S67-H154 VanDerWaalsContact OG-CE1 3.31Å; S67-H154 PolarHBondContact OG-ND1 2.88Å; E69-H154 HydrophobicContact CB-CB 4.41Å; E69-H154 WeakPolarHBondContact OE2-CB 3.25Å; E69-H154 IonicContact OE2-CD2 3.9Å; E69-H154 IonicContact OE2-CG 3.45Å; P152-H154 PolarHBondContact O-N 3.1Å
155	V	86.4	Confident	90	Very high	64 Å²	64	63.5 Å²	63.5	39%	0.388	32%	0.321	S	S	.	.			trans	-97.7	117.7	-176.4	178.3	0	0	0	0	109.2	P152	P152-V155 HydrophobicContact CB-CB 4.28Å; P152-V155 HydrophobicContact CB-CG2 3.92Å; P152-V155 HydrophobicContact CG-CB 4.45Å; P152-V155 HydrophobicContact CG-CG2 4.14Å; P152-V155 PolarHBondContact O-N 2.98Å
156	W	91	Very high	89.9	Confident	14 Å²	14	63.7 Å²	63.7	5%	0.053	32%	0.321	C	S	.	.			trans	-109.9	130.8	173.9	-70.4	88.7	0	0	0	109.8	W60 F62 R147 E209 L211	W60-W156 HydrophobicContact CB-CB 4.27Å; W60-W156 HydrophobicContact CD2-CB 4.02Å; W60-W156 HydrophobicContact CG-CB 3.78Å; W60-W156 HydrophobicContact CG-CG 4.47Å; W60-W156 PolarHBondContact NE1-O 3.38Å; F62-W156 AromaticContact CD1-CD1 3.9Å; F62-W156 AromaticContact CD1-NE1 3.7Å; F62-W156 AromaticContact CG-NE1 3.72Å; R147-W156 HydrophobicContact CB-CD2 4.22Å; R147-W156 HydrophobicContact CB-CE3 3.73Å; R147-W156 HydrophobicContact CB-CH2 4.02Å; R147-W156 HydrophobicContact CB-CZ2 4.49Å; R147-W156 HydrophobicContact CB-CZ3 3.61Å; W156-E209 HydrophobicContact CH2-CB 4.04Å; W156-E209 HydrophobicContact CZ3-CB 4.24Å; W156-L211 HydrophobicContact CB-CD2 4.43Å; W156-L211 HydrophobicContact CD2-CB 3.82Å; W156-L211 HydrophobicContact CD2-CD2 3.59Å; W156-L211 HydrophobicContact CD2-CG 4.36Å; W156-L211 HydrophobicContact CE3-CB 3.44Å; W156-L211 VanDerWaalsContact CE3-CB 3.44Å; W156-L211 HydrophobicContact CE3-CD2 4.11Å; W156-L211 HydrophobicContact CE3-CG 4.44Å; W156-L211 HydrophobicContact CG-CD2 3.73Å; W156-L211 HydrophobicContact CH2-CB 3.79Å; W156-L211 HydrophobicContact CZ2-CB 4.12Å; W156-L211 HydrophobicContact CZ2-CD2 4.35Å; W156-L211 HydrophobicContact CZ3-CB 3.43Å; W156-L211 VanDerWaalsContact CZ3-CB 3.43Å
157	H	92.9	Very high	89.7	Confident	68 Å²	68	63.8 Å²	63.8	32%	0.315	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.1	177.1	-68.6	-70.1	0	0	0	110.2	G145 Y146 D151 L159	G145-H157 CarbonylContact C-O 3.49Å; G145-H157 WeakPolarHBondContact CA-O 2.87Å; Y146-H157 HydrophobicContact CD1-CB 4.02Å; Y146-H157 HydrophobicContact CD2-CB 4.16Å; Y146-H157 HydrophobicContact CE1-CB 3.55Å; Y146-H157 HydrophobicContact CE2-CB 3.68Å; Y146-H157 HydrophobicContact CG-CB 4.32Å; Y146-H157 PolarHBondContact N-O 2.95Å; Y146-H157 PolarHBondContact O-N 2.93Å; D151-H157 IonicContact OD1-CD2 3.99Å; D151-H157 IonicContact OD1-NE2 3.68Å; D151-H157 IonicContact OD2-CD2 2.87Å; H157-L159 PolarHBondContact O-N 3.13Å
158	E	92.6	Very high	89.4	Confident	93 Å²	93	62.5 Å²	62.5	44%	0.435	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.9	179.4	-169.2	165.6	108.7	0	0	110.8	W60 R143	W60-E158 HydrophobicContact CH2-CG 4.45Å; W60-E158 HydrophobicContact CZ2-CB 3.82Å; W60-E158 HydrophobicContact CZ2-CG 3.92Å; R143-E158 IonicContact CZ-OE2 3.09Å; R143-E158 IonicContact NE-OE2 2.86Å; R143-E158 PolarHBondContact NE-OE2 3.23Å; R143-E158 VanDerWaalsContact NE-OE2 3.14Å; R143-E158 IonicContact NH2-OE2 2.64Å; R143-E158 PolarHBondContact NH2-OE2 2.84Å
159	L	92.2	Very high	89.2	Confident	65 Å²	65	66 Å²	66	34%	0.34	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-48.3	172.9	-170	65.4	0	0	0	110.6	L144 Y146 H157 L202 Y210	L144-L159 HydrophobicContact CD2-CD2 3.88Å; L144-L159 HydrophobicContact CG-CB 4.42Å; L144-L159 HydrophobicContact CG-CD2 4.22Å; L144-L159 WeakPolarHBondContact O-CA 3.5Å; L144-L159 WeakPolarHBondContact O-CB 3.32Å; L144-L159 PolarHBondContact O-N 3.24Å; Y146-L159 HydrophobicContact CD1-CB 4.13Å; Y146-L159 HydrophobicContact CD1-CD1 4.11Å; Y146-L159 HydrophobicContact CE1-CD1 4.36Å; H157-L159 PolarHBondContact O-N 3.13Å; L159-L202 HydrophobicContact CD2-CD1 4.23Å; L159-L202 HydrophobicContact CD2-CD2 3.78Å; L159-Y210 HydrophobicContact CD2-CE1 4.32Å
160	A	92.8	Very high	89.3	Confident	14 Å²	14	59.6 Å²	59.6	12%	0.116	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.9	179.9	0	0	0	0	0	111.4	L144 P390 F391	L144-A160 PolarHBondContact N-O 3.26Å; L144-A160 PolarHBondContact O-N 3.24Å; L144-A160 VanDerWaalsContact O-N 3.13Å; A160-P390 HydrophobicContact CB-CG 3.48Å; A160-P390 VanDerWaalsContact CB-CG 3.48Å; A160-F391 HydrophobicContact CB-CD2 4.25Å; A160-F391 HydrophobicContact CB-CE2 3.71Å
161	R	94.1	Very high	89.3	Confident	95 Å²	95	55.3 Å²	55.3	36%	0.358	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.4	170.8	173.4	171.9	-170.8	-171.1	0	109.7	L58 D141 L142 R143	L58-R161 VanDerWaalsContact CD2-NH1 3.31Å; D141-R161 IonicContact OD1-NE 3.57Å; D141-R161 IonicContact OD1-NH2 2.82Å; D141-R161 IonicContact OD2-NH2 3.64Å; D141-R161 PolarHBondContact OD2-NH2 3.07Å; L142-R161 WeakPolarHBondContact O-CA 3.34Å; R143-R161 HydrophobicContact CG-CB 4.15Å; R143-R161 HydrophobicContact CG-CG 3.76Å
162	S	93.6	Very high	88.9	Confident	15 Å²	15	54 Å²	54	11%	0.105	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	147.3	175.5	57.6	0	0	0	0	111.6	L142 E164 F391	L142-S162 PolarHBondContact N-O 2.84Å; L142-S162 PolarHBondContact O-N 3.32Å; S162-E164 WeakPolarHBondContact CB-OE1 3.37Å; S162-E164 WeakPolarHBondContact OG-CG 3.3Å; S162-E164 PolarHBondContact OG-OE1 3.28Å; S162-F391 WeakPolarHBondContact OG-CB 3.35Å; S162-F391 WeakPolarHBondContact OG-CD2 3.33Å; S162-F391 WeakPolarHBondContact OG-CG 3.42Å
163	V	93.5	Very high	88.4	Confident	90 Å²	90	52.5 Å²	52.5	55%	0.545	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118	167.7	-179.1	0	0	0	0	107.7	T139 F140 D141	T139-V163 HydrophobicContact CG2-CG1 3.51Å; F140-V163 CarbonylContact O-C 3.59Å; F140-V163 VanDerWaalsContact O-CA 3.27Å; F140-V163 WeakPolarHBondContact O-CA 3.37Å; D141-V163 HydrophobicContact CB-CG2 4.22Å
164	E	92.8	Very high	88.1	Confident	19 Å²	19	55.7 Å²	55.7	9%	0.089	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.8	-168.6	-70.4	-65.1	155.2	0	0	110.5	F140 L142 S162 R166 N389 F391	F140-E164 PolarHBondContact N-O 3.46Å; F140-E164 PolarHBondContact O-N 2.7Å; L142-E164 HydrophobicContact CD1-CB 4.1Å; L142-E164 HydrophobicContact CD1-CG 4.07Å; S162-E164 WeakPolarHBondContact CB-OE1 3.37Å; S162-E164 WeakPolarHBondContact OG-CG 3.3Å; S162-E164 PolarHBondContact OG-OE1 3.28Å; E164-R166 IonicContact OE2-CZ 3.32Å; E164-R166 IonicContact OE2-NH1 2.61Å; E164-R166 PolarHBondContact OE2-NH1 2.97Å; E164-R166 IonicContact OE2-NH2 2.98Å; E164-N389 PolarHBondContact OE1-ND2 3.44Å; E164-F391 HydrophobicContact CG-CB 3.72Å
165	V	92	Very high	87.5	Confident	58 Å²	58	57.7 Å²	57.7	35%	0.352	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138.7	174	-175.1	0	0	0	0	108.7	E137 I138 T139 S396	E137-V165 HydrophobicContact CB-CG1 3.9Å; E137-V165 HydrophobicContact CG-CG1 4.34Å; I138-V165 CarbonylContact O-C 3.49Å; I138-V165 WeakPolarHBondContact O-CA 3.44Å; T139-V165 HydrophobicContact CG2-CG2 4.24Å; V165-S396 WeakPolarHBondContact O-CB 3.35Å
166	R	91.8	Very high	86.5	Confident	5 Å²	5	54.9 Å²	54.9	2%	0.019	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.2	176.9	-64	-63.9	-178.1	-95.2	-5.1	110.8	E137 I138 F140 E164 L168 L197 P198 F391	E137-R166 WeakPolarHBondContact CA-O 3.4Å; I138-R166 HydrophobicContact CG2-CB 4.03Å; I138-R166 PolarHBondContact N-O 3.4Å; I138-R166 PolarHBondContact O-N 2.9Å; F140-R166 HydrophobicContact CD2-CG 4.07Å; F140-R166 HydrophobicContact CE2-CB 4.12Å; F140-R166 HydrophobicContact CE2-CG 3.93Å; E164-R166 IonicContact OE2-CZ 3.32Å; E164-R166 IonicContact OE2-NH1 2.61Å; E164-R166 PolarHBondContact OE2-NH1 2.97Å; E164-R166 IonicContact OE2-NH2 2.98Å; R166-L168 PolarHBondContact O-N 3.38Å; R166-L197 HydrophobicContact CB-CD1 4.46Å; R166-L197 HydrophobicContact CB-CD2 4.38Å; R166-P198 PolarHBondContact NE-O 3.47Å; R166-P198 VanDerWaalsContact NE-O 3.08Å; R166-P198 PolarHBondContact NH2-O 2.93Å; R166-F391 PolarHBondContact NH2-O 2.93Å
167	P	89.3	Confident	85.4	Confident	54 Å²	54	58.4 Å²	58.4	35%	0.351	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126	169.8	29.7	-32.4	0	0	0	109	L197	P167-L197 WeakPolarHBondContact O-CD2 3.46Å
168	L	87.5	Confident	84.2	Confident	1 Å²	1	65 Å²	65	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116	176	-174.4	69.3	0	0	0	108.4	L123 I125 T136 I138 R166 C170 L197	L123-L168 HydrophobicContact CD1-CD1 3.94Å; I125-L168 HydrophobicContact CD1-CD1 4.28Å; I125-L168 HydrophobicContact CD1-CD2 3.69Å; T136-L168 WeakPolarHBondContact O-CB 3.38Å; T136-L168 PolarHBondContact O-N 3.41Å; I138-L168 HydrophobicContact CG2-CB 4.36Å; R166-L168 PolarHBondContact O-N 3.38Å; L168-C170 VanDerWaalsContact CD1-SG 3.53Å; L168-C170 WeakPolarHBondContact CG-SG 3.47Å; L168-L197 HydrophobicContact CD1-CD1 4.34Å
169	K	86.4	Confident	82.8	Confident	112 Å²	112	64.1 Å²	64.1	49%	0.487	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	110.2	172.2	-65	-168.5	-146	135.9	0	108.8	C194 E195	K169-C194 WeakPolarHBondContact O-CA 3.39Å; K169-E195 HydrophobicContact CB-CG 4.24Å; K169-E195 WeakPolarHBondContact CD-OE2 3.24Å; K169-E195 IonicContact NZ-OE1 3.98Å; K169-E195 PolarHBondContact NZ-OE1 2.87Å; K169-E195 IonicContact NZ-OE2 3.73Å; K169-E195 PolarHBondContact NZ-OE2 3.39Å; K169-E195 PolarHBondContact O-N 2.8Å
170	C	86.2	Confident	81.3	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130	-178.1	-63.1	0	0	0	0	110	L133 L168 Y192 D193 C194	L133-C170 HydrophobicContact CB-CB 4.27Å; L133-C170 HydrophobicContact CD1-CB 4.33Å; L168-C170 VanDerWaalsContact CD1-SG 3.53Å; L168-C170 WeakPolarHBondContact CG-SG 3.47Å; C170-Y192 HydrophobicContact CB-CD1 4.17Å; C170-Y192 HydrophobicContact CB-CG 4.23Å; C170-D193 WeakPolarHBondContact CA-O 3.45Å; C170-C194 HydrophobicContact CB-CB 4.13Å; C170-C194 WeakPolarHBondContact CB-SG 3.45Å; C170-C194 WeakPolarHBondContact SG-CB 3.43Å; C170-C194 CovalentContact SG-SG 2.04Å; C170-C194 PolarHBondContact SG-SG 2.98Å
171	T	84.3	Confident	79.6	Confident	63 Å²	63	69.3 Å²	69.3	39%	0.387	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	153.6	174.5	66.8	0	0	0	0	109.9	D193	T171-D193 PolarHBondContact N-O 3.44Å; T171-D193 PolarHBondContact O-N 3.33Å; T171-D193 PolarHBondContact OG1-O 3.19Å
172	L	79.2	Confident	77.9	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	134.6	172.5	-66.5	165.5	0	0	0	109	Q127 E132 K177 Y192	Q127-L172 VanDerWaalsContact CD-CD2 3.42Å; Q127-L172 HydrophobicContact CG-CD2 4.19Å; E132-L172 HydrophobicContact CG-CD1 3.99Å; E132-L172 HydrophobicContact CG-CG 3.91Å; L172-K177 HydrophobicContact CB-CD 4.32Å; L172-K177 HydrophobicContact CB-CG 3.7Å; L172-K177 VanDerWaalsContact O-CE 3.27Å; L172-K177 WeakPolarHBondContact O-CE 3.31Å; L172-Y192 HydrophobicContact CD2-CD1 4.08Å; L172-Y192 HydrophobicContact CD2-CE1 3.55Å; L172-Y192 HydrophobicContact CG-CE1 4.3Å
173	D	75.2	Confident	76	Confident	53 Å²	53	75 Å²	75	28%	0.283	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-53.9	146.3	174.9	-176.7	22.6	0	0	0	110.7	E175 A176 K177	D173-E175 PolarHBondContact O-N 3.07Å; D173-A176 HydrophobicContact CB-CB 4.33Å; D173-A176 PolarHBondContact O-N 2.87Å; D173-A176 VanDerWaalsContact O-N 3.15Å; D173-K177 PolarHBondContact O-N 3.48Å
174	R	74.2	Confident	74.1	Confident	206 Å²	206	77.5 Å²	77.5	78%	0.777	39%	0.393	S	S	*	.	H	α-helix	trans	-58.2	-33.2	-175.9	-69.5	-179.3	172	178.9	-0.1	111.7	R178	R174-R178 PolarHBondContact O-N 3.12Å
175	E	70	Confident	72.2	Confident	113 Å²	113	77 Å²	77	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-74.2	-44.1	178	-60.3	-168.1	168.5	0	0	111.6	D173 K177 R178 H179 F190	D173-E175 PolarHBondContact O-N 3.07Å; E175-K177 VanDerWaalsContact C-N 3.32Å; E175-K177 PolarHBondContact O-N 3.25Å; E175-R178 WeakPolarHBondContact O-CB 3.35Å; E175-R178 PolarHBondContact O-N 2.96Å; E175-R178 VanDerWaalsContact O-N 3.08Å; E175-H179 PolarHBondContact O-N 3.25Å; E175-H179 PolarHBondContact O-ND1 3.07Å; E175-F190 HydrophobicContact CB-CE1 3.99Å
176	A	65.2	Low	70.4	Confident	5 Å²	5	77.2 Å²	77.2	4%	0.041	39%	0.391	C	S	.	.	H	α-helix	trans	-60	-39.7	173.5	0	0	0	0	0	112.2	D173 R178 H179 Q180 F190	D173-A176 HydrophobicContact CB-CB 4.33Å; D173-A176 PolarHBondContact O-N 2.87Å; D173-A176 VanDerWaalsContact O-N 3.15Å; A176-R178 VanDerWaalsContact C-N 3.27Å; A176-R178 PolarHBondContact O-N 3.19Å; A176-H179 CarbonylContact O-C 3.12Å; A176-H179 PolarHBondContact O-N 3.06Å; A176-H179 VanDerWaalsContact O-N 3.09Å; A176-Q180 PolarHBondContact O-N 3.21Å; A176-F190 HydrophobicContact CB-CB 3.97Å; A176-F190 HydrophobicContact CB-CD1 4.17Å; A176-F190 HydrophobicContact CB-CD2 4.07Å; A176-F190 HydrophobicContact CB-CG 3.8Å
177	K	67.7	Low	68.7	Low	88 Å²	88	83.9 Å²	83.9	38%	0.383	43%	0.427	S	S	.	.	H	α-helix	trans	-59.9	-34.8	174.5	-76.2	-173.6	178.1	-174.3	0	112.8	E132 L172 D173 E175 H179 Q180	E132-K177 WeakPolarHBondContact OE1-CE 3.34Å; E132-K177 IonicContact OE1-NZ 3.7Å; E132-K177 PolarHBondContact OE1-NZ 3.06Å; L172-K177 HydrophobicContact CB-CD 4.32Å; L172-K177 HydrophobicContact CB-CG 3.7Å; L172-K177 VanDerWaalsContact O-CE 3.27Å; L172-K177 WeakPolarHBondContact O-CE 3.31Å; D173-K177 PolarHBondContact O-N 3.48Å; E175-K177 VanDerWaalsContact C-N 3.32Å; E175-K177 PolarHBondContact O-N 3.25Å; K177-H179 VanDerWaalsContact C-N 3.3Å; K177-H179 PolarHBondContact O-N 3.4Å; K177-Q180 WeakPolarHBondContact O-CB 3.34Å
178	R	67.2	Low	67.2	Low	205 Å²	205	87 Å²	87	77%	0.774	44%	0.436	S	S	*	.	H	α-helix	trans	-69.9	-30.3	176.5	-71.2	176.8	178.3	165.7	1.1	112.3	R174 E175 A176	R174-R178 PolarHBondContact O-N 3.12Å; E175-R178 WeakPolarHBondContact O-CB 3.35Å; E175-R178 PolarHBondContact O-N 2.96Å; E175-R178 VanDerWaalsContact O-N 3.08Å; A176-R178 VanDerWaalsContact C-N 3.27Å; A176-R178 PolarHBondContact O-N 3.19Å
179	H	63.8	Low	66.2	Low	76 Å²	76	88 Å²	88	35%	0.352	45%	0.447	S	S	.	.	H	α-helix	trans	-97.1	5.4	-177	-62.9	66.4	0	0	0	112.7	E175 A176 K177 G181 H182 A185	E175-H179 PolarHBondContact O-N 3.25Å; E175-H179 PolarHBondContact O-ND1 3.07Å; A176-H179 CarbonylContact O-C 3.12Å; A176-H179 PolarHBondContact O-N 3.06Å; A176-H179 VanDerWaalsContact O-N 3.09Å; K177-H179 VanDerWaalsContact C-N 3.3Å; K177-H179 PolarHBondContact O-N 3.4Å; H179-G181 PolarHBondContact O-N 2.9Å; H179-H182 PolarHBondContact O-N 3.02Å; H179-A185 HydrophobicContact CB-CB 3.51Å; H179-A185 WeakPolarHBondContact O-CB 3.48Å
180	Q	59.7	Low	65.7	Low	113 Å²	113	83.9 Å²	83.9	53%	0.528	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-5	-175.6	-160.1	172.6	9.1	0	0	115.2	A176 K177	A176-Q180 PolarHBondContact O-N 3.21Å; K177-Q180 WeakPolarHBondContact O-CB 3.34Å
181	G	57.4	Low	65.6	Low	75 Å²	75	87.8 Å²	87.8	77%	0.773	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-1.4	173.4	0	0	0	0	0	116.1	H179	H179-G181 PolarHBondContact O-N 2.9Å
182	H	59	Low	65.6	Low	136 Å²	136	85.3 Å²	85.3	63%	0.63	43%	0.427	S	S	*	.			trans	-106.5	121.5	180	-69	64.4	0	0	0	109.2	H179 H184 A185	H179-H182 PolarHBondContact O-N 3.02Å; H182-H184 PolarHBondContact O-N 2.9Å; H182-A185 VanDerWaalsContact O-CB 3.26Å; H182-A185 WeakPolarHBondContact O-CB 3.31Å; H182-A185 PolarHBondContact O-N 3.48Å
183	A	53.8	Low	65.9	Low	93 Å²	93	89.8 Å²	89.8	77%	0.769	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-57.8	-23.5	-177.6	0	0	0	0	0	113.6
184	H	53.1	Low	66.5	Low	143 Å²	143	88.4 Å²	88.4	66%	0.662	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-80.8	-13.9	177.7	-67.9	-69.6	0	0	0	114.3	H182 L186 D187	H182-H184 PolarHBondContact O-N 2.9Å; H184-L186 PolarHBondContact O-N 3.32Å; H184-D187 PolarHBondContact O-N 2.97Å; H184-D187 VanDerWaalsContact O-N 3.16Å
185	A	52.4	Low	67.2	Low	8 Å²	8	83.9 Å²	83.9	7%	0.066	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-65.1	-26.7	-176.3	0	0	0	0	0	113.1	H179 H182 D187 E188 F190	H179-A185 HydrophobicContact CB-CB 3.51Å; H179-A185 WeakPolarHBondContact O-CB 3.48Å; H182-A185 VanDerWaalsContact O-CB 3.26Å; H182-A185 WeakPolarHBondContact O-CB 3.31Å; H182-A185 PolarHBondContact O-N 3.48Å; A185-D187 VanDerWaalsContact C-N 3.33Å; A185-E188 PolarHBondContact O-N 2.93Å; A185-F190 WeakPolarHBondContact O-CD2 3.43Å; A185-F190 VanDerWaalsContact O-CE2 3.23Å; A185-F190 WeakPolarHBondContact O-CE2 3.35Å
186	L	55.8	Low	68.2	Low	63 Å²	63	82.8 Å²	82.8	33%	0.33	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-74.5	-23.8	178.7	-71.6	162.5	0	0	0	113	Q127 S130 H184 E188	Q127-L186 HydrophobicContact CG-CD2 4.02Å; S130-L186 WeakPolarHBondContact OG-CD1 3.34Å; H184-L186 PolarHBondContact O-N 3.32Å; L186-E188 VanDerWaalsContact C-N 3.33Å
187	D	54.6	Low	69.6	Low	145 Å²	145	83.1 Å²	83.1	78%	0.775	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-15.2	178	-108.5	-0.9	0	0	0	112.3	H184 A185 G189	H184-D187 PolarHBondContact O-N 2.97Å; H184-D187 VanDerWaalsContact O-N 3.16Å; A185-D187 VanDerWaalsContact C-N 3.33Å; D187-G189 PolarHBondContact O-N 3.26Å; D187-G189 VanDerWaalsContact O-N 3.1Å
188	E	57.8	Low	70.8	Confident	119 Å²	119	81.6 Å²	81.6	56%	0.556	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	8.7	-176.5	-70.6	-177	170.4	0	0	113.9	A185 L186 F190	A185-E188 PolarHBondContact O-N 2.93Å; L186-E188 VanDerWaalsContact C-N 3.33Å; E188-F190 HydrophobicContact CB-CD2 4.1Å; E188-F190 HydrophobicContact CB-CE2 3.56Å; E188-F190 HydrophobicContact CB-CZ 4.09Å; E188-F190 PolarHBondContact O-N 3.47Å; E188-F190 WeakPolarHBondContact OE2-CE2 3.42Å; E188-F190 WeakPolarHBondContact OE2-CZ 3.36Å
189	G	66.8	Low	72	Confident	21 Å²	21	72.1 Å²	72.1	22%	0.216	40%	0.399	C	S	.	.			trans	70	29	169.5	0	0	0	0	0	114.7	D187 Y191	D187-G189 PolarHBondContact O-N 3.26Å; D187-G189 VanDerWaalsContact O-N 3.1Å; G189-Y191 WeakPolarHBondContact O-CD2 3.38Å; G189-Y191 WeakPolarHBondContact O-CE2 3.46Å
190	F	76.8	Confident	73.4	Confident	27 Å²	27	68.7 Å²	68.7	12%	0.118	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-63.5	144.5	174.5	-63.6	-73.6	0	0	0	111.9	Q127 E175 A176 A185 E188	Q127-F190 VanDerWaalsContact CB-O 3.32Å; Q127-F190 WeakPolarHBondContact CB-O 3.4Å; Q127-F190 PolarHBondContact N-O 3.39Å; E175-F190 HydrophobicContact CB-CE1 3.99Å; A176-F190 HydrophobicContact CB-CB 3.97Å; A176-F190 HydrophobicContact CB-CD1 4.17Å; A176-F190 HydrophobicContact CB-CD2 4.07Å; A176-F190 HydrophobicContact CB-CG 3.8Å; A185-F190 WeakPolarHBondContact O-CD2 3.43Å; A185-F190 VanDerWaalsContact O-CE2 3.23Å; A185-F190 WeakPolarHBondContact O-CE2 3.35Å; E188-F190 HydrophobicContact CB-CD2 4.1Å; E188-F190 HydrophobicContact CB-CE2 3.56Å; E188-F190 HydrophobicContact CB-CZ 4.09Å; E188-F190 PolarHBondContact O-N 3.47Å; E188-F190 WeakPolarHBondContact OE2-CE2 3.42Å; E188-F190 WeakPolarHBondContact OE2-CZ 3.36Å
191	Y	83.5	Confident	75	Confident	87 Å²	87	64.1 Å²	64.1	34%	0.341	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-100.8	153.6	174.3	-66.2	-89.4	0	0	0	110.6	D124 I125 K126 G189 Q232	D124-Y191 HydrophobicContact CB-CD1 4.03Å; D124-Y191 HydrophobicContact CB-CE1 4.16Å; I125-Y191 CarbonylContact O-C 3.5Å; I125-Y191 WeakPolarHBondContact O-CA 3.32Å; K126-Y191 HydrophobicContact CB-CE1 4.35Å; G189-Y191 WeakPolarHBondContact O-CD2 3.38Å; G189-Y191 WeakPolarHBondContact O-CE2 3.46Å; Y191-Q232 HydrophobicContact CE1-CB 4Å; Y191-Q232 HydrophobicContact CE1-CG 3.76Å
192	Y	83.9	Confident	76.6	Confident	11 Å²	11	61.2 Å²	61.2	4%	0.043	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141.9	167.1	-76	-78.8	0	0	0	111	I125 Q127 Y129 K131 L133 C170 L172 C194	I125-Y192 HydrophobicContact CB-CD2 4.04Å; I125-Y192 HydrophobicContact CG2-CD2 3.82Å; I125-Y192 HydrophobicContact CG2-CE2 4.33Å; I125-Y192 WeakPolarHBondContact O-CD2 3.37Å; I125-Y192 PolarHBondContact O-N 3.48Å; Q127-Y192 HydrophobicContact CB-CD2 4.45Å; Q127-Y192 HydrophobicContact CB-CE2 4.13Å; Q127-Y192 HydrophobicContact CG-CE2 4.08Å; Y129-Y192 PolarHBondContact O-OH 2.88Å; K131-Y192 PolarHBondContact O-OH 3.25Å; L133-Y192 HydrophobicContact CD1-CD1 4.36Å; L133-Y192 HydrophobicContact CD1-CD2 4Å; L133-Y192 HydrophobicContact CD1-CE1 4.08Å; L133-Y192 HydrophobicContact CD1-CE2 3.69Å; L133-Y192 HydrophobicContact CD1-CG 4.31Å; C170-Y192 HydrophobicContact CB-CD1 4.17Å; C170-Y192 HydrophobicContact CB-CG 4.23Å; L172-Y192 HydrophobicContact CD2-CD1 4.08Å; L172-Y192 HydrophobicContact CD2-CE1 3.55Å; L172-Y192 HydrophobicContact CG-CE1 4.3Å; Y192-C194 PolarHBondContact O-N 2.7Å
193	D	85.4	Confident	77.9	Confident	98 Å²	98	55.7 Å²	55.7	52%	0.524	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	101.3	169.1	-176.7	12.6	0	0	0	108.8	C170 T171	C170-D193 WeakPolarHBondContact CA-O 3.45Å; T171-D193 PolarHBondContact N-O 3.44Å; T171-D193 PolarHBondContact O-N 3.33Å; T171-D193 PolarHBondContact OG1-O 3.19Å
194	C	88.6	Confident	79.5	Confident	25 Å²	25	52 Å²	52	17%	0.169	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143.2	-172.5	-62.7	0	0	0	0	112.6	K169 C170 Y192	K169-C194 WeakPolarHBondContact O-CA 3.39Å; C170-C194 HydrophobicContact CB-CB 4.13Å; C170-C194 WeakPolarHBondContact CB-SG 3.45Å; C170-C194 WeakPolarHBondContact SG-CB 3.43Å; C170-C194 CovalentContact SG-SG 2.04Å; C170-C194 PolarHBondContact SG-SG 2.98Å; Y192-C194 PolarHBondContact O-N 2.7Å
195	E	89.1	Confident	81.3	Confident	110 Å²	110	45.4 Å²	45.4	51%	0.514	25%	0.245	S	C	.	.			trans	-62.7	141.8	171.2	-72.7	-177.8	179.8	0	0	111	K169	K169-E195 HydrophobicContact CB-CG 4.24Å; K169-E195 WeakPolarHBondContact CD-OE2 3.24Å; K169-E195 IonicContact NZ-OE1 3.98Å; K169-E195 PolarHBondContact NZ-OE1 2.87Å; K169-E195 IonicContact NZ-OE2 3.73Å; K169-E195 PolarHBondContact NZ-OE2 3.39Å; K169-E195 PolarHBondContact O-N 2.8Å
196	V	91.6	Very high	83.1	Confident	91 Å²	91	46.6 Å²	46.6	55%	0.552	25%	0.25	S	C	*	.			trans	-63.6	137.5	175.4	-60	0	0	0	0	111.4	V120 M122	V120-V196 HydrophobicContact CG1-CB 3.84Å; V120-V196 HydrophobicContact CG1-CG2 4.19Å; M122-V196 HydrophobicContact CG-CG1 4.04Å; M122-V196 HydrophobicContact SD-CG1 4.33Å
197	L	92.6	Very high	84.8	Confident	11 Å²	11	44.4 Å²	44.4	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	-175.4	-57.6	174.3	0	0	0	111	V120 L121 L123 I138 F140 R166 P167 L168 L199	V120-L197 WeakPolarHBondContact CG1-O 3.34Å; L121-L197 HydrophobicContact CB-CB 4.22Å; L121-L197 PolarHBondContact N-O 3.17Å; L121-L197 PolarHBondContact O-N 2.99Å; L123-L197 HydrophobicContact CD1-CD1 3.77Å; L123-L197 HydrophobicContact CG-CD1 4.34Å; I138-L197 HydrophobicContact CG2-CD1 4.33Å; F140-L197 HydrophobicContact CE2-CD1 4.18Å; F140-L197 HydrophobicContact CZ-CD1 4.19Å; R166-L197 HydrophobicContact CB-CD1 4.46Å; R166-L197 HydrophobicContact CB-CD2 4.38Å; P167-L197 WeakPolarHBondContact O-CD2 3.46Å; L168-L197 HydrophobicContact CD1-CD1 4.34Å; L197-L199 PolarHBondContact O-N 2.95Å
198	P	93	Very high	86.6	Confident	56 Å²	56	40.6 Å²	40.6	36%	0.364	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	123.8	174.6	28.1	-33.2	0	0	0	110.1	R166	R166-P198 PolarHBondContact NE-O 3.47Å; R166-P198 VanDerWaalsContact NE-O 3.08Å; R166-P198 PolarHBondContact NH2-O 2.93Å
199	L	93.1	Very high	88.3	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-67.1	-176.2	-175.6	71.6	0	0	0	111.4	G119 L142 L197 L212 L214 M236 F391	G119-L199 VanDerWaalsContact O-CB 3.3Å; G119-L199 WeakPolarHBondContact O-CB 3.36Å; G119-L199 PolarHBondContact O-N 3.05Å; L142-L199 HydrophobicContact CD1-CD1 3.6Å; L142-L199 HydrophobicContact CD2-CD1 3.83Å; L142-L199 HydrophobicContact CG-CD1 4.39Å; L197-L199 PolarHBondContact O-N 2.95Å; L199-L212 HydrophobicContact CD2-CD2 3.47Å; L199-L212 VanDerWaalsContact CD2-CD2 3.47Å; L199-L214 HydrophobicContact CD1-CD1 4.46Å; L199-M236 HydrophobicContact CD2-CG 4.27Å; L199-M236 HydrophobicContact CD2-SD 4.08Å; L199-F391 WeakPolarHBondContact O-CA 3.43Å; L199-F391 WeakPolarHBondContact O-CD1 3.09Å
200	F	94.1	Very high	89.6	Confident	5 Å²	5	35.6 Å²	35.6	2%	0.022	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.3	178.9	67.8	-100.8	0	0	0	112.5	F99 V117 G119 L202 M236 P390 F391	F99-F200 HydrophobicContact CE1-CZ 4.13Å; F99-F200 HydrophobicContact CZ-CE1 4.49Å; F99-F200 HydrophobicContact CZ-CE2 4.39Å; F99-F200 AromaticContact CZ-CZ 3.68Å; F99-F200 HydrophobicContact CZ-CZ 3.68Å; V117-F200 HydrophobicContact CG1-CE2 4.03Å; V117-F200 HydrophobicContact CG1-CZ 4.45Å; G119-F200 PolarHBondContact N-O 3.04Å; G119-F200 PolarHBondContact O-N 2.98Å; F200-L202 HydrophobicContact CD2-CD1 4.48Å; F200-L202 HydrophobicContact CD2-CD2 4.49Å; F200-L202 HydrophobicContact CD2-CG 3.87Å; F200-L202 HydrophobicContact CE2-CD1 4.14Å; F200-L202 HydrophobicContact CE2-CG 3.97Å; F200-M236 HydrophobicContact CE1-SD 4.16Å; F200-P390 CarbonylContact C-O 3.59Å; F200-P390 VanDerWaalsContact CA-O 3.25Å; F200-P390 WeakPolarHBondContact CA-O 3.46Å; F200-F391 HydrophobicContact CB-CD1 3.66Å; F200-F391 HydrophobicContact CB-CE1 3.98Å; F200-F391 HydrophobicContact CB-CG 4.41Å; F200-F391 HydrophobicContact CD1-CE1 4.26Å; F200-F391 HydrophobicContact CG-CE1 4.5Å
201	T	92.6	Very high	90.4	Very high	17 Å²	17	34.3 Å²	34.3	10%	0.104	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	120.2	163.9	-60	0	0	0	0	110.2	I118 L312 R383 P390	I118-T201 HydrophobicContact CG1-CG2 4.28Å; T201-L312 HydrophobicContact CG2-CD2 4.24Å; T201-R383 PolarHBondContact OG1-NH1 2.86Å; T201-P390 PolarHBondContact N-O 3.08Å
202	L	91.6	Very high	91	Very high	14 Å²	14	30.1 Å²	30.1	7%	0.073	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.6	169.6	-59.1	179.6	0	0	0	109.6	Q116 V117 L144 L159 F200 S204 Y210 P390	Q116-L202 WeakPolarHBondContact CA-O 3.25Å; V117-L202 HydrophobicContact CB-CB 4.27Å; V117-L202 HydrophobicContact CB-CD1 4.41Å; V117-L202 PolarHBondContact N-O 2.82Å; V117-L202 VanDerWaalsContact N-O 3.09Å; V117-L202 PolarHBondContact O-N 3.14Å; L144-L202 HydrophobicContact CD2-CD1 4.14Å; L144-L202 HydrophobicContact CD2-CD2 3.87Å; L144-L202 HydrophobicContact CD2-CG 4.34Å; L159-L202 HydrophobicContact CD2-CD1 4.23Å; L159-L202 HydrophobicContact CD2-CD2 3.78Å; F200-L202 HydrophobicContact CD2-CD1 4.48Å; F200-L202 HydrophobicContact CD2-CD2 4.49Å; F200-L202 HydrophobicContact CD2-CG 3.87Å; F200-L202 HydrophobicContact CE2-CD1 4.14Å; F200-L202 HydrophobicContact CE2-CG 3.97Å; L202-S204 VanDerWaalsContact C-N 3.29Å; L202-S204 PolarHBondContact O-N 3.35Å; L202-Y210 HydrophobicContact CD1-CD1 4.26Å; L202-Y210 HydrophobicContact CD1-CE1 3.9Å; L202-P390 HydrophobicContact CD2-CB 3.84Å; L202-P390 HydrophobicContact CD2-CG 4.35Å
203	A	85.8	Confident	91.5	Very high	19 Å²	19	29.9 Å²	29.9	16%	0.157	16%	0.163	C	C	.	.	S	Bend	trans	-76.2	-16.3	178.1	0	0	0	0	0	113.7	Q115 S309 L312	Q115-A203 CarbonylContact O-C 3.54Å; A203-S309 WeakPolarHBondContact CB-O 3.2Å; A203-L312 HydrophobicContact CB-CB 3.89Å
204	S	88.2	Confident	92	Very high	17 Å²	17	25.2 Å²	25.2	12%	0.119	14%	0.138	C	C	.	.			trans	-144.2	125.3	-178.2	45.2	0	0	0	0	110.8	Q115 L202 H206 N307	Q115-S204 CarbonylContact O-C 3.58Å; Q115-S204 WeakPolarHBondContact O-CA 3.27Å; Q115-S204 PolarHBondContact O-N 2.81Å; L202-S204 VanDerWaalsContact C-N 3.29Å; L202-S204 PolarHBondContact O-N 3.35Å; S204-H206 PolarHBondContact O-N 3.03Å; S204-N307 WeakPolarHBondContact CB-OD1 3.4Å; S204-N307 PolarHBondContact OG-OD1 3.45Å
205	C	90.4	Very high	92.2	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.02	14%	0.135	C	C	.	.			trans	-87.6	83.2	169.1	-168.5	0	0	0	0	107.9	R112 F114 Q115 V117	R112-C205 VanDerWaalsContact CA-O 3.26Å; R112-C205 WeakPolarHBondContact CA-O 3.42Å; F114-C205 HydrophobicContact CB-CB 3.98Å; Q115-C205 PolarHBondContact O-N 3.43Å; V117-C205 HydrophobicContact CG2-CB 3.79Å
206	H	89.7	Confident	92.4	Very high	34 Å²	34	20.7 Å²	20.7	16%	0.157	11%	0.114	C	C	.	.			trans	-92.7	-34.4	-173.5	-165.6	72.8	0	0	0	113.9	R112 S204 Y210 N307	R112-H206 VanDerWaalsContact CZ-CE1 3.44Å; S204-H206 PolarHBondContact O-N 3.03Å; H206-Y210 PolarHBondContact N-OH 2.92Å; H206-Y210 VanDerWaalsContact N-OH 3.08Å; H206-N307 HydrophobicContact CB-CB 4.03Å
207	H	92.1	Very high	92.5	Very high	16 Å²	16	18.3 Å²	18.3	7%	0.074	10%	0.1	C	C	.	.	S	Bend	trans	-96.7	161.3	-175.7	-54.4	-64.9	0	0	0	112.2	M110 Y146 N148 Y210	M110-H207 WeakPolarHBondContact CB-O 3.3Å; Y146-H207 AromaticContact CD1-CD2 3.74Å; Y146-H207 AromaticContact CD1-NE2 3.72Å; Y146-H207 HydrophobicContact CD2-CB 4.05Å; Y146-H207 AromaticContact CD2-CD2 3.64Å; Y146-H207 AromaticContact CD2-CE1 3.45Å; Y146-H207 VanDerWaalsContact CD2-CE1 3.45Å; Y146-H207 WeakPolarHBondContact CD2-CE1 3.43Å; Y146-H207 AromaticContact CD2-CG 3.36Å; Y146-H207 AromaticContact CD2-ND1 3.26Å; Y146-H207 VanDerWaalsContact CD2-ND1 3.26Å; Y146-H207 WeakPolarHBondContact CD2-ND1 3.32Å; Y146-H207 AromaticContact CD2-NE2 3.73Å; Y146-H207 AromaticContact CE1-NE2 3.8Å; Y146-H207 AromaticContact CE2-CE1 3.35Å; Y146-H207 WeakPolarHBondContact CE2-CE1 3.34Å; Y146-H207 AromaticContact CE2-ND1 3.55Å; Y146-H207 AromaticContact CE2-NE2 3.84Å; Y146-H207 HydrophobicContact CG-CB 4.13Å; Y146-H207 AromaticContact CG-CD2 3.36Å; Y146-H207 AromaticContact CG-CE1 3.9Å; Y146-H207 AromaticContact CG-CG 3.49Å; Y146-H207 VanDerWaalsContact CG-CG 3.49Å; Y146-H207 AromaticContact CG-ND1 3.85Å; Y146-H207 AromaticContact CG-NE2 3.67Å; Y146-H207 AromaticContact CZ-CE1 3.68Å; Y146-H207 AromaticContact CZ-NE2 3.85Å; N148-H207 WeakPolarHBondContact OD1-CA 3.47Å; N148-H207 WeakPolarHBondContact OD1-CB 3.48Å; N148-H207 PolarHBondContact OD1-ND1 3.18Å; H207-Y210 HydrophobicContact CB-CE1 4.17Å; H207-Y210 HydrophobicContact CB-CE2 4.29Å; H207-Y210 PolarHBondContact N-OH 2.88Å; H207-Y210 VanDerWaalsContact O-CE2 3.28Å; H207-Y210 WeakPolarHBondContact O-CE2 3.48Å; H207-Y210 PolarHBondContact O-OH 3.49Å
208	E	91.8	Very high	92.3	Very high	65 Å²	65	20 Å²	20	30%	0.304	11%	0.112	S	C	.	.	S	Bend	trans	-86	-32.1	-173.4	-66.4	173.4	167.7	0	0	112.9	P100 H109 M110 H149	P100-E208 WeakPolarHBondContact CD-O 3.47Å; H109-E208 HydrophobicContact CB-CB 4.22Å; M110-E208 WeakPolarHBondContact CB-O 3.34Å; M110-E208 PolarHBondContact N-O 2.84Å; H149-E208 VanDerWaalsContact CB-OE2 3.28Å; H149-E208 WeakPolarHBondContact CB-OE2 3.22Å; H149-E208 PolarHBondContact N-OE2 3.14Å
209	E	92.9	Very high	92.2	Very high	33 Å²	33	19.8 Å²	19.8	15%	0.154	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.6	178.9	-63	-179.9	-167.4	0	0	111.1	H109 Y146 R147 W156	H109-E209 IonicContact CE1-OE1 2.76Å; H109-E209 IonicContact ND1-OE1 3.75Å; Y146-E209 VanDerWaalsContact CA-O 3.27Å; Y146-E209 WeakPolarHBondContact CA-O 3.14Å; R147-E209 HydrophobicContact CB-CB 4.35Å; R147-E209 IonicContact CZ-OE1 3.81Å; R147-E209 IonicContact CZ-OE2 3.94Å; R147-E209 PolarHBondContact N-O 3.5Å; R147-E209 IonicContact NE-OE2 3.43Å; R147-E209 PolarHBondContact NE-OE2 3.28Å; R147-E209 IonicContact NH2-OE1 3.83Å; R147-E209 PolarHBondContact NH2-OE1 2.96Å; R147-E209 IonicContact NH2-OE2 3.66Å; R147-E209 PolarHBondContact NH2-OE2 3.18Å; R147-E209 PolarHBondContact O-N 3.06Å; R147-E209 VanDerWaalsContact O-N 3.12Å; W156-E209 HydrophobicContact CH2-CB 4.04Å; W156-E209 HydrophobicContact CZ3-CB 4.24Å
210	Y	94.7	Very high	91.9	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.008	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145	177.5	-62.9	-91.7	0	0	0	110.8	Q98 F99 M110 G145 L159 L202 H206 H207	Q98-Y210 WeakPolarHBondContact CA-O 3.18Å; F99-Y210 HydrophobicContact CD2-CD2 4.05Å; F99-Y210 HydrophobicContact CD2-CG 4.32Å; F99-Y210 VanDerWaalsContact CE2-CB 3.43Å; F99-Y210 AromaticContact CE2-CD2 3.59Å; F99-Y210 HydrophobicContact CE2-CD2 3.59Å; F99-Y210 AromaticContact CE2-CG 3.62Å; F99-Y210 HydrophobicContact CE2-CG 3.62Å; F99-Y210 HydrophobicContact CZ-CD1 4.43Å; F99-Y210 HydrophobicContact CZ-CD2 4.2Å; F99-Y210 AromaticContact CZ-CG 3.73Å; F99-Y210 HydrophobicContact CZ-CG 3.73Å; F99-Y210 PolarHBondContact N-O 3.22Å; F99-Y210 PolarHBondContact O-N 2.73Å; M110-Y210 HydrophobicContact CB-CE2 4.25Å; M110-Y210 HydrophobicContact CG-CD2 4.29Å; M110-Y210 HydrophobicContact CG-CE2 4.26Å; G145-Y210 WeakPolarHBondContact O-CA 3.43Å; L159-Y210 HydrophobicContact CD2-CE1 4.32Å; L202-Y210 HydrophobicContact CD1-CD1 4.26Å; L202-Y210 HydrophobicContact CD1-CE1 3.9Å; H206-Y210 PolarHBondContact N-OH 2.92Å; H206-Y210 VanDerWaalsContact N-OH 3.08Å; H207-Y210 HydrophobicContact CB-CE1 4.17Å; H207-Y210 HydrophobicContact CB-CE2 4.29Å; H207-Y210 PolarHBondContact N-OH 2.88Å; H207-Y210 VanDerWaalsContact O-CE2 3.28Å; H207-Y210 WeakPolarHBondContact O-CE2 3.48Å; H207-Y210 PolarHBondContact O-OH 3.49Å
211	L	94.7	Very high	91.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.4	178.8	175.3	70.6	0	0	0	108.9	W60 H61 F62 I96 A97 Q98 L144 G145 W156	W60-L211 HydrophobicContact CB-CD2 4.28Å; W60-L211 HydrophobicContact CD2-CD2 4.27Å; W60-L211 HydrophobicContact CE3-CD2 3.61Å; W60-L211 HydrophobicContact CE3-CG 4.23Å; W60-L211 HydrophobicContact CZ3-CD2 4.34Å; H61-L211 WeakPolarHBondContact O-CD2 3.45Å; F62-L211 HydrophobicContact CB-CD1 4.04Å; F62-L211 HydrophobicContact CB-CD2 3.93Å; I96-L211 HydrophobicContact CG2-CD1 3.51Å; A97-L211 WeakPolarHBondContact O-CA 3.22Å; Q98-L211 HydrophobicContact CG-CD1 3.51Å; L144-L211 CarbonylContact C-O 3.54Å; L144-L211 WeakPolarHBondContact CA-O 3.48Å; G145-L211 PolarHBondContact N-O 3.44Å; G145-L211 PolarHBondContact O-N 3.46Å; W156-L211 HydrophobicContact CB-CD2 4.43Å; W156-L211 HydrophobicContact CD2-CB 3.82Å; W156-L211 HydrophobicContact CD2-CD2 3.59Å; W156-L211 HydrophobicContact CD2-CG 4.36Å; W156-L211 HydrophobicContact CE3-CB 3.44Å; W156-L211 VanDerWaalsContact CE3-CB 3.44Å; W156-L211 HydrophobicContact CE3-CD2 4.11Å; W156-L211 HydrophobicContact CE3-CG 4.44Å; W156-L211 HydrophobicContact CG-CD2 3.73Å; W156-L211 HydrophobicContact CH2-CB 3.79Å; W156-L211 HydrophobicContact CZ2-CB 4.12Å; W156-L211 HydrophobicContact CZ2-CD2 4.35Å; W156-L211 HydrophobicContact CZ3-CB 3.43Å; W156-L211 VanDerWaalsContact CZ3-CB 3.43Å
212	L	95.4	Very high	91.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.2	172.8	177.2	78.9	0	0	0	109.3	M47 I96 A97 R143 L144 L199 M236 F391	M47-L212 HydrophobicContact CE-CD2 3.83Å; M47-L212 HydrophobicContact CE-CG 4.37Å; I96-L212 WeakPolarHBondContact CA-O 3.47Å; A97-L212 HydrophobicContact CB-CB 4.26Å; A97-L212 HydrophobicContact CB-CD2 4.47Å; A97-L212 PolarHBondContact N-O 2.97Å; A97-L212 PolarHBondContact O-N 2.97Å; R143-L212 WeakPolarHBondContact O-CA 3.3Å; L144-L212 HydrophobicContact CB-CD1 4.48Å; L144-L212 HydrophobicContact CD1-CB 4.41Å; L199-L212 HydrophobicContact CD2-CD2 3.47Å; L199-L212 VanDerWaalsContact CD2-CD2 3.47Å; L212-M236 HydrophobicContact CD2-SD 3.62Å; L212-F391 HydrophobicContact CD1-CE1 3.97Å; L212-F391 HydrophobicContact CD1-CZ 4.27Å
213	N	94.8	Very high	91.2	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.027	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.3	168.6	-70.6	-2.6	0	0	0	108.8	W60 H61 V94 R143	W60-N213 HydrophobicContact CZ3-CB 4.46Å; H61-N213 PolarHBondContact N-ND2 3.39Å; H61-N213 PolarHBondContact O-ND2 3.38Å; H61-N213 PolarHBondContact O-OD1 3.18Å; V94-N213 HydrophobicContact CG1-CB 3.94Å; R143-N213 HydrophobicContact CB-CB 4.36Å; R143-N213 PolarHBondContact N-O 2.71Å; R143-N213 PolarHBondContact O-N 3.11Å
214	L	95.1	Very high	91.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.6	179.2	-179.8	157.5	0	0	0	108.5	M47 F95 L121 F140 L142 L199 I216	M47-L214 HydrophobicContact CE-CB 3.8Å; M47-L214 HydrophobicContact CE-CD1 4.49Å; M47-L214 HydrophobicContact SD-CD1 4.33Å; F95-L214 HydrophobicContact CB-CB 4.25Å; F95-L214 HydrophobicContact CB-CD2 4.16Å; F95-L214 HydrophobicContact CD2-CD2 3.82Å; F95-L214 HydrophobicContact CG-CD2 4.32Å; F95-L214 PolarHBondContact N-O 3.32Å; F95-L214 PolarHBondContact O-N 2.92Å; L121-L214 HydrophobicContact CD1-CD1 3.96Å; L121-L214 HydrophobicContact CD2-CD1 4.01Å; F140-L214 HydrophobicContact CD1-CD1 4.07Å; F140-L214 HydrophobicContact CD1-CD2 3.9Å; F140-L214 HydrophobicContact CD1-CG 4.05Å; F140-L214 HydrophobicContact CE1-CD1 4.4Å; F140-L214 HydrophobicContact CE1-CD2 4.3Å; L142-L214 HydrophobicContact CD2-CB 3.87Å; L142-L214 HydrophobicContact CD2-CD1 3.66Å; L142-L214 HydrophobicContact CD2-CG 3.59Å; L199-L214 HydrophobicContact CD1-CD1 4.46Å; L214-I216 HydrophobicContact CD2-CD1 3.97Å; L214-I216 HydrophobicContact CD2-CG1 3.55Å
215	R	93.9	Very high	91.3	Very high	24 Å²	24	53.4 Å²	53.4	9%	0.091	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145	169.8	-59.4	-174.4	-172.5	-138.9	4.3	109.4	D52 D56 H61 V94 F140 D141 P217	D52-R215 IonicContact OD2-CZ 2.79Å; D52-R215 VanDerWaalsContact OD2-CZ 3.25Å; D52-R215 IonicContact OD2-NH1 3.43Å; D52-R215 PolarHBondContact OD2-NH1 2.61Å; D52-R215 IonicContact OD2-NH2 3.97Å; D52-R215 PolarHBondContact OD2-NH2 3.47Å; D56-R215 PolarHBondContact O-NH2 3.03Å; H61-R215 PolarHBondContact NE2-NH2 2.91Å; V94-R215 HydrophobicContact CB-CG 4.38Å; V94-R215 HydrophobicContact CG1-CG 4.08Å; V94-R215 HydrophobicContact CG2-CG 3.95Å; F140-R215 WeakPolarHBondContact CA-O 3.4Å; D141-R215 HydrophobicContact CB-CB 4.27Å; D141-R215 PolarHBondContact N-O 2.97Å; D141-R215 PolarHBondContact O-N 3.24Å; R215-P217 VanDerWaalsContact O-CD 3.27Å; R215-P217 WeakPolarHBondContact O-CD 3.35Å
216	I	93.1	Very high	91	Very high	17 Å²	17	57.1 Å²	57.1	9%	0.087	27%	0.267	C	S	.	.			trans	-114.1	83.8	175.9	-52.6	-178.1	0	0	0	107	F95 I138 F140 L214 V218 N225 I231	F95-I216 HydrophobicContact CD2-CD1 4.32Å; F95-I216 HydrophobicContact CD2-CG1 4.43Å; F95-I216 HydrophobicContact CE2-CD1 3.86Å; F95-I216 HydrophobicContact CE2-CG1 4.23Å; I138-I216 HydrophobicContact CD1-CG2 4.3Å; I138-I216 HydrophobicContact CG1-CG2 4.37Å; F140-I216 HydrophobicContact CD1-CD1 4.45Å; F140-I216 HydrophobicContact CD1-CG1 3.99Å; F140-I216 HydrophobicContact CE1-CD1 4.05Å; F140-I216 HydrophobicContact CE1-CG1 4.09Å; L214-I216 HydrophobicContact CD2-CD1 3.97Å; L214-I216 HydrophobicContact CD2-CG1 3.55Å; I216-V218 PolarHBondContact O-N 3.49Å; I216-N225 HydrophobicContact CG2-CB 4.35Å; I216-N225 VanDerWaalsContact CG2-ND2 3.34Å; I216-N225 WeakPolarHBondContact CG2-ND2 3.44Å; I216-I231 HydrophobicContact CD1-CD1 3.62Å; I216-I231 HydrophobicContact CG2-CD1 4.36Å
217	P	92	Very high	90.4	Very high	40 Å²	40	57.3 Å²	57.3	26%	0.26	28%	0.279	S	S	.	.			trans	-69.3	133.6	-173.5	27.4	-35.4	0	0	0	111.6	N91 R215 N225	N91-P217 WeakPolarHBondContact OD1-CA 3.41Å; R215-P217 VanDerWaalsContact O-CD 3.27Å; R215-P217 WeakPolarHBondContact O-CD 3.35Å; P217-N225 WeakPolarHBondContact O-CB 3.32Å; P217-N225 PolarHBondContact O-ND2 2.86Å
218	V	90.2	Very high	89.8	Confident	48 Å²	48	57.1 Å²	57.1	29%	0.291	28%	0.278	S	S	.	.			trans	-104.2	124.1	173.5	-176.5	0	0	0	0	108.9	A90 N91 I216 N225	A90-V218 HydrophobicContact CB-CG2 3.77Å; N91-V218 PolarHBondContact ND2-O 3.42Å; N91-V218 VanDerWaalsContact ND2-O 3.13Å; N91-V218 PolarHBondContact OD1-N 3.28Å; N91-V218 PolarHBondContact OD1-O 2.87Å; I216-V218 PolarHBondContact O-N 3.49Å; V218-N225 HydrophobicContact CG2-CB 4.36Å
219	D	89.7	Confident	89.1	Confident	51 Å²	51	55 Å²	55	27%	0.273	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-134.1	101.7	173.1	-177.2	-11.2	0	0	0	109.5	K221 R222 K223 I224	D219-K221 VanDerWaalsContact C-N 3.26Å; D219-K221 PolarHBondContact O-N 3.29Å; D219-K221 WeakPolarHBondContact OD1-CB 3.42Å; D219-K221 PolarHBondContact OD1-N 2.97Å; D219-R222 HydrophobicContact CB-CB 4.31Å; D219-R222 PolarHBondContact O-N 2.99Å; D219-R222 PolarHBondContact OD1-N 3.39Å; D219-R222 WeakPolarHBondContact OD2-CD 3.24Å; D219-R222 VanDerWaalsContact OD2-CG 3.23Å; D219-R222 WeakPolarHBondContact OD2-CG 3.37Å; D219-R222 IonicContact OD2-NE 3.62Å; D219-K223 CarbonylContact O-C 3.55Å; D219-K223 WeakPolarHBondContact O-CA 3.28Å; D219-K223 PolarHBondContact O-N 3.42Å; D219-I224 HydrophobicContact CB-CB 4.19Å; D219-I224 HydrophobicContact CB-CD1 4.36Å; D219-I224 PolarHBondContact N-O 3.23Å; D219-I224 VanDerWaalsContact N-O 3.17Å; D219-I224 PolarHBondContact O-N 3.04Å
220	E	87.4	Confident	88.6	Confident	160 Å²	160	54.4 Å²	54.4	75%	0.748	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.6	179.6	-63.9	-173.5	166	0	0	113	K223 V226	E220-K223 PolarHBondContact O-N 2.87Å; E220-V226 HydrophobicContact CG-CG2 4.41Å
221	K	90	Very high	88.3	Confident	200 Å²	200	55.2 Å²	55.2	87%	0.87	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-39.3	-178.6	-63	178.7	-179.5	173.6	0	110.9	D219	D219-K221 VanDerWaalsContact C-N 3.26Å; D219-K221 PolarHBondContact O-N 3.29Å; D219-K221 WeakPolarHBondContact OD1-CB 3.42Å; D219-K221 PolarHBondContact OD1-N 2.97Å
222	R	87.5	Confident	88	Confident	191 Å²	191	55.3 Å²	55.3	72%	0.721	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-3.3	176.6	-64.7	-176.8	-177.4	-177	1.2	113.2	D219 I224	D219-R222 HydrophobicContact CB-CB 4.31Å; D219-R222 PolarHBondContact O-N 2.99Å; D219-R222 PolarHBondContact OD1-N 3.39Å; D219-R222 WeakPolarHBondContact OD2-CD 3.24Å; D219-R222 VanDerWaalsContact OD2-CG 3.23Å; D219-R222 WeakPolarHBondContact OD2-CG 3.37Å; D219-R222 IonicContact OD2-NE 3.62Å; R222-I224 HydrophobicContact CB-CD1 3.67Å; R222-I224 HydrophobicContact CB-CG1 3.71Å; R222-I224 HydrophobicContact CG-CD1 4.44Å; R222-I224 PolarHBondContact O-N 3.33Å
223	K	86	Confident	87.7	Confident	175 Å²	175	56.6 Å²	56.6	76%	0.761	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	35.3	-172.9	-56.4	-177.1	177.9	-176.8	0	112.8	D219 E220	D219-K223 CarbonylContact O-C 3.55Å; D219-K223 WeakPolarHBondContact O-CA 3.28Å; D219-K223 PolarHBondContact O-N 3.42Å; E220-K223 PolarHBondContact O-N 2.87Å
224	I	88.1	Confident	87.7	Confident	46 Å²	46	56.3 Å²	56.3	24%	0.236	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-85.7	126.9	178.1	-61.7	171.7	0	0	0	108.6	T139 D219 R222 V226	T139-I224 HydrophobicContact CG2-CG2 4.28Å; D219-I224 HydrophobicContact CB-CB 4.19Å; D219-I224 HydrophobicContact CB-CD1 4.36Å; D219-I224 PolarHBondContact N-O 3.23Å; D219-I224 VanDerWaalsContact N-O 3.17Å; D219-I224 PolarHBondContact O-N 3.04Å; R222-I224 HydrophobicContact CB-CD1 3.67Å; R222-I224 HydrophobicContact CB-CG1 3.71Å; R222-I224 HydrophobicContact CG-CD1 4.44Å; R222-I224 PolarHBondContact O-N 3.33Å; I224-V226 PolarHBondContact O-N 2.84Å; I224-V226 VanDerWaalsContact O-N 3.15Å
225	N	88.3	Confident	87.7	Confident	11 Å²	11	60 Å²	60	6%	0.059	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	26.7	179.4	-63.3	-25.7	0	0	0	114.6	I138 T139 I216 P217 V218	I138-N225 WeakPolarHBondContact CA-OD1 3.48Å; T139-N225 PolarHBondContact N-OD1 3.37Å; T139-N225 PolarHBondContact O-ND2 3.41Å; I216-N225 HydrophobicContact CG2-CB 4.35Å; I216-N225 VanDerWaalsContact CG2-ND2 3.34Å; I216-N225 WeakPolarHBondContact CG2-ND2 3.44Å; P217-N225 WeakPolarHBondContact O-CB 3.32Å; P217-N225 PolarHBondContact O-ND2 2.86Å; V218-N225 HydrophobicContact CG2-CB 4.36Å
226	V	83.6	Confident	87.7	Confident	81 Å²	81	58.8 Å²	58.8	49%	0.491	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	127.1	175.3	-176.2	0	0	0	0	109.4	E220 I224	E220-V226 HydrophobicContact CG-CG2 4.41Å; I224-V226 PolarHBondContact O-N 2.84Å; I224-V226 VanDerWaalsContact O-N 3.15Å
227	G	78.2	Confident	87.8	Confident	39 Å²	39	59 Å²	59	40%	0.402	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	16.9	175.3	0	0	0	0	0	115.5	G229	G227-G229 PolarHBondContact O-N 3.39Å
228	V	78.1	Confident	87.9	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.067	28%	0.283	C	S	.	.	S	Bend	trans	-72.5	-3.7	178.4	-63.5	0	0	0	0	114.2	T136 I231	T136-V228 HydrophobicContact CG2-CB 4.47Å; T136-V228 HydrophobicContact CG2-CG1 3.7Å; V228-I231 HydrophobicContact CG2-CD1 4.35Å
229	G	77.6	Confident	88.1	Confident	21 Å²	21	56.7 Å²	56.7	22%	0.216	28%	0.279	C	S	.	.			trans	93.7	-172.8	-169.8	0	0	0	0	0	112	G227	G227-G229 PolarHBondContact O-N 3.39Å
230	S	82.8	Confident	88.3	Confident	20 Å²	20	55.1 Å²	55.1	14%	0.14	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	102.3	174.2	-172.8	0	0	0	0	109	I125 K126 Q232	I125-S230 CarbonylContact C-O 3.59Å; K126-S230 PolarHBondContact N-O 2.91Å; S230-Q232 PolarHBondContact O-N 3.06Å; S230-Q232 PolarHBondContact OG-NE2 2.84Å
231	I	87.7	Confident	88.5	Confident	20 Å²	20	49.3 Å²	49.3	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	115.3	175.4	-56.2	174.1	0	0	0	106.8	I80 I125 I138 I216 V228 V234	I80-I231 WeakPolarHBondContact CD1-O 3.43Å; I125-I231 HydrophobicContact CG1-CG1 4.24Å; I138-I231 HydrophobicContact CD1-CD1 3.76Å; I216-I231 HydrophobicContact CD1-CD1 3.62Å; I216-I231 HydrophobicContact CG2-CD1 4.36Å; V228-I231 HydrophobicContact CG2-CD1 4.35Å; I231-V234 HydrophobicContact CG2-CG2 3.9Å
232	Q	87.8	Confident	88.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-53.5	-179.7	-64.9	-59.3	-22.4	0	0	110.9	K49 I80 D124 K126 Y191 S230	K49-Q232 WeakPolarHBondContact CE-O 3.47Å; K49-Q232 PolarHBondContact NZ-O 2.99Å; I80-Q232 VanDerWaalsContact CD1-O 3.27Å; I80-Q232 WeakPolarHBondContact CD1-O 3.42Å; I80-Q232 WeakPolarHBondContact CG1-O 3.28Å; D124-Q232 PolarHBondContact O-N 3.45Å; K126-Q232 HydrophobicContact CB-CG 3.67Å; K126-Q232 HydrophobicContact CD-CG 4.47Å; Y191-Q232 HydrophobicContact CE1-CB 4Å; Y191-Q232 HydrophobicContact CE1-CG 3.76Å; S230-Q232 PolarHBondContact O-N 3.06Å; S230-Q232 PolarHBondContact OG-NE2 2.84Å
233	D	90.7	Very high	88.9	Confident	27 Å²	27	32.8 Å²	32.8	14%	0.144	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	154	-176.1	-73.5	-46.9	0	0	0	111.1	L46 K49 D124	L46-D233 HydrophobicContact CD1-CB 3.87Å; K49-D233 WeakPolarHBondContact CE-OD1 3.31Å; K49-D233 IonicContact NZ-OD1 3.85Å; K49-D233 PolarHBondContact NZ-OD1 2.75Å; D124-D233 HydrophobicContact CB-CB 4.16Å; D124-D233 PolarHBondContact N-O 3.23Å
234	V	93.3	Very high	89.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	115.2	179.5	-178.8	0	0	0	0	107.2	M47 F95 L121 L123 I231	M47-V234 HydrophobicContact CB-CB 4.37Å; M47-V234 VanDerWaalsContact CB-O 3.32Å; M47-V234 WeakPolarHBondContact CB-O 3.49Å; M47-V234 HydrophobicContact CG-CB 4.41Å; M47-V234 HydrophobicContact CG-CG1 4.19Å; M47-V234 VanDerWaalsContact CG-O 3.24Å; M47-V234 WeakPolarHBondContact CG-O 3.24Å; M47-V234 PolarHBondContact N-O 3.4Å; M47-V234 HydrophobicContact SD-CB 4.16Å; M47-V234 HydrophobicContact SD-CG1 3.44Å; M47-V234 WeakPolarHBondContact SD-CG1 3.45Å; F95-V234 HydrophobicContact CD1-CB 3.92Å; F95-V234 HydrophobicContact CD1-CG2 3.68Å; F95-V234 HydrophobicContact CD2-CG2 4.3Å; F95-V234 HydrophobicContact CE1-CB 4.25Å; F95-V234 HydrophobicContact CE1-CG2 3.6Å; F95-V234 HydrophobicContact CE2-CG2 4.25Å; F95-V234 HydrophobicContact CG-CB 4.33Å; F95-V234 HydrophobicContact CG-CG2 4.04Å; F95-V234 HydrophobicContact CZ-CG2 3.9Å; L121-V234 HydrophobicContact CD1-CG1 3.36Å; L121-V234 HydrophobicContact CD2-CG1 4.39Å; L121-V234 HydrophobicContact CG-CG1 4.02Å; L123-V234 HydrophobicContact CD2-CB 4.43Å; L123-V234 HydrophobicContact CD2-CG1 3.98Å; L123-V234 HydrophobicContact CD2-CG2 3.91Å; I231-V234 HydrophobicContact CG2-CG2 3.9Å
235	W	94.9	Very high	89.6	Confident	76 Å²	76	23.8 Å²	23.8	29%	0.288	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.6	176.6	-64.3	89.5	0	0	0	110	L46 L121 M122 D124	L46-W235 HydrophobicContact CB-CD2 4.37Å; L46-W235 HydrophobicContact CB-CE3 3.88Å; L46-W235 HydrophobicContact CB-CH2 3.91Å; L46-W235 HydrophobicContact CB-CZ2 4.39Å; L46-W235 HydrophobicContact CB-CZ3 3.64Å; L46-W235 HydrophobicContact CD1-CD2 3.97Å; L46-W235 HydrophobicContact CD1-CE3 4.35Å; L46-W235 HydrophobicContact CD1-CG 4.47Å; L46-W235 HydrophobicContact CD1-CH2 4.3Å; L46-W235 HydrophobicContact CD1-CZ2 3.92Å; L46-W235 HydrophobicContact CD2-CH2 4.32Å; L46-W235 HydrophobicContact CD2-CZ2 4.39Å; L46-W235 HydrophobicContact CG-CH2 4.4Å; L46-W235 HydrophobicContact CG-CZ2 4.46Å; L121-W235 CarbonylContact C-O 3.56Å; L121-W235 WeakPolarHBondContact CA-O 3.46Å; M122-W235 HydrophobicContact CB-CB 4.15Å; M122-W235 HydrophobicContact CE-CB 3.83Å; M122-W235 HydrophobicContact CE-CG 4.43Å; M122-W235 PolarHBondContact N-O 2.7Å; M122-W235 PolarHBondContact O-N 2.9Å; D124-W235 VanDerWaalsContact OD2-CD1 3.28Å; D124-W235 PolarHBondContact OD2-NE1 2.94Å
236	M	94.7	Very high	89.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125	170	-173.9	-174.6	75.1	0	0	109.1	I45 M47 A97 F99 V120 L199 F200 L212 E238	I45-M236 HydrophobicContact CB-CE 4.46Å; I45-M236 HydrophobicContact CD1-CE 3.76Å; I45-M236 PolarHBondContact N-O 3.34Å; I45-M236 PolarHBondContact O-N 3.38Å; M47-M236 HydrophobicContact CG-CB 4.38Å; M47-M236 HydrophobicContact SD-CB 4.45Å; A97-M236 HydrophobicContact CB-CE 3.66Å; A97-M236 HydrophobicContact CB-SD 3.97Å; F99-M236 HydrophobicContact CD1-CE 3.69Å; F99-M236 HydrophobicContact CE1-CE 4.04Å; F99-M236 HydrophobicContact CG-CE 4.41Å; V120-M236 CarbonylContact O-C 3.57Å; V120-M236 WeakPolarHBondContact O-CA 2.88Å; L199-M236 HydrophobicContact CD2-CG 4.27Å; L199-M236 HydrophobicContact CD2-SD 4.08Å; F200-M236 HydrophobicContact CE1-SD 4.16Å; L212-M236 HydrophobicContact CD2-SD 3.62Å; M236-E238 HydrophobicContact CE-CB 4.34Å
237	V	94.8	Very high	90.4	Very high	21 Å²	21	24.3 Å²	24.3	13%	0.127	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	112.8	169.1	-171.4	0	0	0	0	108.1	Q44 V120 M122 I239	Q44-V237 HydrophobicContact CG-CG1 4.49Å; Q44-V237 HydrophobicContact CG-CG2 4.26Å; V120-V237 PolarHBondContact N-O 2.74Å; V120-V237 PolarHBondContact O-N 3.11Å; M122-V237 HydrophobicContact CE-CG2 3.51Å; M122-V237 HydrophobicContact CG-CG2 4.35Å; M122-V237 HydrophobicContact SD-CG2 3.91Å; V237-I239 HydrophobicContact CG1-CG1 4.12Å
238	E	94.4	Very high	91.2	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.9	173.9	-173.6	-83.1	123.6	0	0	108.8	T42 D43 I45 F99 V117 M236 H240	T42-E238 CarbonylContact C-O 3.49Å; T42-E238 VanDerWaalsContact CA-O 3.28Å; T42-E238 WeakPolarHBondContact CA-O 3.37Å; D43-E238 HydrophobicContact CB-CB 4.47Å; D43-E238 PolarHBondContact N-O 3.19Å; D43-E238 PolarHBondContact O-N 2.84Å; I45-E238 HydrophobicContact CD1-CB 4.35Å; F99-E238 HydrophobicContact CD2-CG 3.97Å; F99-E238 HydrophobicContact CE2-CG 4.33Å; F99-E238 HydrophobicContact CG-CG 4.33Å; V117-E238 HydrophobicContact CG1-CG 4.03Å; M236-E238 HydrophobicContact CE-CB 4.34Å; E238-H240 VanDerWaalsContact OE1-CB 3.23Å; E238-H240 WeakPolarHBondContact OE1-CB 3.42Å; E238-H240 IonicContact OE1-CE1 2.84Å; E238-H240 IonicContact OE1-CG 3.92Å; E238-H240 PolarHBondContact OE1-N 3.4Å; E238-H240 IonicContact OE1-ND1 3.73Å; E238-H240 PolarHBondContact OE1-ND1 2.89Å; E238-H240 IonicContact OE2-CE1 3.46Å; E238-H240 PolarHBondContact OE2-CE1 3.36Å; E238-H240 IonicContact OE2-ND1 2.73Å; E238-H240 PolarHBondContact OE2-ND1 2.84Å
239	I	94.5	Very high	92	Very high	39 Å²	39	25.1 Å²	25.1	20%	0.2	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.9	179.7	-45.2	-179.5	0	0	0	108.5	N40 T41 T42 V117 I118 V120 V237	N40-I239 HydrophobicContact CB-CG2 4.21Å; T41-I239 WeakPolarHBondContact O-CA 3.28Å; T42-I239 HydrophobicContact CG2-CD1 4.47Å; T42-I239 HydrophobicContact CG2-CG1 4.06Å; T42-I239 HydrophobicContact CG2-CG2 4.16Å; V117-I239 CarbonylContact C-O 3.56Å; V117-I239 WeakPolarHBondContact CA-O 3.4Å; I118-I239 HydrophobicContact CB-CB 4.26Å; I118-I239 PolarHBondContact N-O 3.37Å; I118-I239 PolarHBondContact O-N 3.39Å; V120-I239 HydrophobicContact CG2-CD1 4.32Å; V237-I239 HydrophobicContact CG1-CG1 4.12Å
240	H	93.8	Very high	92.8	Very high	18 Å²	18	24.4 Å²	24.4	8%	0.083	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	156.4	175.4	57.7	-90	0	0	0	112.2	N40 T41 F114 Q116 V117 E238	N40-H240 CarbonylContact C-O 3.56Å; N40-H240 VanDerWaalsContact CA-O 3.3Å; N40-H240 WeakPolarHBondContact CA-O 3.41Å; T41-H240 PolarHBondContact N-O 3.49Å; T41-H240 PolarHBondContact O-N 2.89Å; T41-H240 VanDerWaalsContact O-N 3.07Å; F114-H240 HydrophobicContact CB-CB 4.17Å; F114-H240 AromaticContact CD1-CD2 3.79Å; F114-H240 AromaticContact CG-CD2 3.8Å; Q116-H240 VanDerWaalsContact O-CA 3.3Å; Q116-H240 WeakPolarHBondContact O-CA 3.05Å; V117-H240 HydrophobicContact CG2-CB 4.29Å; E238-H240 VanDerWaalsContact OE1-CB 3.23Å; E238-H240 WeakPolarHBondContact OE1-CB 3.42Å; E238-H240 IonicContact OE1-CE1 2.84Å; E238-H240 IonicContact OE1-CG 3.92Å; E238-H240 PolarHBondContact OE1-N 3.4Å; E238-H240 IonicContact OE1-ND1 3.73Å; E238-H240 PolarHBondContact OE1-ND1 2.89Å; E238-H240 IonicContact OE2-CE1 3.46Å; E238-H240 PolarHBondContact OE2-CE1 3.36Å; E238-H240 IonicContact OE2-ND1 2.73Å; E238-H240 PolarHBondContact OE2-ND1 2.84Å
241	Q	92.4	Very high	93.4	Very high	38 Å²	38	26.5 Å²	26.5	18%	0.178	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.3	171.6	-162.9	178.4	3.6	0	0	109.4	P39 F114 Q116 G243 F245	P39-Q241 WeakPolarHBondContact O-CA 3.41Å; P39-Q241 VanDerWaalsContact O-CG 3.3Å; P39-Q241 WeakPolarHBondContact O-CG 3.37Å; F114-Q241 VanDerWaalsContact CA-O 3.26Å; F114-Q241 WeakPolarHBondContact CA-O 3.34Å; F114-Q241 VanDerWaalsContact CD1-O 3.22Å; F114-Q241 WeakPolarHBondContact CD1-O 3.45Å; F114-Q241 WeakPolarHBondContact O-CB 3.27Å; F114-Q241 PolarHBondContact O-N 3.36Å; Q116-Q241 PolarHBondContact O-N 2.91Å; Q241-G243 PolarHBondContact O-N 3.23Å; Q241-F245 HydrophobicContact CG-CD1 4.35Å
242	N	93.2	Very high	93.8	Very high	38 Å²	38	26.1 Å²	26.1	20%	0.203	14%	0.137	C	C	.	.			trans	-69.7	124.5	179.8	-169.5	-33.7	0	0	0	110.2	P37 A38 P39 G244 F245 T246	P37-N242 HydrophobicContact CG-CB 4.4Å; A38-N242 WeakPolarHBondContact O-CB 3.12Å; P39-N242 PolarHBondContact O-N 3.06Å; N242-G244 PolarHBondContact O-N 3.48Å; N242-G244 VanDerWaalsContact O-N 3.16Å; N242-G244 PolarHBondContact OD1-N 3.45Å; N242-F245 HydrophobicContact CB-CB 4.21Å; N242-F245 WeakPolarHBondContact O-CA 3.35Å; N242-F245 WeakPolarHBondContact O-CB 3.49Å; N242-F245 PolarHBondContact O-N 3.4Å; N242-T246 PolarHBondContact O-N 2.97Å; N242-T246 PolarHBondContact O-OG1 3.29Å
243	G	92.5	Very high	94.1	Very high	6 Å²	6	26.3 Å²	26.3	6%	0.062	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-28.6	-177.9	0	0	0	0	0	113.7	Q241 K247	Q241-G243 PolarHBondContact O-N 3.23Å; G243-K247 WeakPolarHBondContact O-CG 3.38Å; G243-K247 PolarHBondContact O-N 3.42Å; G243-K247 VanDerWaalsContact O-N 3.1Å
244	G	93.5	Very high	94.4	Very high	26 Å²	26	28 Å²	28	27%	0.268	15%	0.149	S	C	.	.	H	α-helix	trans	-67.1	-42.2	172.6	0	0	0	0	0	112.3	N242 K247 V248	N242-G244 PolarHBondContact O-N 3.48Å; N242-G244 VanDerWaalsContact O-N 3.16Å; N242-G244 PolarHBondContact OD1-N 3.45Å; G244-K247 PolarHBondContact O-N 2.93Å; G244-V248 PolarHBondContact O-N 2.94Å
245	F	94.1	Very high	94.5	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-44.6	175.6	177.4	-93.7	0	0	0	110.7	A36 P37 P39 Q241 N242 K247 V248 W249 I500	A36-F245 HydrophobicContact CB-CD2 4Å; P37-F245 HydrophobicContact CG-CB 4.22Å; P39-F245 HydrophobicContact CB-CD1 4.07Å; P39-F245 HydrophobicContact CB-CD2 4.15Å; P39-F245 HydrophobicContact CB-CE1 4.07Å; P39-F245 HydrophobicContact CB-CE2 4.15Å; P39-F245 HydrophobicContact CB-CG 4.13Å; P39-F245 HydrophobicContact CB-CZ 4.12Å; Q241-F245 HydrophobicContact CG-CD1 4.35Å; N242-F245 HydrophobicContact CB-CB 4.21Å; N242-F245 WeakPolarHBondContact O-CA 3.35Å; N242-F245 WeakPolarHBondContact O-CB 3.49Å; N242-F245 PolarHBondContact O-N 3.4Å; F245-K247 VanDerWaalsContact C-N 3.33Å; F245-K247 PolarHBondContact O-N 3.2Å; F245-V248 PolarHBondContact O-N 2.87Å; F245-V248 VanDerWaalsContact O-N 3.16Å; F245-W249 HydrophobicContact CE1-CB 4.28Å; F245-W249 HydrophobicContact CE1-CG 4.42Å; F245-W249 HydrophobicContact CZ-CE3 4.26Å; F245-W249 WeakPolarHBondContact O-CB 3.31Å; F245-W249 PolarHBondContact O-N 3.48Å; F245-I500 HydrophobicContact CE2-CD1 4.49Å; F245-I500 HydrophobicContact CZ-CB 4.2Å; F245-I500 HydrophobicContact CZ-CD1 4.09Å; F245-I500 HydrophobicContact CZ-CG2 3.81Å
246	T	94.1	Very high	94.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.7	-43.7	176.7	-54.4	0	0	0	0	112.4	W113 Q115 N242 V248 W249 F250	W113-T246 HydrophobicContact CE3-CG2 4.06Å; W113-T246 WeakPolarHBondContact O-CB 3.2Å; W113-T246 WeakPolarHBondContact O-CG2 3.44Å; W113-T246 PolarHBondContact O-OG1 3.18Å; Q115-T246 HydrophobicContact CG-CG2 3.69Å; N242-T246 PolarHBondContact O-N 2.97Å; N242-T246 PolarHBondContact O-OG1 3.29Å; T246-V248 PolarHBondContact O-N 3.38Å; T246-W249 PolarHBondContact O-N 2.86Å; T246-F250 HydrophobicContact CG2-CD1 3.99Å; T246-F250 HydrophobicContact CG2-CD2 4.37Å; T246-F250 HydrophobicContact CG2-CE1 3.57Å; T246-F250 HydrophobicContact CG2-CE2 3.99Å; T246-F250 HydrophobicContact CG2-CG 4.36Å; T246-F250 HydrophobicContact CG2-CZ 3.55Å; T246-F250 WeakPolarHBondContact O-CB 2.96Å; T246-F250 WeakPolarHBondContact O-CD1 3.34Å; T246-F250 WeakPolarHBondContact O-CG 3.39Å; T246-F250 PolarHBondContact O-N 3.45Å
247	K	94.9	Very high	94.6	Very high	103 Å²	103	33.5 Å²	33.5	45%	0.448	18%	0.176	S	C	.	.	H	α-helix	trans	-59.1	-46	176.3	-76.1	173.3	-177.3	177.7	0	112.2	W113 G243 G244 F245 S251	W113-K247 HydrophobicContact CD2-CD 4.41Å; W113-K247 HydrophobicContact CD2-CG 3.81Å; W113-K247 HydrophobicContact CE3-CG 3.47Å; W113-K247 VanDerWaalsContact CE3-CG 3.47Å; W113-K247 HydrophobicContact CH2-CG 3.8Å; W113-K247 HydrophobicContact CZ2-CG 4.14Å; W113-K247 HydrophobicContact CZ3-CB 4.31Å; W113-K247 HydrophobicContact CZ3-CG 3.46Å; W113-K247 VanDerWaalsContact CZ3-CG 3.46Å; G243-K247 WeakPolarHBondContact O-CG 3.38Å; G243-K247 PolarHBondContact O-N 3.42Å; G243-K247 VanDerWaalsContact O-N 3.1Å; G244-K247 PolarHBondContact O-N 2.93Å; F245-K247 VanDerWaalsContact C-N 3.33Å; F245-K247 PolarHBondContact O-N 3.2Å; K247-S251 WeakPolarHBondContact O-CB 3.24Å; K247-S251 PolarHBondContact O-N 3.43Å; K247-S251 VanDerWaalsContact O-N 3.07Å; K247-S251 PolarHBondContact O-OG 3.47Å
248	V	95.5	Very high	94.7	Very high	20 Å²	20	35.9 Å²	35.9	12%	0.121	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-45.1	177.4	176.7	0	0	0	0	110.1	I31 I35 A36 G244 F245 T246 F250 S251 L252	I31-V248 HydrophobicContact CG2-CG1 3.54Å; I35-V248 HydrophobicContact CG2-CG2 4.11Å; A36-V248 HydrophobicContact CB-CB 4.08Å; A36-V248 HydrophobicContact CB-CG1 4.03Å; A36-V248 HydrophobicContact CB-CG2 4.09Å; G244-V248 PolarHBondContact O-N 2.94Å; F245-V248 PolarHBondContact O-N 2.87Å; F245-V248 VanDerWaalsContact O-N 3.16Å; T246-V248 PolarHBondContact O-N 3.38Å; V248-F250 PolarHBondContact O-N 2.84Å; V248-S251 WeakPolarHBondContact O-CB 3.36Å; V248-S251 PolarHBondContact O-N 3.44Å; V248-L252 HydrophobicContact CG1-CD1 4.07Å; V248-L252 HydrophobicContact CG1-CG 4.26Å; V248-L252 WeakPolarHBondContact O-CG 3.34Å; V248-L252 PolarHBondContact O-N 2.95Å
249	W	94.6	Very high	94.7	Very high	47 Å²	47	39.5 Å²	39.5	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-47.8	179.7	-172.9	-118.8	0	0	0	112.6	F245 T246 S251 L252 K253 I500 Y504	F245-W249 HydrophobicContact CE1-CB 4.28Å; F245-W249 HydrophobicContact CE1-CG 4.42Å; F245-W249 HydrophobicContact CZ-CE3 4.26Å; F245-W249 WeakPolarHBondContact O-CB 3.31Å; F245-W249 PolarHBondContact O-N 3.48Å; T246-W249 PolarHBondContact O-N 2.86Å; W249-S251 VanDerWaalsContact C-N 3.33Å; W249-S251 PolarHBondContact O-N 3.02Å; W249-L252 PolarHBondContact O-N 3.36Å; W249-K253 PolarHBondContact O-N 3.4Å; W249-I500 HydrophobicContact CE3-CG2 4.28Å; W249-I500 HydrophobicContact CH2-CG2 3.89Å; W249-I500 HydrophobicContact CZ3-CG2 3.63Å; W249-Y504 AromaticContact CH2-CD2 3.73Å; W249-Y504 HydrophobicContact CH2-CD2 3.73Å; W249-Y504 AromaticContact CH2-CG 3.8Å; W249-Y504 HydrophobicContact CH2-CG 3.8Å; W249-Y504 HydrophobicContact CZ2-CD2 4.37Å; W249-Y504 HydrophobicContact CZ3-CD1 4.38Å; W249-Y504 HydrophobicContact CZ3-CD2 4.24Å; W249-Y504 AromaticContact CZ3-CG 3.88Å; W249-Y504 HydrophobicContact CZ3-CG 3.88Å
250	F	94.5	Very high	94.8	Very high	5 Å²	5	37.8 Å²	37.8	2%	0.022	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177.4	-75.7	15.6	0	0	0	111.4	W113 Q115 T246 V248 K253 T254 E300 W301 L304	W113-F250 AromaticContact CZ3-CD2 4Å; W113-F250 HydrophobicContact CZ3-CD2 4Å; W113-F250 HydrophobicContact CZ3-CE2 4.37Å; Q115-F250 HydrophobicContact CG-CZ 4.24Å; T246-F250 HydrophobicContact CG2-CD1 3.99Å; T246-F250 HydrophobicContact CG2-CD2 4.37Å; T246-F250 HydrophobicContact CG2-CE1 3.57Å; T246-F250 HydrophobicContact CG2-CE2 3.99Å; T246-F250 HydrophobicContact CG2-CG 4.36Å; T246-F250 HydrophobicContact CG2-CZ 3.55Å; T246-F250 WeakPolarHBondContact O-CB 2.96Å; T246-F250 WeakPolarHBondContact O-CD1 3.34Å; T246-F250 WeakPolarHBondContact O-CG 3.39Å; T246-F250 PolarHBondContact O-N 3.45Å; V248-F250 PolarHBondContact O-N 2.84Å; F250-K253 PolarHBondContact O-N 2.94Å; F250-T254 WeakPolarHBondContact O-CB 3.02Å; F250-T254 PolarHBondContact O-N 3.27Å; F250-T254 PolarHBondContact O-OG1 3.22Å; F250-E300 HydrophobicContact CD1-CB 4.2Å; F250-E300 HydrophobicContact CE1-CB 3.43Å; F250-E300 VanDerWaalsContact CE1-CB 3.43Å; F250-E300 HydrophobicContact CE1-CG 4.19Å; F250-E300 HydrophobicContact CE2-CB 3.98Å; F250-E300 WeakPolarHBondContact CE2-O 3.33Å; F250-E300 HydrophobicContact CZ-CB 3.31Å; F250-E300 HydrophobicContact CZ-CG 4.43Å; F250-W301 HydrophobicContact CB-CZ2 3.69Å; F250-W301 AromaticContact CD2-CD2 3.98Å; F250-W301 HydrophobicContact CD2-CD2 3.98Å; F250-W301 AromaticContact CD2-CE2 3.96Å; F250-W301 HydrophobicContact CD2-CE3 4.39Å; F250-W301 HydrophobicContact CD2-CG 4.23Å; F250-W301 HydrophobicContact CD2-CZ2 4.36Å; F250-L304 HydrophobicContact CE2-CD1 4.3Å; F250-L304 HydrophobicContact CE2-CG 4.36Å
251	S	95.4	Very high	94.9	Very high	65 Å²	65	39.8 Å²	39.8	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-63	-42.2	176.1	-58	0	0	0	0	111.8	K247 V248 W249 T254 F255	K247-S251 WeakPolarHBondContact O-CB 3.24Å; K247-S251 PolarHBondContact O-N 3.43Å; K247-S251 VanDerWaalsContact O-N 3.07Å; K247-S251 PolarHBondContact O-OG 3.47Å; V248-S251 WeakPolarHBondContact O-CB 3.36Å; V248-S251 PolarHBondContact O-N 3.44Å; W249-S251 VanDerWaalsContact C-N 3.33Å; W249-S251 PolarHBondContact O-N 3.02Å; S251-T254 PolarHBondContact O-N 3.41Å; S251-F255 WeakPolarHBondContact O-CB 3.48Å; S251-F255 PolarHBondContact O-N 3.38Å
252	L	95.4	Very high	95.2	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-41.5	176.3	-71.7	175.9	0	0	0	112	F28 I31 V248 W249 S256 T501 Y504	F28-L252 HydrophobicContact CD1-CD2 3.88Å; F28-L252 HydrophobicContact CE1-CD2 3.81Å; I31-L252 HydrophobicContact CD1-CD2 4.04Å; I31-L252 HydrophobicContact CG2-CD1 4.37Å; I31-L252 HydrophobicContact CG2-CD2 4.11Å; I31-L252 HydrophobicContact CG2-CG 4.49Å; V248-L252 HydrophobicContact CG1-CD1 4.07Å; V248-L252 HydrophobicContact CG1-CG 4.26Å; V248-L252 WeakPolarHBondContact O-CG 3.34Å; V248-L252 PolarHBondContact O-N 2.95Å; W249-L252 PolarHBondContact O-N 3.36Å; L252-S256 VanDerWaalsContact O-CB 3.26Å; L252-S256 WeakPolarHBondContact O-CB 3.04Å; L252-S256 PolarHBondContact O-N 3.34Å; L252-S256 PolarHBondContact O-OG 3.01Å; L252-T501 HydrophobicContact CD1-CG2 3.55Å; L252-Y504 HydrophobicContact CB-CE1 4.15Å
253	K	95.8	Very high	95.3	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-50.3	173.7	-73.6	-167.4	-179	-166.5	0	111.9	W249 F250 F255 S256 F257 P298 E300 Y504	W249-K253 PolarHBondContact O-N 3.4Å; F250-K253 PolarHBondContact O-N 2.94Å; K253-F255 VanDerWaalsContact C-N 3.28Å; K253-F255 PolarHBondContact O-N 3.47Å; K253-S256 PolarHBondContact O-N 3.03Å; K253-F257 VanDerWaalsContact O-CB 3.3Å; K253-F257 WeakPolarHBondContact O-CB 3.44Å; K253-F257 PolarHBondContact O-N 3.48Å; K253-P298 HydrophobicContact CB-CB 4.41Å; K253-E300 IonicContact NZ-OE1 3.25Å; K253-E300 PolarHBondContact NZ-OE1 3.26Å; K253-Y504 WeakPolarHBondContact CA-OH 3.5Å; K253-Y504 HydrophobicContact CG-CE2 4.4Å
254	T	95.9	Very high	95.4	Very high	62 Å²	62	42.8 Å²	42.8	38%	0.38	23%	0.229	S	C	.	.	H	α-helix	trans	-58.2	-38.3	178.1	-60.1	0	0	0	0	112.4	F250 S251 P258 P298 W301	F250-T254 WeakPolarHBondContact O-CB 3.02Å; F250-T254 PolarHBondContact O-N 3.27Å; F250-T254 PolarHBondContact O-OG1 3.22Å; S251-T254 PolarHBondContact O-N 3.41Å; T254-P258 WeakPolarHBondContact O-CD 3.43Å; T254-P298 WeakPolarHBondContact OG1-CB 3.28Å; T254-W301 PolarHBondContact OG1-NE1 3.37Å; T254-W301 VanDerWaalsContact OG1-NE1 3.1Å
255	F	95.2	Very high	95.6	Very high	135 Å²	135	46.6 Å²	46.6	59%	0.592	24%	0.242	S	C	*	.	H	α-helix	trans	-74.3	-41.3	177.3	-178.9	-100.7	0	0	0	113	S251 K253 P258 I259	S251-F255 WeakPolarHBondContact O-CB 3.48Å; S251-F255 PolarHBondContact O-N 3.38Å; K253-F255 VanDerWaalsContact C-N 3.28Å; K253-F255 PolarHBondContact O-N 3.47Å; F255-P258 WeakPolarHBondContact O-CD 3.46Å; F255-P258 WeakPolarHBondContact O-CG 3.47Å; F255-I259 HydrophobicContact CD1-CD1 3.97Å; F255-I259 HydrophobicContact CE1-CD1 3.5Å; F255-I259 VanDerWaalsContact CE1-CD1 3.5Å; F255-I259 HydrophobicContact CE2-CD1 4.42Å; F255-I259 HydrophobicContact CZ-CD1 3.76Å
256	S	95.1	Very high	95.6	Very high	5 Å²	5	50.1 Å²	50.1	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-75.4	-33.7	-175.9	-54.1	0	0	0	0	112.5	L252 K253 I259 V260 Y504	L252-S256 VanDerWaalsContact O-CB 3.26Å; L252-S256 WeakPolarHBondContact O-CB 3.04Å; L252-S256 PolarHBondContact O-N 3.34Å; L252-S256 PolarHBondContact O-OG 3.01Å; K253-S256 PolarHBondContact O-N 3.03Å; S256-I259 PolarHBondContact O-N 3.28Å; S256-V260 WeakPolarHBondContact O-CG2 3.22Å; S256-V260 PolarHBondContact O-N 3.33Å; S256-Y504 WeakPolarHBondContact CB-OH 3.49Å; S256-Y504 PolarHBondContact OG-OH 3.24Å
257	F	96.5	Very high	95.6	Very high	52 Å²	52	50.2 Å²	50.2	23%	0.228	26%	0.258	C	S	.	.	H	α-helix	trans	-53	-55.2	-178.4	177.8	-107.6	0	0	0	114.5	K253 I259 V260 L261 S293 N296 C297	K253-F257 VanDerWaalsContact O-CB 3.3Å; K253-F257 WeakPolarHBondContact O-CB 3.44Å; K253-F257 PolarHBondContact O-N 3.48Å; F257-I259 VanDerWaalsContact C-N 3.27Å; F257-I259 PolarHBondContact O-N 2.95Å; F257-V260 PolarHBondContact O-N 2.82Å; F257-L261 HydrophobicContact CE1-CD2 4.19Å; F257-L261 HydrophobicContact CZ-CD2 4.17Å; F257-L261 VanDerWaalsContact O-CB 3.3Å; F257-L261 WeakPolarHBondContact O-CB 3.21Å; F257-L261 PolarHBondContact O-N 2.99Å; F257-S293 WeakPolarHBondContact CD2-O 3.32Å; F257-S293 WeakPolarHBondContact CE2-O 3.28Å; F257-N296 HydrophobicContact CB-CB 4.11Å; F257-N296 HydrophobicContact CD2-CB 4.2Å; F257-C297 HydrophobicContact CD2-CB 4.24Å; F257-C297 HydrophobicContact CE2-CB 3.98Å
258	P	96.6	Very high	95.5	Very high	71 Å²	71	45.8 Å²	45.8	46%	0.461	24%	0.242	S	C	.	.	H	α-helix	trans	-64.2	-32.3	-180	25.5	-35	0	0	0	112.6	T254 F255 L261 L262	T254-P258 WeakPolarHBondContact O-CD 3.43Å; F255-P258 WeakPolarHBondContact O-CD 3.46Å; F255-P258 WeakPolarHBondContact O-CG 3.47Å; P258-L261 PolarHBondContact O-N 3.28Å; P258-L262 VanDerWaalsContact O-CB 3.29Å; P258-L262 WeakPolarHBondContact O-CB 3.34Å; P258-L262 PolarHBondContact O-N 3.3Å
259	I	95.6	Very high	95.4	Very high	77 Å²	77	50.7 Å²	50.7	40%	0.395	26%	0.263	S	S	.	.	H	α-helix	trans	-66.4	-49.5	178.5	-62.2	172.4	0	0	0	110.4	F255 S256 F257 L261 L262 A263	F255-I259 HydrophobicContact CD1-CD1 3.97Å; F255-I259 HydrophobicContact CE1-CD1 3.5Å; F255-I259 VanDerWaalsContact CE1-CD1 3.5Å; F255-I259 HydrophobicContact CE2-CD1 4.42Å; F255-I259 HydrophobicContact CZ-CD1 3.76Å; S256-I259 PolarHBondContact O-N 3.28Å; F257-I259 VanDerWaalsContact C-N 3.27Å; F257-I259 PolarHBondContact O-N 2.95Å; I259-L261 VanDerWaalsContact C-N 3.34Å; I259-L262 PolarHBondContact O-N 3.08Å; I259-A263 PolarHBondContact O-N 3.41Å
260	V	96.2	Very high	95.2	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-42.7	176.9	176.6	0	0	0	0	110.6	S256 F257 L262 A263 L264 L292 N508 V512	S256-V260 WeakPolarHBondContact O-CG2 3.22Å; S256-V260 PolarHBondContact O-N 3.33Å; F257-V260 PolarHBondContact O-N 2.82Å; V260-L262 PolarHBondContact O-N 2.97Å; V260-A263 PolarHBondContact O-N 3.36Å; V260-L264 WeakPolarHBondContact O-CB 3.44Å; V260-L264 PolarHBondContact O-N 3.27Å; V260-L292 HydrophobicContact CG1-CB 4.33Å; V260-L292 HydrophobicContact CG1-CD2 3.83Å; V260-L292 HydrophobicContact CG1-CG 4Å; V260-L292 HydrophobicContact CG2-CD2 3.94Å; V260-L292 HydrophobicContact CG2-CG 4.39Å; V260-N508 WeakPolarHBondContact CG2-OD1 3.48Å; V260-V512 HydrophobicContact CG2-CG2 3.85Å
261	L	96.6	Very high	94.9	Very high	60 Å²	60	51 Å²	51	31%	0.314	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-42.4	178.8	-174.9	62.9	0	0	0	111.7	F257 P258 I259 L264 I265	F257-L261 HydrophobicContact CE1-CD2 4.19Å; F257-L261 HydrophobicContact CZ-CD2 4.17Å; F257-L261 VanDerWaalsContact O-CB 3.3Å; F257-L261 WeakPolarHBondContact O-CB 3.21Å; F257-L261 PolarHBondContact O-N 2.99Å; P258-L261 PolarHBondContact O-N 3.28Å; I259-L261 VanDerWaalsContact C-N 3.34Å; L261-L264 PolarHBondContact O-N 3.4Å; L261-I265 HydrophobicContact CD1-CD1 4.28Å; L261-I265 HydrophobicContact CD1-CG1 4.46Å; L261-I265 HydrophobicContact CG-CD1 3.95Å; L261-I265 WeakPolarHBondContact O-CB 3.41Å; L261-I265 VanDerWaalsContact O-CG1 3.27Å; L261-I265 WeakPolarHBondContact O-CG1 3.41Å; L261-I265 PolarHBondContact O-N 3Å
262	L	96.8	Very high	94.6	Very high	123 Å²	123	56.6 Å²	56.6	64%	0.644	28%	0.282	S	S	*	.	H	α-helix	trans	-62.6	-43.9	175.7	-177.7	63.9	0	0	0	111.5	P258 I259 V260 L264 I265 F266	P258-L262 VanDerWaalsContact O-CB 3.29Å; P258-L262 WeakPolarHBondContact O-CB 3.34Å; P258-L262 PolarHBondContact O-N 3.3Å; I259-L262 PolarHBondContact O-N 3.08Å; V260-L262 PolarHBondContact O-N 2.97Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 3.47Å; L262-I265 PolarHBondContact O-N 3.1Å; L262-F266 VanDerWaalsContact O-CB 3.24Å; L262-F266 WeakPolarHBondContact O-CB 3.39Å; L262-F266 PolarHBondContact O-N 3.23Å
263	A	95.4	Very high	94.1	Very high	10 Å²	10	59.7 Å²	59.7	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-39.3	175.8	0	0	0	0	0	112.1	I259 V260 F267 V512 L515	I259-A263 PolarHBondContact O-N 3.41Å; V260-A263 PolarHBondContact O-N 3.36Å; A263-F267 WeakPolarHBondContact O-CB 3.42Å; A263-F267 PolarHBondContact O-N 3.46Å; A263-V512 HydrophobicContact CB-CG1 4.32Å; A263-L515 HydrophobicContact CB-CB 4.41Å; A263-L515 HydrophobicContact CB-CD1 4.14Å
264	L	96.5	Very high	93.5	Very high	13 Å²	13	62.2 Å²	62.2	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-66	-46.6	176.2	177.8	61.6	0	0	0	112	V260 L261 L262 F266 F267 G268 F286 I290 L515	V260-L264 WeakPolarHBondContact O-CB 3.44Å; V260-L264 PolarHBondContact O-N 3.27Å; L261-L264 PolarHBondContact O-N 3.4Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 3.47Å; L264-F266 VanDerWaalsContact C-N 3.34Å; L264-F267 PolarHBondContact O-N 2.87Å; L264-G268 PolarHBondContact O-N 2.98Å; L264-F286 HydrophobicContact CD1-CD2 3.56Å; L264-F286 HydrophobicContact CD1-CE2 3.61Å; L264-F286 HydrophobicContact CD1-CG 4.36Å; L264-F286 HydrophobicContact CD1-CZ 4.47Å; L264-F286 HydrophobicContact CG-CE2 4.25Å; L264-I290 HydrophobicContact CD1-CG1 4.45Å; L264-I290 HydrophobicContact CD2-CG1 3.88Å; L264-L515 HydrophobicContact CB-CD1 4.5Å; L264-L515 HydrophobicContact CD1-CD2 4.34Å
265	I	96	Very high	92.7	Very high	105 Å²	105	67.6 Å²	67.6	54%	0.538	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-45.1	176.1	-69	167.4	0	0	0	109.8	L261 L262 F267 G268 H269	L261-I265 HydrophobicContact CD1-CD1 4.28Å; L261-I265 HydrophobicContact CD1-CG1 4.46Å; L261-I265 HydrophobicContact CG-CD1 3.95Å; L261-I265 WeakPolarHBondContact O-CB 3.41Å; L261-I265 VanDerWaalsContact O-CG1 3.27Å; L261-I265 WeakPolarHBondContact O-CG1 3.41Å; L261-I265 PolarHBondContact O-N 3Å; L262-I265 PolarHBondContact O-N 3.1Å; I265-F267 PolarHBondContact O-N 3.43Å; I265-G268 PolarHBondContact O-N 3.33Å; I265-H269 VanDerWaalsContact O-CB 3.31Å; I265-H269 WeakPolarHBondContact O-CB 3.31Å; I265-H269 PolarHBondContact O-N 3.27Å
266	F	94.2	Very high	92	Very high	81 Å²	81	64.7 Å²	64.7	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-56.9	-51	175.8	173.1	-97.5	0	0	0	111.4	L262 L264 H269 R270	L262-F266 VanDerWaalsContact O-CB 3.24Å; L262-F266 WeakPolarHBondContact O-CB 3.39Å; L262-F266 PolarHBondContact O-N 3.23Å; L264-F266 VanDerWaalsContact C-N 3.34Å; F266-H269 PolarHBondContact O-N 2.88Å; F266-R270 HydrophobicContact CE1-CG 4.28Å; F266-R270 HydrophobicContact CE2-CG 4.4Å; F266-R270 HydrophobicContact CZ-CG 4.21Å; F266-R270 WeakPolarHBondContact O-CG 3.25Å; F266-R270 PolarHBondContact O-N 3.01Å; F266-R270 VanDerWaalsContact O-N 3.1Å
267	F	94.2	Very high	91.4	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.009	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-46.8	178	178.6	-97.9	0	0	0	112	A263 L264 I265 H269 R270 V271 E282 I285 F286 L515	A263-F267 WeakPolarHBondContact O-CB 3.42Å; A263-F267 PolarHBondContact O-N 3.46Å; L264-F267 PolarHBondContact O-N 2.87Å; I265-F267 PolarHBondContact O-N 3.43Å; F267-H269 PolarHBondContact O-N 3.35Å; F267-R270 WeakPolarHBondContact O-CB 3.11Å; F267-R270 PolarHBondContact O-N 3.34Å; F267-V271 HydrophobicContact CD1-CG2 4.24Å; F267-V271 HydrophobicContact CD2-CG2 4.47Å; F267-V271 HydrophobicContact CE1-CG2 3.85Å; F267-V271 HydrophobicContact CE2-CG2 4.1Å; F267-V271 HydrophobicContact CZ-CG2 3.77Å; F267-V271 WeakPolarHBondContact O-CG2 3.4Å; F267-V271 PolarHBondContact O-N 2.92Å; F267-E282 HydrophobicContact CZ-CB 4.33Å; F267-I285 HydrophobicContact CD1-CG2 4.42Å; F267-I285 HydrophobicContact CE1-CB 4.29Å; F267-I285 HydrophobicContact CE1-CG2 3.87Å; F267-I285 HydrophobicContact CE2-CG2 4.08Å; F267-I285 HydrophobicContact CZ-CB 4.05Å; F267-I285 HydrophobicContact CZ-CG2 3.68Å; F267-F286 HydrophobicContact CD1-CD2 4.08Å; F267-F286 HydrophobicContact CE1-CB 4.12Å; F267-F286 HydrophobicContact CE1-CD2 4.43Å; F267-L515 HydrophobicContact CB-CB 4.43Å; F267-L515 HydrophobicContact CB-CD2 3.88Å; F267-L515 HydrophobicContact CD1-CD2 3.88Å; F267-L515 HydrophobicContact CD2-CD2 4.44Å; F267-L515 VanDerWaalsContact CD2-O 3.27Å; F267-L515 WeakPolarHBondContact CD2-O 3.27Å; F267-L515 HydrophobicContact CG-CD2 3.81Å
268	G	93	Very high	90.8	Very high	10 Å²	10	69.5 Å²	69.5	10%	0.103	35%	0.352	C	S	.	.	H	α-helix	trans	-61.5	-41.6	179.2	0	0	0	0	0	113.1	L264 I265 V271 K272	L264-G268 PolarHBondContact O-N 2.98Å; I265-G268 PolarHBondContact O-N 3.33Å; G268-V271 PolarHBondContact O-N 2.83Å; G268-K272 WeakPolarHBondContact O-CG 3.39Å; G268-K272 PolarHBondContact O-N 3.49Å; G268-K272 VanDerWaalsContact O-N 3.08Å
269	H	92.9	Very high	90.2	Very high	123 Å²	123	68.6 Å²	68.6	57%	0.569	34%	0.343	S	S	*	.	H	α-helix	trans	-63.3	-42.5	176.1	-170.7	-89.7	0	0	0	111.6	I265 F266 F267 V271 K272 E273	I265-H269 VanDerWaalsContact O-CB 3.31Å; I265-H269 WeakPolarHBondContact O-CB 3.31Å; I265-H269 PolarHBondContact O-N 3.27Å; F266-H269 PolarHBondContact O-N 2.88Å; F267-H269 PolarHBondContact O-N 3.35Å; H269-V271 PolarHBondContact O-N 3.25Å; H269-K272 PolarHBondContact O-N 2.96Å; H269-E273 PolarHBondContact O-N 2.89Å
270	R	90.6	Very high	89.8	Confident	39 Å²	39	67.4 Å²	67.4	15%	0.147	34%	0.337	C	S	.	.	H	α-helix	trans	-63.1	-40.1	177.2	-68.4	-76.4	-179.9	-179.9	-3	113.3	F266 F267 P520 H522	F266-R270 HydrophobicContact CE1-CG 4.28Å; F266-R270 HydrophobicContact CE2-CG 4.4Å; F266-R270 HydrophobicContact CZ-CG 4.21Å; F266-R270 WeakPolarHBondContact O-CG 3.25Å; F266-R270 PolarHBondContact O-N 3.01Å; F266-R270 VanDerWaalsContact O-N 3.1Å; F267-R270 WeakPolarHBondContact O-CB 3.11Å; F267-R270 PolarHBondContact O-N 3.34Å; R270-P520 HydrophobicContact CB-CB 4.44Å; R270-P520 HydrophobicContact CB-CG 4.17Å; R270-H522 VanDerWaalsContact CZ-CD2 3.49Å; R270-H522 PolarHBondContact NH1-CD2 3.1Å; R270-H522 PolarHBondContact NH1-CE1 3.28Å; R270-H522 PolarHBondContact NH1-ND1 2.97Å; R270-H522 PolarHBondContact NH1-NE2 3.25Å; R270-H522 PolarHBondContact NH2-CD2 2.85Å; R270-H522 PolarHBondContact NH2-NE2 3.39Å
271	V	88.8	Confident	89.3	Confident	18 Å²	18	67.4 Å²	67.4	11%	0.109	34%	0.337	C	S	.	.	H	α-helix	trans	-70.2	-39	180	172.8	0	0	0	0	110.9	F267 G268 H269 E273 L274 P278 P520	F267-V271 HydrophobicContact CD1-CG2 4.24Å; F267-V271 HydrophobicContact CD2-CG2 4.47Å; F267-V271 HydrophobicContact CE1-CG2 3.85Å; F267-V271 HydrophobicContact CE2-CG2 4.1Å; F267-V271 HydrophobicContact CZ-CG2 3.77Å; F267-V271 WeakPolarHBondContact O-CG2 3.4Å; F267-V271 PolarHBondContact O-N 2.92Å; G268-V271 PolarHBondContact O-N 2.83Å; H269-V271 PolarHBondContact O-N 3.25Å; V271-E273 VanDerWaalsContact C-N 3.27Å; V271-E273 PolarHBondContact O-N 2.9Å; V271-L274 PolarHBondContact O-N 3.49Å; V271-P278 HydrophobicContact CG1-CB 3.76Å; V271-P520 HydrophobicContact CG2-CG 4.14Å
272	K	88.5	Confident	89	Confident	183 Å²	183	64.9 Å²	64.9	80%	0.796	32%	0.324	S	S	*	.	H	α-helix	trans	-66.8	-25.2	177.8	-75.1	-179	-179.1	-176.1	0	114.2	G268 H269 L274	G268-K272 WeakPolarHBondContact O-CG 3.39Å; G268-K272 PolarHBondContact O-N 3.49Å; G268-K272 VanDerWaalsContact O-N 3.08Å; H269-K272 PolarHBondContact O-N 2.96Å; K272-L274 PolarHBondContact O-N 3.35Å
273	E	86.4	Confident	88.8	Confident	77 Å²	77	64.1 Å²	64.1	36%	0.36	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.4	-178.8	-161.2	-176.7	83.7	0	0	113.3	H269 V271 R525	H269-E273 PolarHBondContact O-N 2.89Å; V271-E273 VanDerWaalsContact C-N 3.27Å; V271-E273 PolarHBondContact O-N 2.9Å; E273-R525 IonicContact OE1-CZ 3.52Å; E273-R525 IonicContact OE1-NE 2.7Å; E273-R525 PolarHBondContact OE1-NE 3.17Å; E273-R525 IonicContact OE1-NH1 2.78Å; E273-R525 PolarHBondContact OE1-NH1 3.36Å; E273-R525 IonicContact OE1-NH2 2.84Å; E273-R525 PolarHBondContact OE1-NH2 3.19Å; E273-R525 IonicContact OE2-CZ 3.32Å; E273-R525 VanDerWaalsContact OE2-CZ 3.27Å; E273-R525 IonicContact OE2-NH1 2.92Å; E273-R525 PolarHBondContact OE2-NH1 2.83Å; E273-R525 IonicContact OE2-NH2 3.64Å; E273-R525 PolarHBondContact OE2-NH2 2.97Å
274	L	81.4	Confident	88.6	Confident	59 Å²	59	64.4 Å²	64.4	31%	0.309	32%	0.316	S	S	.	.	S	Bend	trans	-75.4	137.7	177	-68.5	160.3	0	0	0	110.6	V271 K272 R276 P520	V271-L274 PolarHBondContact O-N 3.49Å; K272-L274 PolarHBondContact O-N 3.35Å; L274-R276 HydrophobicContact CB-CG 4.25Å; L274-R276 PolarHBondContact O-N 3.36Å; L274-P520 HydrophobicContact CD1-CB 4.06Å; L274-P520 HydrophobicContact CD1-CG 3.59Å; L274-P520 HydrophobicContact CD2-CB 4.44Å; L274-P520 HydrophobicContact CG-CB 4.43Å; L274-P520 HydrophobicContact CG-CG 4.39Å
275	E	79.6	Confident	88.5	Confident	175 Å²	175	63.9 Å²	63.9	82%	0.818	31%	0.313	S	S	*	.	S	Bend	trans	-66	-19.9	175.4	-66.6	171.9	174.2	0	0	113.2	Q530	E275-Q530 PolarHBondContact OE2-NE2 3.1Å; E275-Q530 VanDerWaalsContact OE2-NE2 3.13Å
276	R	80.7	Confident	88.5	Confident	74 Å²	74	62.6 Å²	62.6	28%	0.279	30%	0.304	S	S	.	.	S	Bend	trans	-91.6	152.8	-180	68.3	165.9	178.8	82	2.6	112	L274 N279 E282	L274-R276 HydrophobicContact CB-CG 4.25Å; L274-R276 PolarHBondContact O-N 3.36Å; R276-N279 PolarHBondContact NH1-ND2 2.75Å; R276-N279 PolarHBondContact NH1-OD1 2.84Å; R276-E282 IonicContact CZ-OE1 3.65Å; R276-E282 IonicContact CZ-OE2 2.76Å; R276-E282 IonicContact NH1-OE1 3.39Å; R276-E282 IonicContact NH1-OE2 3.93Å; R276-E282 PolarHBondContact NH1-OE2 2.91Å; R276-E282 IonicContact NH2-OE1 3.14Å; R276-E282 PolarHBondContact NH2-OE1 3.07Å; R276-E282 IonicContact NH2-OE2 3.28Å; R276-E282 PolarHBondContact NH2-OE2 3.3Å
277	P	82.8	Confident	88.6	Confident	102 Å²	102	62.8 Å²	62.8	66%	0.662	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-62	151.4	170	26.6	-34.7	0	0	0	111.9
278	P	84.2	Confident	88.7	Confident	55 Å²	55	62.7 Å²	62.7	36%	0.357	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-67.6	135.5	179.2	25.9	-32.8	0	0	0	111.4	V271 E282 K283	V271-P278 HydrophobicContact CG1-CB 3.76Å; P278-E282 WeakPolarHBondContact CA-OE2 3.49Å; P278-E282 HydrophobicContact CB-CB 4.44Å; P278-K283 HydrophobicContact CB-CG 4.22Å; P278-K283 HydrophobicContact CG-CG 4.3Å; P278-K283 WeakPolarHBondContact O-CE 3.24Å
279	N	84.2	Confident	88.9	Confident	53 Å²	53	62.2 Å²	62.2	28%	0.283	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-71.7	162.9	177.6	-68.7	-26	0	0	0	111.1	M1 R276 L281 E282 K283	M1-N279 HydrophobicContact CE-CB 3.99Å; M1-N279 VanDerWaalsContact CG-ND2 3.32Å; M1-N279 WeakPolarHBondContact CG-ND2 3.46Å; R276-N279 PolarHBondContact NH1-ND2 2.75Å; R276-N279 PolarHBondContact NH1-OD1 2.84Å; N279-L281 VanDerWaalsContact C-N 3.26Å; N279-L281 PolarHBondContact O-N 3.22Å; N279-E282 HydrophobicContact CB-CG 4.5Å; N279-E282 PolarHBondContact N-OE2 2.91Å; N279-E282 PolarHBondContact O-N 3.45Å; N279-E282 VanDerWaalsContact O-N 3.11Å; N279-K283 WeakPolarHBondContact O-CG 3.35Å; N279-K283 PolarHBondContact O-N 2.82Å
280	I	86.2	Confident	89.1	Confident	52 Å²	52	59.4 Å²	59.4	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-58.3	-37.3	179.2	-170.4	60.3	0	0	0	112.7	K283 T284 V332 E336 L357	I280-K283 PolarHBondContact O-N 3.38Å; I280-T284 WeakPolarHBondContact O-CB 3.42Å; I280-T284 PolarHBondContact O-N 3.45Å; I280-T284 PolarHBondContact O-OG1 3.32Å; I280-V332 HydrophobicContact CG1-CG1 4.1Å; I280-V332 HydrophobicContact CG2-CG1 4.29Å; I280-E336 HydrophobicContact CG2-CG 3.66Å; I280-E336 WeakPolarHBondContact CG2-OE1 3.17Å; I280-E336 WeakPolarHBondContact CG2-OE2 3.31Å; I280-L357 HydrophobicContact CD1-CD1 3.89Å; I280-L357 HydrophobicContact CG1-CD1 4.27Å
281	L	87.2	Confident	89.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-64.9	-43.9	175.8	-173.6	68	0	0	0	112.1	M1 N279 K283 T284 I285 F329 F333 Y518	M1-L281 HydrophobicContact CE-CB 3.53Å; M1-L281 HydrophobicContact CE-CD2 3.76Å; M1-L281 HydrophobicContact CE-CG 4.28Å; M1-L281 HydrophobicContact SD-CD2 3.98Å; N279-L281 VanDerWaalsContact C-N 3.26Å; N279-L281 PolarHBondContact O-N 3.22Å; L281-K283 VanDerWaalsContact C-N 3.34Å; L281-K283 PolarHBondContact O-N 3.47Å; L281-T284 PolarHBondContact O-N 2.84Å; L281-I285 HydrophobicContact CD1-CD1 4.36Å; L281-I285 HydrophobicContact CD2-CD1 4.45Å; L281-I285 HydrophobicContact CG-CD1 3.94Å; L281-I285 VanDerWaalsContact O-CG1 3.31Å; L281-I285 WeakPolarHBondContact O-CG1 3.29Å; L281-I285 PolarHBondContact O-N 2.93Å; L281-F329 HydrophobicContact CD1-CE2 4.14Å; L281-F333 HydrophobicContact CD1-CB 4.19Å; L281-F333 HydrophobicContact CD1-CD2 3.86Å; L281-F333 HydrophobicContact CD2-CD2 4.4Å; L281-Y518 HydrophobicContact CD2-CD1 4.1Å; L281-Y518 HydrophobicContact CD2-CE1 4.08Å
282	E	90.4	Very high	89.8	Confident	7 Å²	7	57.1 Å²	57.1	3%	0.033	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-40.4	178.8	-67.7	166.7	157	0	0	110.9	F267 R276 P278 N279 F286	F267-E282 HydrophobicContact CZ-CB 4.33Å; R276-E282 IonicContact CZ-OE1 3.65Å; R276-E282 IonicContact CZ-OE2 2.76Å; R276-E282 IonicContact NH1-OE1 3.39Å; R276-E282 IonicContact NH1-OE2 3.93Å; R276-E282 PolarHBondContact NH1-OE2 2.91Å; R276-E282 IonicContact NH2-OE1 3.14Å; R276-E282 PolarHBondContact NH2-OE1 3.07Å; R276-E282 IonicContact NH2-OE2 3.28Å; R276-E282 PolarHBondContact NH2-OE2 3.3Å; P278-E282 WeakPolarHBondContact CA-OE2 3.49Å; P278-E282 HydrophobicContact CB-CB 4.44Å; N279-E282 HydrophobicContact CB-CG 4.5Å; N279-E282 PolarHBondContact N-OE2 2.91Å; N279-E282 PolarHBondContact O-N 3.45Å; N279-E282 VanDerWaalsContact O-N 3.11Å; E282-F286 WeakPolarHBondContact O-CB 3.47Å; E282-F286 PolarHBondContact O-N 3.38Å
283	K	91.3	Very high	90.2	Very high	108 Å²	108	48.9 Å²	48.9	47%	0.47	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-44.8	172.5	-68.8	179.5	-179.8	-178.8	0	111.6	P278 N279 I280 L281 F286 I287	P278-K283 HydrophobicContact CB-CG 4.22Å; P278-K283 HydrophobicContact CG-CG 4.3Å; P278-K283 WeakPolarHBondContact O-CE 3.24Å; N279-K283 WeakPolarHBondContact O-CG 3.35Å; N279-K283 PolarHBondContact O-N 2.82Å; I280-K283 PolarHBondContact O-N 3.38Å; L281-K283 VanDerWaalsContact C-N 3.34Å; L281-K283 PolarHBondContact O-N 3.47Å; K283-F286 WeakPolarHBondContact O-CB 3.41Å; K283-F286 PolarHBondContact O-N 3.4Å; K283-I287 VanDerWaalsContact O-CG1 3.28Å; K283-I287 WeakPolarHBondContact O-CG1 3.27Å; K283-I287 PolarHBondContact O-N 3.42Å
284	T	91.9	Very high	90.6	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.098	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-40.5	-178.3	-51.9	0	0	0	0	111.8	I280 L281 F286 I287 L288 F329 V332	I280-T284 WeakPolarHBondContact O-CB 3.42Å; I280-T284 PolarHBondContact O-N 3.45Å; I280-T284 PolarHBondContact O-OG1 3.32Å; L281-T284 PolarHBondContact O-N 2.84Å; T284-F286 VanDerWaalsContact C-N 3.33Å; T284-I287 PolarHBondContact O-N 3.46Å; T284-L288 WeakPolarHBondContact O-CB 3.38Å; T284-L288 PolarHBondContact O-N 3.27Å; T284-F329 HydrophobicContact CG2-CB 3.93Å; T284-F329 HydrophobicContact CG2-CD2 4.15Å; T284-V332 HydrophobicContact CG2-CB 4.45Å
285	I	94.5	Very high	91.3	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-40.5	173.2	-69.7	169.9	0	0	0	111	F267 L281 L288 G289 F329 V514 L515 Y518	F267-I285 HydrophobicContact CD1-CG2 4.42Å; F267-I285 HydrophobicContact CE1-CB 4.29Å; F267-I285 HydrophobicContact CE1-CG2 3.87Å; F267-I285 HydrophobicContact CE2-CG2 4.08Å; F267-I285 HydrophobicContact CZ-CB 4.05Å; F267-I285 HydrophobicContact CZ-CG2 3.68Å; L281-I285 HydrophobicContact CD1-CD1 4.36Å; L281-I285 HydrophobicContact CD2-CD1 4.45Å; L281-I285 HydrophobicContact CG-CD1 3.94Å; L281-I285 VanDerWaalsContact O-CG1 3.31Å; L281-I285 WeakPolarHBondContact O-CG1 3.29Å; L281-I285 PolarHBondContact O-N 2.93Å; I285-L288 PolarHBondContact O-N 2.96Å; I285-G289 PolarHBondContact O-N 2.96Å; I285-F329 HydrophobicContact CD1-CE2 4.24Å; I285-F329 HydrophobicContact CG1-CD2 4.13Å; I285-F329 HydrophobicContact CG1-CE2 3.59Å; I285-F329 HydrophobicContact CG1-CZ 4.49Å; I285-V514 HydrophobicContact CD1-CG1 3.98Å; I285-V514 HydrophobicContact CG1-CG1 3.93Å; I285-V514 HydrophobicContact CG2-CG1 4.02Å; I285-L515 HydrophobicContact CG2-CD2 3.71Å; I285-L515 HydrophobicContact CG2-CG 4.43Å; I285-Y518 HydrophobicContact CD1-CD1 4.06Å; I285-Y518 HydrophobicContact CD1-CG 3.89Å
286	F	95.5	Very high	92.1	Very high	77 Å²	77	38.5 Å²	38.5	34%	0.338	20%	0.199	S	C	.	.	H	α-helix	trans	-62.7	-45	176.5	-169.2	-109.9	0	0	0	111.8	L264 F267 E282 K283 T284 G289 I290	L264-F286 HydrophobicContact CD1-CD2 3.56Å; L264-F286 HydrophobicContact CD1-CE2 3.61Å; L264-F286 HydrophobicContact CD1-CG 4.36Å; L264-F286 HydrophobicContact CD1-CZ 4.47Å; L264-F286 HydrophobicContact CG-CE2 4.25Å; F267-F286 HydrophobicContact CD1-CD2 4.08Å; F267-F286 HydrophobicContact CE1-CB 4.12Å; F267-F286 HydrophobicContact CE1-CD2 4.43Å; E282-F286 WeakPolarHBondContact O-CB 3.47Å; E282-F286 PolarHBondContact O-N 3.38Å; K283-F286 WeakPolarHBondContact O-CB 3.41Å; K283-F286 PolarHBondContact O-N 3.4Å; T284-F286 VanDerWaalsContact C-N 3.33Å; F286-G289 PolarHBondContact O-N 3.47Å; F286-I290 HydrophobicContact CD1-CD1 3.71Å; F286-I290 HydrophobicContact CE1-CD1 3.52Å; F286-I290 HydrophobicContact CE1-CG1 4.37Å; F286-I290 HydrophobicContact CZ-CD1 4.21Å; F286-I290 WeakPolarHBondContact O-CG1 3.41Å; F286-I290 PolarHBondContact O-N 2.99Å
287	I	95.8	Very high	92.8	Very high	85 Å²	85	36.9 Å²	36.9	44%	0.436	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-43.2	175.6	-64.6	164.9	0	0	0	110.7	K283 T284 G289 I290 C291 T325	K283-I287 VanDerWaalsContact O-CG1 3.28Å; K283-I287 WeakPolarHBondContact O-CG1 3.27Å; K283-I287 PolarHBondContact O-N 3.42Å; T284-I287 PolarHBondContact O-N 3.46Å; I287-G289 VanDerWaalsContact C-N 3.3Å; I287-G289 PolarHBondContact O-N 2.97Å; I287-I290 PolarHBondContact O-N 2.74Å; I287-I290 VanDerWaalsContact O-N 3.14Å; I287-C291 PolarHBondContact O-N 2.97Å; I287-C291 PolarHBondContact O-SG 2.91Å; I287-C291 VanDerWaalsContact O-SG 3.41Å; I287-T325 HydrophobicContact CG2-CG2 3.82Å
288	L	96.6	Very high	93.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57	-43.4	175.4	-177.3	64.5	0	0	0	111.9	T284 I285 C291 L292 F322 T325 L326 F329 V511	T284-L288 WeakPolarHBondContact O-CB 3.38Å; T284-L288 PolarHBondContact O-N 3.27Å; I285-L288 PolarHBondContact O-N 2.96Å; L288-C291 PolarHBondContact O-N 3.26Å; L288-L292 PolarHBondContact O-N 3.42Å; L288-F322 HydrophobicContact CD1-CD2 4.37Å; L288-F322 HydrophobicContact CD1-CE2 3.99Å; L288-T325 HydrophobicContact CB-CG2 4.1Å; L288-T325 HydrophobicContact CD1-CG2 4.03Å; L288-L326 HydrophobicContact CD1-CB 4.17Å; L288-L326 HydrophobicContact CD1-CD1 4.17Å; L288-L326 HydrophobicContact CD2-CD1 4.44Å; L288-F329 HydrophobicContact CD2-CB 4.26Å; L288-F329 HydrophobicContact CD2-CD1 3.91Å; L288-F329 HydrophobicContact CD2-CD2 4.34Å; L288-F329 HydrophobicContact CD2-CE1 4.34Å; L288-F329 HydrophobicContact CD2-CG 3.89Å; L288-V511 HydrophobicContact CD2-CG2 4.12Å; L288-V511 HydrophobicContact CG-CG1 4.27Å; L288-V511 HydrophobicContact CG-CG2 4.13Å
289	G	96.8	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-40.8	175.1	0	0	0	0	0	113.1	I285 F286 I287 L292 S293	I285-G289 PolarHBondContact O-N 2.96Å; F286-G289 PolarHBondContact O-N 3.47Å; I287-G289 VanDerWaalsContact C-N 3.3Å; I287-G289 PolarHBondContact O-N 2.97Å; G289-L292 PolarHBondContact O-N 3.35Å; G289-S293 PolarHBondContact O-N 3.46Å; G289-S293 PolarHBondContact O-OG 3.44Å
290	I	97.3	Very high	93.9	Very high	64 Å²	64	31.2 Å²	31.2	33%	0.328	16%	0.162	S	C	.	.	H	α-helix	trans	-60.9	-49.1	174.3	-69.4	166.7	0	0	0	110.8	L264 F286 I287 L292 S293 I294	L264-I290 HydrophobicContact CD1-CG1 4.45Å; L264-I290 HydrophobicContact CD2-CG1 3.88Å; F286-I290 HydrophobicContact CD1-CD1 3.71Å; F286-I290 HydrophobicContact CE1-CD1 3.52Å; F286-I290 HydrophobicContact CE1-CG1 4.37Å; F286-I290 HydrophobicContact CZ-CD1 4.21Å; F286-I290 WeakPolarHBondContact O-CG1 3.41Å; F286-I290 PolarHBondContact O-N 2.99Å; I287-I290 PolarHBondContact O-N 2.74Å; I287-I290 VanDerWaalsContact O-N 3.14Å; I290-L292 VanDerWaalsContact C-N 3.31Å; I290-L292 PolarHBondContact O-N 3.3Å; I290-S293 WeakPolarHBondContact O-CB 3.36Å; I290-S293 PolarHBondContact O-N 3.4Å; I290-S293 VanDerWaalsContact O-N 3.15Å; I290-I294 HydrophobicContact CG2-CD1 3.88Å; I290-I294 HydrophobicContact CG2-CG1 4.44Å; I290-I294 WeakPolarHBondContact O-CG1 3.35Å; I290-I294 PolarHBondContact O-N 3.43Å
291	C	97.1	Very high	94.2	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.054	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-39.1	-179.7	-69.2	0	0	0	0	111.8	I287 L288 I294 L295 T325	I287-C291 PolarHBondContact O-N 2.97Å; I287-C291 PolarHBondContact O-SG 2.91Å; I287-C291 VanDerWaalsContact O-SG 3.41Å; L288-C291 PolarHBondContact O-N 3.26Å; C291-I294 PolarHBondContact O-N 2.96Å; C291-L295 PolarHBondContact O-N 3.44Å; C291-T325 HydrophobicContact CB-CG2 4.43Å; C291-T325 PolarHBondContact SG-OG1 2.85Å; C291-T325 VanDerWaalsContact SG-OG1 3.33Å
292	L	96.8	Very high	94.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-67	-40.7	173.2	-177.4	63.4	0	0	0	112.2	V260 L288 G289 I290 I294 L295 N296 F322 V511	V260-L292 HydrophobicContact CG1-CB 4.33Å; V260-L292 HydrophobicContact CG1-CD2 3.83Å; V260-L292 HydrophobicContact CG1-CG 4Å; V260-L292 HydrophobicContact CG2-CD2 3.94Å; V260-L292 HydrophobicContact CG2-CG 4.39Å; L288-L292 PolarHBondContact O-N 3.42Å; G289-L292 PolarHBondContact O-N 3.35Å; I290-L292 VanDerWaalsContact C-N 3.31Å; I290-L292 PolarHBondContact O-N 3.3Å; L292-I294 VanDerWaalsContact C-N 3.29Å; L292-I294 PolarHBondContact O-N 2.94Å; L292-L295 HydrophobicContact CD1-CD2 4.22Å; L292-L295 PolarHBondContact O-N 3.04Å; L292-L295 VanDerWaalsContact O-N 3.16Å; L292-N296 PolarHBondContact O-N 3.01Å; L292-F322 HydrophobicContact CB-CD2 4.21Å; L292-F322 HydrophobicContact CB-CE2 4.13Å; L292-F322 HydrophobicContact CD1-CD2 4.32Å; L292-F322 HydrophobicContact CD1-CE2 4.02Å; L292-F322 HydrophobicContact CD1-CZ 4.4Å; L292-V511 HydrophobicContact CB-CG1 4.39Å; L292-V511 HydrophobicContact CD2-CB 3.43Å; L292-V511 VanDerWaalsContact CD2-CB 3.43Å; L292-V511 HydrophobicContact CD2-CG1 3.63Å; L292-V511 HydrophobicContact CD2-CG2 3.84Å
293	S	96.7	Very high	94.4	Very high	10 Å²	10	37.1 Å²	37.1	7%	0.07	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-40.9	173.5	-67.6	0	0	0	0	111.7	F257 G289 I290 N296 C297	F257-S293 WeakPolarHBondContact CD2-O 3.32Å; F257-S293 WeakPolarHBondContact CE2-O 3.28Å; G289-S293 PolarHBondContact O-N 3.46Å; G289-S293 PolarHBondContact O-OG 3.44Å; I290-S293 WeakPolarHBondContact O-CB 3.36Å; I290-S293 PolarHBondContact O-N 3.4Å; I290-S293 VanDerWaalsContact O-N 3.15Å; S293-N296 PolarHBondContact O-N 2.9Å; S293-C297 PolarHBondContact O-N 3.45Å
294	I	96.5	Very high	94.3	Very high	72 Å²	72	33.2 Å²	33.2	37%	0.369	17%	0.171	S	C	.	.	H	α-helix	trans	-62.8	-43.1	174	-68.8	168.3	0	0	0	110.5	I290 C291 L292 N296 C297 R318	I290-I294 HydrophobicContact CG2-CD1 3.88Å; I290-I294 HydrophobicContact CG2-CG1 4.44Å; I290-I294 WeakPolarHBondContact O-CG1 3.35Å; I290-I294 PolarHBondContact O-N 3.43Å; C291-I294 PolarHBondContact O-N 2.96Å; L292-I294 VanDerWaalsContact C-N 3.29Å; L292-I294 PolarHBondContact O-N 2.94Å; I294-N296 VanDerWaalsContact C-N 3.34Å; I294-N296 PolarHBondContact O-N 3.3Å; I294-C297 WeakPolarHBondContact O-CB 3.35Å; I294-C297 PolarHBondContact O-N 2.91Å; I294-R318 HydrophobicContact CG2-CG 3.98Å; I294-R318 PolarHBondContact O-NE 3.3Å; I294-R318 PolarHBondContact O-NH2 2.87Å
295	L	95.6	Very high	94.2	Very high	22 Å²	22	37.4 Å²	37.4	12%	0.115	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-34.2	178.1	-178.3	64	0	0	0	113.5	C291 L292 R318 Q319 F322	C291-L295 PolarHBondContact O-N 3.44Å; L292-L295 HydrophobicContact CD1-CD2 4.22Å; L292-L295 PolarHBondContact O-N 3.04Å; L292-L295 VanDerWaalsContact O-N 3.16Å; L295-R318 HydrophobicContact CD1-CB 4.2Å; L295-R318 PolarHBondContact O-NH2 2.83Å; L295-Q319 HydrophobicContact CD1-CB 4.22Å; L295-F322 HydrophobicContact CD2-CB 3.99Å; L295-F322 HydrophobicContact CD2-CD1 3.84Å; L295-F322 HydrophobicContact CD2-CG 3.85Å
296	N	96.2	Very high	93.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-88.5	-12.9	179.6	-67.6	-11.1	0	0	0	113.8	F257 L292 S293 I294 P298 Y504 N508	F257-N296 HydrophobicContact CB-CB 4.11Å; F257-N296 HydrophobicContact CD2-CB 4.2Å; L292-N296 PolarHBondContact O-N 3.01Å; S293-N296 PolarHBondContact O-N 2.9Å; I294-N296 VanDerWaalsContact C-N 3.34Å; I294-N296 PolarHBondContact O-N 3.3Å; N296-P298 WeakPolarHBondContact O-CD 3.4Å; N296-P298 VanDerWaalsContact O-N 3.12Å; N296-Y504 VanDerWaalsContact OD1-CE2 3.32Å; N296-Y504 WeakPolarHBondContact OD1-CE2 3.36Å; N296-Y504 PolarHBondContact OD1-OH 2.69Å; N296-N508 PolarHBondContact ND2-OD1 3.16Å
297	C	95.1	Very high	93.5	Very high	40 Å²	40	42.5 Å²	42.5	27%	0.27	22%	0.215	S	C	.	.			trans	-55	120	178.8	-170.6	0	0	0	0	109.3	F257 S293 I294 V299 R318	F257-C297 HydrophobicContact CD2-CB 4.24Å; F257-C297 HydrophobicContact CE2-CB 3.98Å; S293-C297 PolarHBondContact O-N 3.45Å; I294-C297 WeakPolarHBondContact O-CB 3.35Å; I294-C297 PolarHBondContact O-N 2.91Å; C297-V299 HydrophobicContact CB-CG1 4.22Å; C297-V299 PolarHBondContact O-N 2.92Å; C297-V299 VanDerWaalsContact SG-CG1 3.6Å; C297-R318 PolarHBondContact O-NH2 3.46Å
298	P	93.6	Very high	92.9	Very high	34 Å²	34	42.9 Å²	42.9	22%	0.221	21%	0.213	C	C	.	.			trans	-82.6	58.5	-169.2	37.3	-39.6	0	0	0	110	K253 T254 N296 E300 W301	K253-P298 HydrophobicContact CB-CB 4.41Å; T254-P298 WeakPolarHBondContact OG1-CB 3.28Å; N296-P298 WeakPolarHBondContact O-CD 3.4Å; N296-P298 VanDerWaalsContact O-N 3.12Å; P298-E300 PolarHBondContact O-N 3.1Å; P298-W301 VanDerWaalsContact O-CD1 3.29Å
299	V	92.4	Very high	92.3	Very high	37 Å²	37	45.5 Å²	45.5	22%	0.224	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-71.6	-22.8	-178.9	-60.9	0	0	0	0	111.9	C297 W301 L302 W311 L314	C297-V299 HydrophobicContact CB-CG1 4.22Å; C297-V299 PolarHBondContact O-N 2.92Å; C297-V299 VanDerWaalsContact SG-CG1 3.6Å; V299-W301 PolarHBondContact O-N 2.93Å; V299-L302 VanDerWaalsContact O-CB 3.26Å; V299-L302 WeakPolarHBondContact O-CB 3.39Å; V299-L302 PolarHBondContact O-N 3.41Å; V299-W311 HydrophobicContact CB-CZ3 4.46Å; V299-W311 HydrophobicContact CG2-CZ3 4.4Å; V299-L314 HydrophobicContact CG2-CD2 4.35Å
300	E	89.4	Confident	91.9	Very high	19 Å²	19	49.6 Å²	49.6	9%	0.089	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-65.7	-17.6	-179.4	-57.8	87.5	160.5	0	0	112.2	F250 K253 P298 L302 S303 R318	F250-E300 HydrophobicContact CD1-CB 4.2Å; F250-E300 HydrophobicContact CE1-CB 3.43Å; F250-E300 VanDerWaalsContact CE1-CB 3.43Å; F250-E300 HydrophobicContact CE1-CG 4.19Å; F250-E300 HydrophobicContact CE2-CB 3.98Å; F250-E300 WeakPolarHBondContact CE2-O 3.33Å; F250-E300 HydrophobicContact CZ-CB 3.31Å; F250-E300 HydrophobicContact CZ-CG 4.43Å; K253-E300 IonicContact NZ-OE1 3.25Å; K253-E300 PolarHBondContact NZ-OE1 3.26Å; P298-E300 PolarHBondContact O-N 3.1Å; E300-L302 PolarHBondContact O-N 2.72Å; E300-S303 WeakPolarHBondContact O-CB 3.29Å; E300-S303 PolarHBondContact O-N 3.48Å; E300-S303 PolarHBondContact O-OG 3.41Å; E300-R318 IonicContact OE1-CZ 2.8Å; E300-R318 IonicContact OE1-NH1 2.92Å; E300-R318 PolarHBondContact OE1-NH1 3.49Å; E300-R318 IonicContact OE1-NH2 3.27Å; E300-R318 IonicContact OE2-NH1 3.18Å
301	W	92.1	Very high	91.5	Very high	98 Å²	98	47.7 Å²	47.7	37%	0.371	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-59.7	-29.5	169.1	-74.1	89.4	0	0	0	112.6	W113 F250 T254 P298 V299 S303 L304	W113-W301 HydrophobicContact CH2-CE3 4.44Å; W113-W301 AromaticContact CH2-CH2 3.99Å; W113-W301 HydrophobicContact CH2-CH2 3.99Å; W113-W301 AromaticContact CH2-CZ3 3.65Å; W113-W301 HydrophobicContact CH2-CZ3 3.65Å; W113-W301 HydrophobicContact CZ3-CZ3 4.4Å; F250-W301 HydrophobicContact CB-CZ2 3.69Å; F250-W301 AromaticContact CD2-CD2 3.98Å; F250-W301 HydrophobicContact CD2-CD2 3.98Å; F250-W301 AromaticContact CD2-CE2 3.96Å; F250-W301 HydrophobicContact CD2-CE3 4.39Å; F250-W301 HydrophobicContact CD2-CG 4.23Å; F250-W301 HydrophobicContact CD2-CZ2 4.36Å; T254-W301 PolarHBondContact OG1-NE1 3.37Å; T254-W301 VanDerWaalsContact OG1-NE1 3.1Å; P298-W301 VanDerWaalsContact O-CD1 3.29Å; V299-W301 PolarHBondContact O-N 2.93Å; W301-S303 PolarHBondContact O-N 3.2Å; W301-L304 HydrophobicContact CE3-CD1 3.88Å; W301-L304 HydrophobicContact CZ3-CD1 4.23Å; W301-L304 WeakPolarHBondContact O-CB 3.34Å; W301-L304 PolarHBondContact O-N 2.9Å
302	L	92.1	Very high	91	Very high	81 Å²	81	48.5 Å²	48.5	42%	0.424	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-69.3	-23.2	177.1	-62.1	174.5	0	0	0	112.2	V299 E300 L304 I305 Y306 W311	V299-L302 VanDerWaalsContact O-CB 3.26Å; V299-L302 WeakPolarHBondContact O-CB 3.39Å; V299-L302 PolarHBondContact O-N 3.41Å; E300-L302 PolarHBondContact O-N 2.72Å; L302-L304 PolarHBondContact O-N 3.41Å; L302-I305 PolarHBondContact O-N 2.84Å; L302-I305 VanDerWaalsContact O-N 3.11Å; L302-Y306 HydrophobicContact CB-CD2 4.42Å; L302-Y306 HydrophobicContact CD2-CE2 4.45Å; L302-Y306 PolarHBondContact O-N 2.92Å; L302-W311 HydrophobicContact CB-CH2 3.62Å; L302-W311 HydrophobicContact CB-CZ2 3.82Å; L302-W311 HydrophobicContact CD1-CH2 4.3Å
303	S	89.5	Confident	90.8	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.042	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-69.2	-22.7	177.9	76.5	0	0	0	0	112.6	Q115 E300 W301 I305	Q115-S303 PolarHBondContact NE2-OG 3.11Å; Q115-S303 PolarHBondContact OE1-OG 2.93Å; E300-S303 WeakPolarHBondContact O-CB 3.29Å; E300-S303 PolarHBondContact O-N 3.48Å; E300-S303 PolarHBondContact O-OG 3.41Å; W301-S303 PolarHBondContact O-N 3.2Å; S303-I305 PolarHBondContact O-N 3.42Å
304	L	89.8	Confident	90.5	Very high	25 Å²	25	51.4 Å²	51.4	13%	0.131	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-69.3	-24.9	173.2	-59.3	176.3	0	0	0	112.2	R112 W113 F250 W301 L302	R112-L304 HydrophobicContact CB-CD2 3.93Å; R112-L304 WeakPolarHBondContact CD-O 3.33Å; R112-L304 PolarHBondContact NH1-O 3.14Å; R112-L304 WeakPolarHBondContact O-CD2 3.17Å; W113-L304 HydrophobicContact CD2-CD1 4.48Å; W113-L304 HydrophobicContact CD2-CD2 4.12Å; W113-L304 HydrophobicContact CE3-CD1 4.23Å; W113-L304 HydrophobicContact CE3-CD2 4.14Å; W113-L304 HydrophobicContact CH2-CD1 3.56Å; W113-L304 HydrophobicContact CZ2-CD1 3.82Å; W113-L304 HydrophobicContact CZ3-CD1 3.77Å; W113-L304 HydrophobicContact CZ3-CD2 4.49Å; F250-L304 HydrophobicContact CE2-CD1 4.3Å; F250-L304 HydrophobicContact CE2-CG 4.36Å; W301-L304 HydrophobicContact CE3-CD1 3.88Å; W301-L304 HydrophobicContact CZ3-CD1 4.23Å; W301-L304 WeakPolarHBondContact O-CB 3.34Å; W301-L304 PolarHBondContact O-N 2.9Å; L302-L304 PolarHBondContact O-N 3.41Å
305	I	89.8	Confident	90.2	Very high	104 Å²	104	49.8 Å²	49.8	53%	0.533	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-48.6	-178.5	-57.3	172.4	0	0	0	109.8	L302 S303	L302-I305 PolarHBondContact O-N 2.84Å; L302-I305 VanDerWaalsContact O-N 3.11Å; S303-I305 PolarHBondContact O-N 3.42Å
306	Y	88.2	Confident	90.1	Very high	124 Å²	124	51 Å²	51	49%	0.486	26%	0.258	S	S	.	.			trans	-111.6	125.1	-171.4	-58.1	-71.7	0	0	0	112.3	L302 F308 W311	L302-Y306 HydrophobicContact CB-CD2 4.42Å; L302-Y306 HydrophobicContact CD2-CE2 4.45Å; L302-Y306 PolarHBondContact O-N 2.92Å; Y306-F308 VanDerWaalsContact CB-CE2 3.4Å; Y306-F308 AromaticContact CG-CE2 3.94Å; Y306-F308 HydrophobicContact CG-CE2 3.94Å; Y306-F308 PolarHBondContact O-N 3.37Å; Y306-F308 VanDerWaalsContact O-N 3.16Å; Y306-W311 PolarHBondContact O-NE1 2.86Å
307	N	86.1	Confident	89.9	Confident	63 Å²	63	54.2 Å²	54.2	34%	0.337	28%	0.275	S	S	.	.			trans	-80	91.2	174.5	-167.2	10.5	0	0	0	110.9	S204 H206	S204-N307 WeakPolarHBondContact CB-OD1 3.4Å; S204-N307 PolarHBondContact OG-OD1 3.45Å; H206-N307 HydrophobicContact CB-CB 4.03Å
308	F	84.3	Confident	89.9	Confident	93 Å²	93	53 Å²	53	41%	0.408	26%	0.264	S	S	.	.			trans	-117.3	127.8	173	-65.2	-59.7	0	0	0	111.2	Y306 F310 W311	Y306-F308 VanDerWaalsContact CB-CE2 3.4Å; Y306-F308 AromaticContact CG-CE2 3.94Å; Y306-F308 HydrophobicContact CG-CE2 3.94Å; Y306-F308 PolarHBondContact O-N 3.37Å; Y306-F308 VanDerWaalsContact O-N 3.16Å; F308-F310 HydrophobicContact CB-CD1 3.71Å; F308-F310 HydrophobicContact CB-CE1 3.46Å; F308-F310 VanDerWaalsContact CB-CE1 3.46Å; F308-F310 HydrophobicContact CB-CG 4.5Å; F308-F310 HydrophobicContact CB-CZ 4.07Å; F308-F310 HydrophobicContact CD1-CE1 4.02Å; F308-F310 HydrophobicContact CD2-CE1 4.02Å; F308-F310 HydrophobicContact CD2-CZ 4.18Å; F308-F310 HydrophobicContact CG-CD1 4.27Å; F308-F310 AromaticContact CG-CE1 3.59Å; F308-F310 HydrophobicContact CG-CE1 3.59Å; F308-F310 HydrophobicContact CG-CZ 4.18Å; F308-F310 PolarHBondContact O-N 3.3Å; F308-W311 AromaticContact CD2-CZ2 3.86Å; F308-W311 HydrophobicContact CD2-CZ2 3.86Å
309	S	83.1	Confident	89.9	Confident	55 Å²	55	55 Å²	55	39%	0.385	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-10.8	-178.8	-46.2	0	0	0	0	114.2	A203	A203-S309 WeakPolarHBondContact CB-O 3.2Å
310	F	89.3	Confident	90	Very high	85 Å²	85	54.9 Å²	54.9	37%	0.373	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.1	-178.3	71.7	-102.6	0	0	0	114.2	F308 L312 V313 L314 I387	F308-F310 HydrophobicContact CB-CD1 3.71Å; F308-F310 HydrophobicContact CB-CE1 3.46Å; F308-F310 VanDerWaalsContact CB-CE1 3.46Å; F308-F310 HydrophobicContact CB-CG 4.5Å; F308-F310 HydrophobicContact CB-CZ 4.07Å; F308-F310 HydrophobicContact CD1-CE1 4.02Å; F308-F310 HydrophobicContact CD2-CE1 4.02Å; F308-F310 HydrophobicContact CD2-CZ 4.18Å; F308-F310 HydrophobicContact CG-CD1 4.27Å; F308-F310 AromaticContact CG-CE1 3.59Å; F308-F310 HydrophobicContact CG-CE1 3.59Å; F308-F310 HydrophobicContact CG-CZ 4.18Å; F308-F310 PolarHBondContact O-N 3.3Å; F310-L312 VanDerWaalsContact C-N 3.28Å; F310-L312 PolarHBondContact O-N 2.96Å; F310-V313 PolarHBondContact O-N 3.04Å; F310-L314 HydrophobicContact CD2-CB 4.14Å; F310-L314 HydrophobicContact CD2-CD2 4.46Å; F310-L314 HydrophobicContact CE2-CD2 4.04Å; F310-L314 PolarHBondContact O-N 3.24Å; F310-I387 HydrophobicContact CB-CD1 4.14Å
311	W	88.3	Confident	90.2	Very high	25 Å²	25	57.7 Å²	57.7	10%	0.095	29%	0.293	C	S	.	.	H	α-helix	trans	-54.7	-42.4	-174.4	-74	127.1	0	0	0	113.2	V299 L302 Y306 F308 L314 S315	V299-W311 HydrophobicContact CB-CZ3 4.46Å; V299-W311 HydrophobicContact CG2-CZ3 4.4Å; L302-W311 HydrophobicContact CB-CH2 3.62Å; L302-W311 HydrophobicContact CB-CZ2 3.82Å; L302-W311 HydrophobicContact CD1-CH2 4.3Å; Y306-W311 PolarHBondContact O-NE1 2.86Å; F308-W311 AromaticContact CD2-CZ2 3.86Å; F308-W311 HydrophobicContact CD2-CZ2 3.86Å; W311-L314 HydrophobicContact CE3-CD2 4.15Å; W311-L314 HydrophobicContact CZ3-CD2 4.04Å; W311-L314 PolarHBondContact O-N 3.18Å; W311-S315 PolarHBondContact O-N 2.89Å
312	L	86.4	Confident	90.4	Very high	25 Å²	25	53.2 Å²	53.2	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-52.5	177.6	-175.1	62.9	0	0	0	111.3	T201 A203 F310 L314 S315 D316	T201-L312 HydrophobicContact CG2-CD2 4.24Å; A203-L312 HydrophobicContact CB-CB 3.89Å; F310-L312 VanDerWaalsContact C-N 3.28Å; F310-L312 PolarHBondContact O-N 2.96Å; L312-L314 VanDerWaalsContact C-N 3.29Å; L312-L314 PolarHBondContact O-N 3.41Å; L312-S315 WeakPolarHBondContact O-CB 3.44Å; L312-S315 PolarHBondContact O-N 3.34Å; L312-D316 PolarHBondContact O-N 3.42Å
313	V	91.6	Very high	90.5	Very high	18 Å²	18	54.8 Å²	54.8	11%	0.109	28%	0.277	C	S	.	.	H	α-helix	trans	-58.3	-40.9	177.9	177.3	0	0	0	0	111.5	F310 S315 D316 I317 L380 R383 I387	F310-V313 PolarHBondContact O-N 3.04Å; V313-S315 PolarHBondContact O-N 3.5Å; V313-D316 PolarHBondContact O-N 3.02Å; V313-I317 HydrophobicContact CG1-CD1 3.71Å; V313-I317 HydrophobicContact CG1-CG1 4.3Å; V313-I317 WeakPolarHBondContact O-CB 3.09Å; V313-I317 WeakPolarHBondContact O-CG1 3.33Å; V313-I317 PolarHBondContact O-N 3.15Å; V313-L380 HydrophobicContact CG1-CD2 4.42Å; V313-R383 HydrophobicContact CG2-CB 3.71Å; V313-I387 HydrophobicContact CG2-CD1 4.09Å; V313-I387 HydrophobicContact CG2-CG1 4.38Å
314	L	91.9	Very high	90.7	Very high	54 Å²	54	55.5 Å²	55.5	28%	0.283	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.2	178.6	62.6	0	0	0	111.9	V299 F310 W311 L312 R318	V299-L314 HydrophobicContact CG2-CD2 4.35Å; F310-L314 HydrophobicContact CD2-CB 4.14Å; F310-L314 HydrophobicContact CD2-CD2 4.46Å; F310-L314 HydrophobicContact CE2-CD2 4.04Å; F310-L314 PolarHBondContact O-N 3.24Å; W311-L314 HydrophobicContact CE3-CD2 4.15Å; W311-L314 HydrophobicContact CZ3-CD2 4.04Å; W311-L314 PolarHBondContact O-N 3.18Å; L312-L314 VanDerWaalsContact C-N 3.29Å; L312-L314 PolarHBondContact O-N 3.41Å; L314-R318 HydrophobicContact CD1-CG 4.3Å; L314-R318 WeakPolarHBondContact O-CD 3.45Å; L314-R318 WeakPolarHBondContact O-CG 3.39Å; L314-R318 PolarHBondContact O-N 2.87Å; L314-R318 VanDerWaalsContact O-N 3.13Å
315	S	90.2	Very high	90.9	Very high	37 Å²	37	55 Å²	55	26%	0.259	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-48.3	175.8	-175	0	0	0	0	111.1	W311 L312 V313 I317 R318 Q319	W311-S315 PolarHBondContact O-N 2.89Å; L312-S315 WeakPolarHBondContact O-CB 3.44Å; L312-S315 PolarHBondContact O-N 3.34Å; V313-S315 PolarHBondContact O-N 3.5Å; S315-I317 PolarHBondContact O-N 2.88Å; S315-R318 PolarHBondContact O-N 3.44Å; S315-Q319 PolarHBondContact O-N 3.26Å
316	D	92.3	Very high	91.1	Very high	47 Å²	47	50.5 Å²	50.5	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-64.9	-41.3	-178	-62.9	-23.8	0	0	0	111.7	L312 V313 R318 Q319 G320	L312-D316 PolarHBondContact O-N 3.42Å; V313-D316 PolarHBondContact O-N 3.02Å; D316-R318 PolarHBondContact O-N 3.4Å; D316-Q319 PolarHBondContact O-N 3.47Å; D316-G320 PolarHBondContact O-N 2.91Å
317	I	93	Very high	91.3	Very high	68 Å²	68	46.3 Å²	46.3	35%	0.349	25%	0.245	S	C	.	.	H	α-helix	trans	-60.8	-43.8	175.4	-71.5	172	0	0	0	111.4	V313 S315 G320 L321 F376	V313-I317 HydrophobicContact CG1-CD1 3.71Å; V313-I317 HydrophobicContact CG1-CG1 4.3Å; V313-I317 WeakPolarHBondContact O-CB 3.09Å; V313-I317 WeakPolarHBondContact O-CG1 3.33Å; V313-I317 PolarHBondContact O-N 3.15Å; S315-I317 PolarHBondContact O-N 2.88Å; I317-G320 PolarHBondContact O-N 3.06Å; I317-L321 VanDerWaalsContact O-CB 3.27Å; I317-L321 WeakPolarHBondContact O-CB 3.39Å; I317-L321 PolarHBondContact O-N 3.11Å; I317-F376 HydrophobicContact CD1-CE2 3.88Å; I317-F376 HydrophobicContact CG1-CD2 4.44Å; I317-F376 HydrophobicContact CG1-CE2 3.88Å
318	R	94.9	Very high	91.6	Very high	14 Å²	14	44.9 Å²	44.9	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-42.4	-179.5	-70.9	165.2	63.7	-152.5	4.1	111.3	I294 L295 C297 E300 L314 S315 D316 F322	I294-R318 HydrophobicContact CG2-CG 3.98Å; I294-R318 PolarHBondContact O-NE 3.3Å; I294-R318 PolarHBondContact O-NH2 2.87Å; L295-R318 HydrophobicContact CD1-CB 4.2Å; L295-R318 PolarHBondContact O-NH2 2.83Å; C297-R318 PolarHBondContact O-NH2 3.46Å; E300-R318 IonicContact OE1-CZ 2.8Å; E300-R318 IonicContact OE1-NH1 2.92Å; E300-R318 PolarHBondContact OE1-NH1 3.49Å; E300-R318 IonicContact OE1-NH2 3.27Å; E300-R318 IonicContact OE2-NH1 3.18Å; L314-R318 HydrophobicContact CD1-CG 4.3Å; L314-R318 WeakPolarHBondContact O-CD 3.45Å; L314-R318 WeakPolarHBondContact O-CG 3.39Å; L314-R318 PolarHBondContact O-N 2.87Å; L314-R318 VanDerWaalsContact O-N 3.13Å; S315-R318 PolarHBondContact O-N 3.44Å; D316-R318 PolarHBondContact O-N 3.4Å; R318-F322 PolarHBondContact O-N 2.86Å
319	Q	93.7	Very high	91.9	Very high	76 Å²	76	40.4 Å²	40.4	36%	0.355	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-46.6	176.8	-178.5	172	-23.8	0	0	111.5	L295 S315 D316 L321 F322 Y323	L295-Q319 HydrophobicContact CD1-CB 4.22Å; S315-Q319 PolarHBondContact O-N 3.26Å; D316-Q319 PolarHBondContact O-N 3.47Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 3.43Å; Q319-F322 PolarHBondContact O-N 3.15Å; Q319-Y323 HydrophobicContact CG-CD2 4.11Å; Q319-Y323 HydrophobicContact CG-CE1 4.21Å; Q319-Y323 HydrophobicContact CG-CE2 3.41Å; Q319-Y323 VanDerWaalsContact CG-CE2 3.41Å; Q319-Y323 VanDerWaalsContact CG-CZ 3.46Å; Q319-Y323 PolarHBondContact NE2-OH 3.47Å; Q319-Y323 PolarHBondContact O-N 3.27Å
320	G	94	Very high	92.3	Very high	36 Å²	36	40 Å²	40	37%	0.371	21%	0.211	S	C	.	.	H	α-helix	trans	-59.3	-41.4	175.8	0	0	0	0	0	113	D316 I317 F322 Y323 A324	D316-G320 PolarHBondContact O-N 2.91Å; I317-G320 PolarHBondContact O-N 3.06Å; G320-F322 PolarHBondContact O-N 2.84Å; G320-Y323 PolarHBondContact O-N 3.21Å; G320-A324 WeakPolarHBondContact O-CB 3.3Å; G320-A324 PolarHBondContact O-N 3.25Å
321	L	94.8	Very high	92.3	Very high	77 Å²	77	36.1 Å²	36.1	40%	0.403	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-41.6	176.7	-179.1	64.4	0	0	0	112.3	I317 Q319 T325	I317-L321 VanDerWaalsContact O-CB 3.27Å; I317-L321 WeakPolarHBondContact O-CB 3.39Å; I317-L321 PolarHBondContact O-N 3.11Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 3.43Å; L321-T325 WeakPolarHBondContact O-CB 3.27Å; L321-T325 PolarHBondContact O-N 2.86Å; L321-T325 VanDerWaalsContact O-N 3.1Å; L321-T325 PolarHBondContact O-OG1 2.76Å
322	F	96	Very high	92.2	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-47.1	175.2	171.1	-107.9	0	0	0	111.3	L288 L292 L295 R318 Q319 G320 T325 L326 W507 V511	L288-F322 HydrophobicContact CD1-CD2 4.37Å; L288-F322 HydrophobicContact CD1-CE2 3.99Å; L292-F322 HydrophobicContact CB-CD2 4.21Å; L292-F322 HydrophobicContact CB-CE2 4.13Å; L292-F322 HydrophobicContact CD1-CD2 4.32Å; L292-F322 HydrophobicContact CD1-CE2 4.02Å; L292-F322 HydrophobicContact CD1-CZ 4.4Å; L295-F322 HydrophobicContact CD2-CB 3.99Å; L295-F322 HydrophobicContact CD2-CD1 3.84Å; L295-F322 HydrophobicContact CD2-CG 3.85Å; R318-F322 PolarHBondContact O-N 2.86Å; Q319-F322 PolarHBondContact O-N 3.15Å; G320-F322 PolarHBondContact O-N 2.84Å; F322-T325 PolarHBondContact O-N 3.49Å; F322-L326 HydrophobicContact CE1-CD2 4.32Å; F322-L326 HydrophobicContact CZ-CD2 4.31Å; F322-L326 WeakPolarHBondContact O-CB 3.46Å; F322-L326 PolarHBondContact O-N 3.49Å; F322-W507 HydrophobicContact CE1-CB 4.33Å; F322-W507 HydrophobicContact CZ-CB 4.17Å; F322-V511 HydrophobicContact CE2-CG2 4.13Å; F322-V511 HydrophobicContact CZ-CG2 4.4Å
323	Y	93.8	Very high	92.3	Very high	115 Å²	115	34.5 Å²	34.5	45%	0.451	19%	0.187	S	C	.	.	H	α-helix	trans	-61.9	-45.4	178.4	-63.5	-21.5	0	0	0	112.7	Q319 G320 T325 L326 V327	Q319-Y323 HydrophobicContact CG-CD2 4.11Å; Q319-Y323 HydrophobicContact CG-CE1 4.21Å; Q319-Y323 HydrophobicContact CG-CE2 3.41Å; Q319-Y323 VanDerWaalsContact CG-CE2 3.41Å; Q319-Y323 VanDerWaalsContact CG-CZ 3.46Å; Q319-Y323 PolarHBondContact NE2-OH 3.47Å; Q319-Y323 PolarHBondContact O-N 3.27Å; G320-Y323 PolarHBondContact O-N 3.21Å; Y323-T325 VanDerWaalsContact C-N 3.27Å; Y323-T325 PolarHBondContact O-N 3.06Å; Y323-L326 PolarHBondContact O-N 2.85Å; Y323-V327 WeakPolarHBondContact O-CB 3.32Å; Y323-V327 VanDerWaalsContact O-CG2 3.28Å; Y323-V327 WeakPolarHBondContact O-CG2 3.45Å; Y323-V327 PolarHBondContact O-N 3.05Å
324	A	93.9	Very high	91.9	Very high	21 Å²	21	33.9 Å²	33.9	17%	0.174	18%	0.183	C	C	.	.	H	α-helix	trans	-55.8	-45.6	175.8	0	0	0	0	0	111.4	G320 C328 C372	G320-A324 WeakPolarHBondContact O-CB 3.3Å; G320-A324 PolarHBondContact O-N 3.25Å; A324-C328 WeakPolarHBondContact O-CB 3.44Å; A324-C328 PolarHBondContact O-N 3.25Å; A324-C328 PolarHBondContact O-SG 3.43Å; A324-C372 WeakPolarHBondContact CB-SG 3.23Å
325	T	93.6	Very high	91.4	Very high	15 Å²	15	31.8 Å²	31.8	9%	0.092	17%	0.174	C	C	.	.	H	α-helix	trans	-68.4	-38.8	-179.5	-55.9	0	0	0	0	112.4	I287 L288 C291 L321 F322 Y323 C328 F329	I287-T325 HydrophobicContact CG2-CG2 3.82Å; L288-T325 HydrophobicContact CB-CG2 4.1Å; L288-T325 HydrophobicContact CD1-CG2 4.03Å; C291-T325 HydrophobicContact CB-CG2 4.43Å; C291-T325 PolarHBondContact SG-OG1 2.85Å; C291-T325 VanDerWaalsContact SG-OG1 3.33Å; L321-T325 WeakPolarHBondContact O-CB 3.27Å; L321-T325 PolarHBondContact O-N 2.86Å; L321-T325 VanDerWaalsContact O-N 3.1Å; L321-T325 PolarHBondContact O-OG1 2.76Å; F322-T325 PolarHBondContact O-N 3.49Å; Y323-T325 VanDerWaalsContact C-N 3.27Å; Y323-T325 PolarHBondContact O-N 3.06Å; T325-C328 PolarHBondContact O-N 3.07Å; T325-F329 WeakPolarHBondContact O-CB 3.29Å; T325-F329 PolarHBondContact O-N 3.22Å
326	L	93.9	Very high	90.8	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.042	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-44.4	177.2	-178.2	66.1	0	0	0	111.9	L288 F322 Y323 F329 W330 W507 Y510	L288-L326 HydrophobicContact CD1-CB 4.17Å; L288-L326 HydrophobicContact CD1-CD1 4.17Å; L288-L326 HydrophobicContact CD2-CD1 4.44Å; F322-L326 HydrophobicContact CE1-CD2 4.32Å; F322-L326 HydrophobicContact CZ-CD2 4.31Å; F322-L326 WeakPolarHBondContact O-CB 3.46Å; F322-L326 PolarHBondContact O-N 3.49Å; Y323-L326 PolarHBondContact O-N 2.85Å; L326-F329 HydrophobicContact CD1-CD1 4.44Å; L326-F329 WeakPolarHBondContact O-CB 3.41Å; L326-F329 PolarHBondContact O-N 2.88Å; L326-W330 HydrophobicContact CD1-CZ2 3.99Å; L326-W330 HydrophobicContact CD2-CH2 3.96Å; L326-W330 HydrophobicContact CD2-CZ2 3.81Å; L326-W330 HydrophobicContact CG-CH2 4.12Å; L326-W330 HydrophobicContact CG-CZ2 3.72Å; L326-W330 PolarHBondContact O-N 3.49Å; L326-W507 HydrophobicContact CD1-CE3 4.39Å; L326-W507 HydrophobicContact CD1-CZ3 4.1Å; L326-W507 HydrophobicContact CD2-CD2 4.34Å; L326-W507 HydrophobicContact CD2-CE3 3.8Å; L326-W507 HydrophobicContact CD2-CH2 3.95Å; L326-W507 HydrophobicContact CD2-CZ2 4.44Å; L326-W507 HydrophobicContact CD2-CZ3 3.6Å; L326-W507 HydrophobicContact CG-CZ3 4.41Å; L326-Y510 HydrophobicContact CD1-CE1 4.09Å
327	V	92.6	Very high	90	Very high	36 Å²	36	32.3 Å²	32.3	22%	0.218	17%	0.171	C	C	.	.	H	α-helix	trans	-63.3	-44.3	175.6	169.2	0	0	0	0	110.5	Y323 F329 W330 L331 V368 Y418	Y323-V327 WeakPolarHBondContact O-CB 3.32Å; Y323-V327 VanDerWaalsContact O-CG2 3.28Å; Y323-V327 WeakPolarHBondContact O-CG2 3.45Å; Y323-V327 PolarHBondContact O-N 3.05Å; V327-F329 VanDerWaalsContact C-N 3.31Å; V327-F329 PolarHBondContact O-N 3.17Å; V327-W330 PolarHBondContact O-N 3.22Å; V327-L331 PolarHBondContact O-N 3.27Å; V327-V368 HydrophobicContact CG1-CG1 3.99Å; V327-V368 HydrophobicContact CG1-CG2 3.99Å; V327-Y418 HydrophobicContact CG1-CD1 4.11Å; V327-Y418 HydrophobicContact CG1-CD2 4.03Å; V327-Y418 HydrophobicContact CG1-CE1 3.56Å; V327-Y418 HydrophobicContact CG1-CE2 3.44Å; V327-Y418 VanDerWaalsContact CG1-CE2 3.44Å; V327-Y418 HydrophobicContact CG1-CG 4.34Å; V327-Y418 WeakPolarHBondContact CG1-OH 3.28Å; V327-Y418 PolarHBondContact O-OH 3.29Å
328	C	91.4	Very high	88.8	Confident	33 Å²	33	30 Å²	30	22%	0.223	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-40.4	173.8	-70.7	0	0	0	0	112.1	A324 T325 L331 V332	A324-C328 WeakPolarHBondContact O-CB 3.44Å; A324-C328 PolarHBondContact O-N 3.25Å; A324-C328 PolarHBondContact O-SG 3.43Å; T325-C328 PolarHBondContact O-N 3.07Å; C328-L331 PolarHBondContact O-N 3.23Å; C328-V332 WeakPolarHBondContact O-CG2 3.29Å; C328-V332 PolarHBondContact O-N 3.25Å
329	F	92.3	Very high	86.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-46.3	176.7	164.5	-105.9	0	0	0	112.1	L281 T284 I285 L288 T325 L326 V327 L331 V332 F333 L461 Y510 V514	L281-F329 HydrophobicContact CD1-CE2 4.14Å; T284-F329 HydrophobicContact CG2-CB 3.93Å; T284-F329 HydrophobicContact CG2-CD2 4.15Å; I285-F329 HydrophobicContact CD1-CE2 4.24Å; I285-F329 HydrophobicContact CG1-CD2 4.13Å; I285-F329 HydrophobicContact CG1-CE2 3.59Å; I285-F329 HydrophobicContact CG1-CZ 4.49Å; L288-F329 HydrophobicContact CD2-CB 4.26Å; L288-F329 HydrophobicContact CD2-CD1 3.91Å; L288-F329 HydrophobicContact CD2-CD2 4.34Å; L288-F329 HydrophobicContact CD2-CE1 4.34Å; L288-F329 HydrophobicContact CD2-CG 3.89Å; T325-F329 WeakPolarHBondContact O-CB 3.29Å; T325-F329 PolarHBondContact O-N 3.22Å; L326-F329 HydrophobicContact CD1-CD1 4.44Å; L326-F329 WeakPolarHBondContact O-CB 3.41Å; L326-F329 PolarHBondContact O-N 2.88Å; V327-F329 VanDerWaalsContact C-N 3.31Å; V327-F329 PolarHBondContact O-N 3.17Å; F329-L331 VanDerWaalsContact C-N 3.34Å; F329-L331 PolarHBondContact O-N 3.46Å; F329-V332 PolarHBondContact O-N 3.19Å; F329-F333 HydrophobicContact CE2-CB 4.33Å; F329-F333 HydrophobicContact CZ-CB 4.44Å; F329-F333 WeakPolarHBondContact O-CB 3.27Å; F329-F333 PolarHBondContact O-N 3.43Å; F329-L461 HydrophobicContact CE1-CD2 4.41Å; F329-L461 HydrophobicContact CZ-CD2 3.88Å; F329-Y510 HydrophobicContact CE1-CE1 4.31Å; F329-V514 HydrophobicContact CE2-CG1 4.44Å; F329-V514 HydrophobicContact CZ-CG1 4.05Å
330	W	91.6	Very high	84.8	Confident	47 Å²	47	34.8 Å²	34.8	18%	0.178	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-42.4	177.1	-65.8	-25.1	0	0	0	112.5	L326 V327 F333 T334 L422 T465 W507 Y510	L326-W330 HydrophobicContact CD1-CZ2 3.99Å; L326-W330 HydrophobicContact CD2-CH2 3.96Å; L326-W330 HydrophobicContact CD2-CZ2 3.81Å; L326-W330 HydrophobicContact CG-CH2 4.12Å; L326-W330 HydrophobicContact CG-CZ2 3.72Å; L326-W330 PolarHBondContact O-N 3.49Å; V327-W330 PolarHBondContact O-N 3.22Å; W330-F333 PolarHBondContact O-N 3.15Å; W330-T334 PolarHBondContact O-N 3.22Å; W330-T334 PolarHBondContact O-OG1 2.92Å; W330-T334 VanDerWaalsContact O-OG1 3.07Å; W330-L422 HydrophobicContact CB-CD1 4.41Å; W330-T465 HydrophobicContact CD2-CG2 4.39Å; W330-T465 HydrophobicContact CZ2-CG2 3.85Å; W330-W507 AromaticContact CH2-CH2 3.86Å; W330-W507 HydrophobicContact CH2-CH2 3.86Å; W330-W507 HydrophobicContact CH2-CZ3 4.46Å; W330-W507 AromaticContact CZ2-CH2 3.56Å; W330-W507 HydrophobicContact CZ2-CH2 3.56Å; W330-W507 AromaticContact CZ2-CZ3 3.79Å; W330-W507 HydrophobicContact CZ2-CZ3 3.79Å; W330-Y510 PolarHBondContact NE1-OH 2.88Å
331	L	88.4	Confident	82.3	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-49.6	177.4	-171.6	155.5	0	0	0	111.9	V327 C328 F329 F333 G335 Y361 R364 Y418 Y421	V327-L331 PolarHBondContact O-N 3.27Å; C328-L331 PolarHBondContact O-N 3.23Å; F329-L331 VanDerWaalsContact C-N 3.34Å; F329-L331 PolarHBondContact O-N 3.46Å; L331-F333 VanDerWaalsContact C-N 3.35Å; L331-G335 PolarHBondContact O-N 3Å; L331-Y361 HydrophobicContact CD2-CD1 4.04Å; L331-Y361 HydrophobicContact CD2-CE1 4.48Å; L331-R364 HydrophobicContact CD1-CB 4.03Å; L331-Y418 HydrophobicContact CB-CE2 4.28Å; L331-Y418 HydrophobicContact CD1-CD2 4.3Å; L331-Y418 HydrophobicContact CD1-CE2 3.94Å; L331-Y421 HydrophobicContact CD1-CD1 4.28Å; L331-Y421 HydrophobicContact CD1-CE1 4.05Å; L331-Y421 HydrophobicContact CG-CE1 4.28Å
332	V	86.4	Confident	79.6	Confident	11 Å²	11	40.9 Å²	40.9	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-42.4	178.2	173.4	0	0	0	0	110.4	I280 T284 C328 F329 G335 E336	I280-V332 HydrophobicContact CG1-CG1 4.1Å; I280-V332 HydrophobicContact CG2-CG1 4.29Å; T284-V332 HydrophobicContact CG2-CB 4.45Å; C328-V332 WeakPolarHBondContact O-CG2 3.29Å; C328-V332 PolarHBondContact O-N 3.25Å; F329-V332 PolarHBondContact O-N 3.19Å; V332-G335 PolarHBondContact O-N 3.3Å; V332-E336 HydrophobicContact CG1-CG 4.08Å; V332-E336 WeakPolarHBondContact O-CB 3.44Å; V332-E336 VanDerWaalsContact O-CG 3.3Å; V332-E336 WeakPolarHBondContact O-CG 3.26Å; V332-E336 PolarHBondContact O-N 3.28Å
333	F	87.5	Confident	76.6	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-49.4	179.4	178	-101.3	0	0	0	112	L281 F329 W330 L331 H337 F458 L461 Y518	L281-F333 HydrophobicContact CD1-CB 4.19Å; L281-F333 HydrophobicContact CD1-CD2 3.86Å; L281-F333 HydrophobicContact CD2-CD2 4.4Å; F329-F333 HydrophobicContact CE2-CB 4.33Å; F329-F333 HydrophobicContact CZ-CB 4.44Å; F329-F333 WeakPolarHBondContact O-CB 3.27Å; F329-F333 PolarHBondContact O-N 3.43Å; W330-F333 PolarHBondContact O-N 3.15Å; L331-F333 VanDerWaalsContact C-N 3.35Å; F333-H337 AromaticContact CD2-CE1 3.53Å; F333-H337 AromaticContact CD2-ND1 3.76Å; F333-H337 AromaticContact CE2-CE1 3.11Å; F333-H337 WeakPolarHBondContact CE2-CE1 3.46Å; F333-H337 AromaticContact CE2-ND1 3.6Å; F333-H337 AromaticContact CE2-NE2 3.89Å; F333-H337 AromaticContact CZ-CE1 3.73Å; F333-H337 AromaticContact CZ-ND1 3.94Å; F333-H337 PolarHBondContact O-N 2.97Å; F333-H337 PolarHBondContact O-ND1 2.92Å; F333-F458 HydrophobicContact CD1-CD2 4.42Å; F333-F458 HydrophobicContact CD1-CE2 4.39Å; F333-F458 AromaticContact CE1-CD2 3.64Å; F333-F458 HydrophobicContact CE1-CD2 3.64Å; F333-F458 AromaticContact CE1-CE2 3.92Å; F333-F458 HydrophobicContact CE1-CE2 3.92Å; F333-F458 AromaticContact CZ-CD2 3.95Å; F333-F458 HydrophobicContact CZ-CD2 3.95Å; F333-L461 HydrophobicContact CD1-CD2 4.11Å; F333-L461 HydrophobicContact CD2-CD2 3.68Å; F333-L461 HydrophobicContact CE1-CB 4.13Å; F333-L461 HydrophobicContact CE1-CD2 3.76Å; F333-L461 HydrophobicContact CE1-CG 4.2Å; F333-L461 HydrophobicContact CE2-CB 4.36Å; F333-L461 HydrophobicContact CE2-CD2 3.3Å; F333-L461 HydrophobicContact CE2-CG 4.37Å; F333-L461 HydrophobicContact CG-CD2 4.07Å; F333-L461 HydrophobicContact CZ-CB 3.67Å; F333-L461 HydrophobicContact CZ-CD2 3.34Å; F333-L461 HydrophobicContact CZ-CG 3.96Å; F333-Y518 HydrophobicContact CE2-CE1 4.07Å; F333-Y518 AromaticContact CE2-CZ 3.84Å; F333-Y518 VanDerWaalsContact CE2-OH 3.25Å; F333-Y518 WeakPolarHBondContact CE2-OH 3.37Å
334	T	84.6	Confident	73.7	Confident	5 Å²	5	46 Å²	46	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-39.9	178.5	-51.9	0	0	0	0	111.6	W330 H337 M338 L425 V426 A429 F458	W330-T334 PolarHBondContact O-N 3.22Å; W330-T334 PolarHBondContact O-OG1 2.92Å; W330-T334 VanDerWaalsContact O-OG1 3.07Å; T334-H337 PolarHBondContact O-N 3.5Å; T334-M338 WeakPolarHBondContact O-CG 3.33Å; T334-M338 PolarHBondContact O-N 3.45Å; T334-L425 HydrophobicContact CG2-CB 3.78Å; T334-V426 HydrophobicContact CG2-CG2 4.05Å; T334-A429 HydrophobicContact CG2-CB 4.25Å; T334-F458 HydrophobicContact CG2-CE2 4.35Å; T334-F458 HydrophobicContact CG2-CZ 4.39Å
335	G	80.3	Confident	70.7	Confident	9 Å²	9	48.2 Å²	48.2	9%	0.093	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-46.5	177.7	0	0	0	0	0	113.6	L331 V332 H337 M338	L331-G335 PolarHBondContact O-N 3Å; V332-G335 PolarHBondContact O-N 3.3Å; G335-H337 VanDerWaalsContact C-N 3.3Å; G335-H337 PolarHBondContact O-N 3.02Å; G335-M338 WeakPolarHBondContact O-CB 3.23Å; G335-M338 PolarHBondContact O-N 3.14Å
336	E	78.7	Confident	67.7	Low	71 Å²	71	55.1 Å²	55.1	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-28.8	-178.1	-74.4	-66.9	111.9	0	0	113.4	I280 V332 Y361	I280-E336 HydrophobicContact CG2-CG 3.66Å; I280-E336 WeakPolarHBondContact CG2-OE1 3.17Å; I280-E336 WeakPolarHBondContact CG2-OE2 3.31Å; V332-E336 HydrophobicContact CG1-CG 4.08Å; V332-E336 WeakPolarHBondContact O-CB 3.44Å; V332-E336 VanDerWaalsContact O-CG 3.3Å; V332-E336 WeakPolarHBondContact O-CG 3.26Å; V332-E336 PolarHBondContact O-N 3.28Å; E336-Y361 PolarHBondContact OE1-OH 3.36Å; E336-Y361 VanDerWaalsContact OE1-OH 3.12Å
337	H	74.8	Confident	64.9	Low	25 Å²	25	64.2 Å²	64.2	12%	0.116	36%	0.356	C	S	.	.	H	α-helix	trans	-83.4	-15.2	177.4	-69.7	82.9	0	0	0	112.9	F333 T334 G335 M339 F458	F333-H337 AromaticContact CD2-CE1 3.53Å; F333-H337 AromaticContact CD2-ND1 3.76Å; F333-H337 AromaticContact CE2-CE1 3.11Å; F333-H337 WeakPolarHBondContact CE2-CE1 3.46Å; F333-H337 AromaticContact CE2-ND1 3.6Å; F333-H337 AromaticContact CE2-NE2 3.89Å; F333-H337 AromaticContact CZ-CE1 3.73Å; F333-H337 AromaticContact CZ-ND1 3.94Å; F333-H337 PolarHBondContact O-N 2.97Å; F333-H337 PolarHBondContact O-ND1 2.92Å; T334-H337 PolarHBondContact O-N 3.5Å; G335-H337 VanDerWaalsContact C-N 3.3Å; G335-H337 PolarHBondContact O-N 3.02Å; H337-M339 VanDerWaalsContact C-N 3.33Å; H337-M339 PolarHBondContact O-N 2.82Å; H337-F458 HydrophobicContact CB-CB 4.32Å; H337-F458 HydrophobicContact CB-CD2 3.38Å; H337-F458 HydrophobicContact CB-CE2 3.93Å; H337-F458 HydrophobicContact CB-CG 4.04Å; H337-F458 AromaticContact CG-CD2 3.55Å
338	M	68.7	Low	61.9	Low	20 Å²	20	68.1 Å²	68.1	10%	0.099	39%	0.385	C	S	.	.			trans	-77.1	84.2	166.6	-69.4	-175.9	64.8	0	0	109.4	T334 G335 Q340 L425 K428 A429	T334-M338 WeakPolarHBondContact O-CG 3.33Å; T334-M338 PolarHBondContact O-N 3.45Å; G335-M338 WeakPolarHBondContact O-CB 3.23Å; G335-M338 PolarHBondContact O-N 3.14Å; M338-Q340 PolarHBondContact O-N 3.44Å; M338-L425 HydrophobicContact CE-CD2 4.4Å; M338-L425 HydrophobicContact SD-CB 4.43Å; M338-L425 HydrophobicContact SD-CD2 3.4Å; M338-L425 WeakPolarHBondContact SD-CD2 3.27Å; M338-K428 HydrophobicContact CE-CB 3.54Å; M338-K428 HydrophobicContact CE-CD 4.19Å; M338-K428 HydrophobicContact SD-CB 4.27Å; M338-A429 HydrophobicContact CG-CB 3.79Å; M338-A429 HydrophobicContact SD-CB 4.29Å
339	M	51.9	Low	59.1	Low	64 Å²	64	76 Å²	76	32%	0.315	42%	0.416	S	S	.	.			trans	-70.5	84.2	170.6	-25.4	163.8	-179.6	0	0	108.3	H337 K436 Y451 I454	H337-M339 VanDerWaalsContact C-N 3.33Å; H337-M339 PolarHBondContact O-N 2.82Å; M339-K436 PolarHBondContact O-NZ 3.25Å; M339-K436 VanDerWaalsContact O-NZ 3.13Å; M339-Y451 HydrophobicContact CE-CD1 3.88Å; M339-Y451 HydrophobicContact CE-CE1 4.08Å; M339-Y451 HydrophobicContact SD-CD1 3.96Å; M339-Y451 HydrophobicContact SD-CE1 3.62Å; M339-I454 HydrophobicContact CE-CB 3.98Å; M339-I454 HydrophobicContact CE-CD1 3.56Å; M339-I454 HydrophobicContact CE-CG1 4.36Å; M339-I454 HydrophobicContact CE-CG2 3.53Å
340	Q	51.9	Low	56.3	Low	125 Å²	125	81.6 Å²	81.6	58%	0.584	45%	0.454	S	S	*	.			trans	-92.1	118.2	173.8	-162.7	150.3	15	0	0	108.3	M338 S342	M338-Q340 PolarHBondContact O-N 3.44Å; Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 2.97Å; Q340-S342 PolarHBondContact O-OG 3.5Å; Q340-S342 VanDerWaalsContact O-OG 3.14Å
341	E	42.4	Very low	53.6	Low	170 Å²	170	86.1 Å²	86.1	79%	0.794	48%	0.482	S	S	*	.			trans	-54.6	91.6	171.7	-74.7	170.5	166.9	0	0	109.4	S343	E341-S343 PolarHBondContact O-N 3.1Å
342	S	37.9	Very low	50.8	Low	72 Å²	72	92.3 Å²	92.3	50%	0.503	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	24.2	172.5	-40.7	0	0	0	0	111.2	Q340 R347	Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 2.97Å; Q340-S342 PolarHBondContact O-OG 3.5Å; Q340-S342 VanDerWaalsContact O-OG 3.14Å; S342-R347 PolarHBondContact O-NH1 2.96Å; S342-R347 PolarHBondContact O-NH2 3.08Å; S342-R347 VanDerWaalsContact O-NH2 3.16Å
343	S	32.4	Very low	48.2	Very low	108 Å²	108	98.5 Å²	98.5	76%	0.755	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	8.2	-177.8	-57.1	0	0	0	0	112.9	E341 G345	E341-S343 PolarHBondContact O-N 3.1Å; S343-G345 PolarHBondContact O-N 3.17Å
344	S	31.9	Very low	45.6	Very low	117 Å²	117	104 Å²	104	82%	0.818	59%	0.586	S	S	*	*	S	Bend	trans	-76.5	94.4	168.6	-171.6	0	0	0	0	110.6	N346	S344-N346 PolarHBondContact O-N 2.77Å
345	G	30.8	Very low	43.2	Very low	69 Å²	69	110.2 Å²	110.2	71%	0.711	61%	0.61	S	S	*	*	S	Bend	trans	84.6	-7.8	130.5	0	0	0	0	0	121	S343	S343-G345 PolarHBondContact O-N 3.17Å
346	N	31.6	Very low	41.2	Very low	160 Å²	160	114 Å²	114	86%	0.856	65%	0.649	S	S	*	*			trans	-138.4	21.2	-175.5	-102.1	-14.3	0	0	0	117.5	S344 S348	S344-N346 PolarHBondContact O-N 2.77Å; N346-S348 VanDerWaalsContact C-N 3.33Å; N346-S348 PolarHBondContact O-N 3.43Å
347	R	34.3	Very low	39.5	Very low	198 Å²	198	114.6 Å²	114.6	75%	0.747	65%	0.654	S	S	*	*			trans	-90.8	62.6	172.5	-73.7	-173.4	-164.3	151.3	-0.9	112.9	S342	S342-R347 PolarHBondContact O-NH1 2.96Å; S342-R347 PolarHBondContact O-NH2 3.08Å; S342-R347 VanDerWaalsContact O-NH2 3.16Å
348	S	30.6	Very low	37.9	Very low	119 Å²	119	116.8 Å²	116.8	83%	0.832	67%	0.666	S	S	*	*			trans	-99.2	72.2	149.5	-167.7	0	0	0	0	108.4	N346	N346-S348 VanDerWaalsContact C-N 3.33Å; N346-S348 PolarHBondContact O-N 3.43Å
349	K	33.3	Very low	36.9	Very low	199 Å²	199	119 Å²	119	87%	0.865	70%	0.695	S	S	*	*			trans	-158.6	71.8	157	-113.5	176.6	-175.2	176.2	0	107.2	N351	K349-N351 PolarHBondContact O-N 3.38Å
350	S	32.5	Very low	37.1	Very low	116 Å²	116	120.9 Å²	120.9	81%	0.811	71%	0.705	S	S	*	*			trans	-67.6	103.7	156.6	-177.6	0	0	0	0	106.6
351	N	34	Very low	37.7	Very low	142 Å²	142	116.7 Å²	116.7	76%	0.759	69%	0.685	S	S	*	*			trans	-142.3	101.3	155.9	-138.2	3.8	0	0	0	108	K349 N353	K349-N351 PolarHBondContact O-N 3.38Å; N351-N353 PolarHBondContact O-N 3.47Å
352	N	30.8	Very low	38.9	Very low	132 Å²	132	115.4 Å²	115.4	71%	0.706	67%	0.673	S	S	*	*			trans	0.1	101.7	154.5	-57.3	-32.6	0	0	0	114.4
353	N	32	Very low	40.5	Very low	141 Å²	141	115.6 Å²	115.6	75%	0.754	67%	0.672	S	S	*	*			trans	-167.3	141.2	145.3	-95	-22.9	0	0	0	111.3	N351 Y355	N351-N353 PolarHBondContact O-N 3.47Å; N353-Y355 VanDerWaalsContact C-N 3.3Å; N353-Y355 HydrophobicContact CB-CD2 3.71Å; N353-Y355 HydrophobicContact CB-CE2 3.99Å; N353-Y355 PolarHBondContact O-N 2.95Å
354	C	31.8	Very low	42.5	Very low	123 Å²	123	113.6 Å²	113.6	83%	0.831	65%	0.648	S	S	*	*	S	Bend	trans	-62.7	66.1	-170.9	-170.6	0	0	0	0	113.7
355	Y	34.5	Very low	44.9	Very low	135 Å²	135	110.6 Å²	110.6	53%	0.529	62%	0.622	S	S	.	*			trans	-148.7	48.5	-165	-70.1	-53.5	0	0	0	116.2	N353 L357 N358	N353-Y355 VanDerWaalsContact C-N 3.3Å; N353-Y355 HydrophobicContact CB-CD2 3.71Å; N353-Y355 HydrophobicContact CB-CE2 3.99Å; N353-Y355 PolarHBondContact O-N 2.95Å; Y355-L357 PolarHBondContact O-N 2.97Å; Y355-L357 VanDerWaalsContact O-N 3.08Å; Y355-N358 HydrophobicContact CD1-CB 3.98Å; Y355-N358 WeakPolarHBondContact CD1-ND2 3.5Å; Y355-N358 WeakPolarHBondContact CD1-OD1 3.34Å; Y355-N358 WeakPolarHBondContact CE1-ND2 3.13Å; Y355-N358 HydrophobicContact CG-CB 4.08Å; Y355-N358 PolarHBondContact O-N 3.41Å
356	G	39.4	Very low	47.5	Very low	88 Å²	88	112 Å²	112	91%	0.907	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-14.9	167.5	0	0	0	0	0	114.3
357	L	41.8	Very low	50.1	Low	84 Å²	84	106.6 Å²	106.6	44%	0.44	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.6	-29.7	176.6	-135.7	86.8	0	0	0	113.8	I280 Y355 G359	I280-L357 HydrophobicContact CD1-CD1 3.89Å; I280-L357 HydrophobicContact CG1-CD1 4.27Å; Y355-L357 PolarHBondContact O-N 2.97Å; Y355-L357 VanDerWaalsContact O-N 3.08Å; L357-G359 PolarHBondContact O-N 2.96Å
358	N	41.8	Very low	52.8	Low	70 Å²	70	97.5 Å²	97.5	37%	0.374	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	-19.1	-168.3	-70.1	11.5	0	0	0	114.6	Y355	Y355-N358 HydrophobicContact CD1-CB 3.98Å; Y355-N358 WeakPolarHBondContact CD1-ND2 3.5Å; Y355-N358 WeakPolarHBondContact CD1-OD1 3.34Å; Y355-N358 WeakPolarHBondContact CE1-ND2 3.13Å; Y355-N358 HydrophobicContact CG-CB 4.08Å; Y355-N358 PolarHBondContact O-N 3.41Å
359	G	47.3	Very low	55.7	Low	68 Å²	68	94.2 Å²	94.2	70%	0.701	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-37	-171.9	0	0	0	0	0	115	L357	L357-G359 PolarHBondContact O-N 2.96Å
360	L	56.3	Low	58.4	Low	102 Å²	102	87.2 Å²	87.2	53%	0.534	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-34.8	-165.6	-156.1	75.5	0	0	0	114.5	R364	L360-R364 WeakPolarHBondContact O-CD 3.48Å; L360-R364 VanDerWaalsContact O-CZ 3.28Å; L360-R364 PolarHBondContact O-NE 3.47Å
361	Y	63.8	Low	61.4	Low	37 Å²	37	82.6 Å²	82.6	15%	0.145	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-31.7	-176.4	-69.1	-75.6	0	0	0	113	L331 E336 R364 I365	L331-Y361 HydrophobicContact CD2-CD1 4.04Å; L331-Y361 HydrophobicContact CD2-CE1 4.48Å; E336-Y361 PolarHBondContact OE1-OH 3.36Å; E336-Y361 VanDerWaalsContact OE1-OH 3.12Å; Y361-R364 WeakPolarHBondContact O-CB 3.21Å; Y361-R364 PolarHBondContact O-N 3.06Å; Y361-I365 PolarHBondContact O-N 2.83Å
362	W	69	Low	64.2	Low	143 Å²	143	78 Å²	78	54%	0.542	45%	0.452	S	S	.	.	H	α-helix	trans	-51.5	-50.5	-176.9	-170.8	-107.4	0	0	0	115	R364 I365 L366	W362-R364 PolarHBondContact O-N 3.23Å; W362-R364 VanDerWaalsContact O-N 3.1Å; W362-I365 PolarHBondContact O-N 3.43Å; W362-L366 WeakPolarHBondContact O-CB 3.49Å; W362-L366 PolarHBondContact O-N 3.47Å
363	P	70.2	Confident	67.2	Low	77 Å²	77	74 Å²	74	50%	0.5	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-22.6	179.9	24.2	-33.6	0	0	0	112.9
364	R	75.2	Confident	70.1	Confident	65 Å²	65	67.7 Å²	67.7	25%	0.245	41%	0.405	C	S	.	.	H	α-helix	trans	-88.9	-38.4	-176.5	-55.8	161	-178.7	172.9	3.9	111.6	L331 L360 Y361 W362 L366 L367 Y421	L331-R364 HydrophobicContact CD1-CB 4.03Å; L360-R364 WeakPolarHBondContact O-CD 3.48Å; L360-R364 VanDerWaalsContact O-CZ 3.28Å; L360-R364 PolarHBondContact O-NE 3.47Å; Y361-R364 WeakPolarHBondContact O-CB 3.21Å; Y361-R364 PolarHBondContact O-N 3.06Å; W362-R364 PolarHBondContact O-N 3.23Å; W362-R364 VanDerWaalsContact O-N 3.1Å; R364-L366 VanDerWaalsContact C-N 3.25Å; R364-L367 WeakPolarHBondContact O-CB 3.43Å; R364-L367 PolarHBondContact O-N 3.13Å; R364-Y421 HydrophobicContact CB-CE1 4.35Å; R364-Y421 VanDerWaalsContact CD-CZ 3.41Å; R364-Y421 WeakPolarHBondContact CD-OH 3.5Å; R364-Y421 HydrophobicContact CG-CE1 4.09Å; R364-Y421 PolarHBondContact NE-OH 3.09Å; R364-Y421 PolarHBondContact NH1-OH 3.32Å
365	I	81.8	Confident	73.1	Confident	54 Å²	54	65.5 Å²	65.5	28%	0.277	39%	0.385	S	S	.	.	H	α-helix	trans	-65.5	-35.6	169.9	-65.5	172.4	0	0	0	109.8	Y361 W362 L367 V368 A369	Y361-I365 PolarHBondContact O-N 2.83Å; W362-I365 PolarHBondContact O-N 3.43Å; I365-L367 PolarHBondContact O-N 3.37Å; I365-V368 PolarHBondContact O-N 3.42Å; I365-V368 VanDerWaalsContact O-N 3.14Å; I365-A369 WeakPolarHBondContact O-CB 3.31Å; I365-A369 PolarHBondContact O-N 2.97Å
366	L	84.9	Confident	75.9	Confident	98 Å²	98	63.8 Å²	63.8	51%	0.513	38%	0.38	S	S	.	.	H	α-helix	trans	-58	-35.1	174	-173.2	66.9	0	0	0	112.2	W362 R364 A369 S370	W362-L366 WeakPolarHBondContact O-CB 3.49Å; W362-L366 PolarHBondContact O-N 3.47Å; R364-L366 VanDerWaalsContact C-N 3.25Å; L366-A369 PolarHBondContact O-N 2.95Å; L366-S370 VanDerWaalsContact O-CB 3.24Å; L366-S370 WeakPolarHBondContact O-CB 3.35Å; L366-S370 PolarHBondContact O-N 3.16Å
367	L	87.8	Confident	78.5	Confident	47 Å²	47	64.7 Å²	64.7	25%	0.246	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-45.2	175.7	-172.3	69	0	0	0	111.9	R364 I365 S370 C371 C414 A417	R364-L367 WeakPolarHBondContact O-CB 3.43Å; R364-L367 PolarHBondContact O-N 3.13Å; I365-L367 PolarHBondContact O-N 3.37Å; L367-S370 PolarHBondContact O-N 3.03Å; L367-C371 PolarHBondContact O-N 2.87Å; L367-C414 HydrophobicContact CD1-CB 3.95Å; L367-C414 HydrophobicContact CG-CB 4.4Å; L367-A417 HydrophobicContact CD1-CB 4.35Å; L367-A417 HydrophobicContact CD2-CB 3.93Å
368	V	90.7	Very high	80.9	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.048	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-45.2	176.3	-178.3	0	0	0	0	110.1	V327 I365 S370 C371 C372 Y418	V327-V368 HydrophobicContact CG1-CG1 3.99Å; V327-V368 HydrophobicContact CG1-CG2 3.99Å; I365-V368 PolarHBondContact O-N 3.42Å; I365-V368 VanDerWaalsContact O-N 3.14Å; V368-S370 VanDerWaalsContact C-N 3.32Å; V368-S370 PolarHBondContact O-N 2.67Å; V368-C371 WeakPolarHBondContact O-CB 3.42Å; V368-C371 PolarHBondContact O-N 3.49Å; V368-C372 PolarHBondContact O-N 3.24Å; V368-C372 PolarHBondContact O-SG 3.39Å; V368-Y418 HydrophobicContact CG2-CD2 3.63Å; V368-Y418 HydrophobicContact CG2-CE2 3.93Å
369	A	91.3	Very high	83.3	Confident	50 Å²	50	61.5 Å²	61.5	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-40.4	177.5	0	0	0	0	0	112.1	I365 L366 C372 A373	I365-A369 WeakPolarHBondContact O-CB 3.31Å; I365-A369 PolarHBondContact O-N 2.97Å; L366-A369 PolarHBondContact O-N 2.95Å; A369-C372 PolarHBondContact O-N 3.39Å; A369-A373 VanDerWaalsContact O-CB 3.24Å; A369-A373 WeakPolarHBondContact O-CB 3.11Å; A369-A373 PolarHBondContact O-N 3.15Å
370	S	90.8	Very high	85.5	Confident	52 Å²	52	61.7 Å²	61.7	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-64.6	-41.5	176	-171.8	0	0	0	0	111.9	L366 L367 V368 A373 A374	L366-S370 VanDerWaalsContact O-CB 3.24Å; L366-S370 WeakPolarHBondContact O-CB 3.35Å; L366-S370 PolarHBondContact O-N 3.16Å; L367-S370 PolarHBondContact O-N 3.03Å; V368-S370 VanDerWaalsContact C-N 3.32Å; V368-S370 PolarHBondContact O-N 2.67Å; S370-A373 PolarHBondContact O-N 2.93Å; S370-A374 WeakPolarHBondContact O-CB 3.42Å; S370-A374 PolarHBondContact O-N 2.92Å
371	C	93.6	Very high	87.2	Confident	18 Å²	18	58.6 Å²	58.6	12%	0.122	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-51.5	174.2	-179.1	0	0	0	0	111.1	L367 V368 A373 A374 L375 G411 C414	L367-C371 PolarHBondContact O-N 2.87Å; V368-C371 WeakPolarHBondContact O-CB 3.42Å; V368-C371 PolarHBondContact O-N 3.49Å; C371-A373 VanDerWaalsContact C-N 3.33Å; C371-A373 PolarHBondContact O-N 3.38Å; C371-A374 PolarHBondContact O-N 3.01Å; C371-L375 WeakPolarHBondContact O-CG 3.23Å; C371-L375 PolarHBondContact O-N 3.34Å; C371-G411 PolarHBondContact SG-O 3.3Å; C371-G411 VanDerWaalsContact SG-O 3.35Å; C371-C414 HydrophobicContact CB-CB 3.75Å
372	C	94.1	Very high	88.4	Confident	45 Å²	45	58 Å²	58	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-39.5	179.3	-63.7	0	0	0	0	112.2	A324 V368 A369 F376	A324-C372 WeakPolarHBondContact CB-SG 3.23Å; V368-C372 PolarHBondContact O-N 3.24Å; V368-C372 PolarHBondContact O-SG 3.39Å; A369-C372 PolarHBondContact O-N 3.39Å; C372-F376 WeakPolarHBondContact O-CB 3.36Å; C372-F376 PolarHBondContact O-N 3.4Å
373	A	93.5	Very high	89.5	Confident	48 Å²	48	53.7 Å²	53.7	40%	0.397	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-43.3	176.6	0	0	0	0	0	111.8	A369 S370 C371 F376 I377	A369-A373 VanDerWaalsContact O-CB 3.24Å; A369-A373 WeakPolarHBondContact O-CB 3.11Å; A369-A373 PolarHBondContact O-N 3.15Å; S370-A373 PolarHBondContact O-N 2.93Å; C371-A373 VanDerWaalsContact C-N 3.33Å; C371-A373 PolarHBondContact O-N 3.38Å; A373-F376 PolarHBondContact O-N 2.94Å; A373-I377 WeakPolarHBondContact O-CB 3.33Å; A373-I377 WeakPolarHBondContact O-CD1 3.45Å; A373-I377 WeakPolarHBondContact O-CG1 3.17Å; A373-I377 PolarHBondContact O-N 2.88Å
374	A	93.9	Very high	90.5	Very high	10 Å²	10	51.2 Å²	51.2	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-47.6	177.1	0	0	0	0	0	111.8	S370 C371 I377 F378 S407 I410	S370-A374 WeakPolarHBondContact O-CB 3.42Å; S370-A374 PolarHBondContact O-N 2.92Å; C371-A374 PolarHBondContact O-N 3.01Å; A374-I377 PolarHBondContact O-N 3.46Å; A374-F378 PolarHBondContact O-N 2.84Å; A374-F378 VanDerWaalsContact O-N 3.11Å; A374-S407 PolarHBondContact O-OG 3.16Å; A374-I410 HydrophobicContact CB-CG2 4.23Å
375	L	93.4	Very high	91.3	Very high	77 Å²	77	51 Å²	51	40%	0.403	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-40.4	177.1	-65.5	177.3	0	0	0	111.8	C371 I377 F378 E379	C371-L375 WeakPolarHBondContact O-CG 3.23Å; C371-L375 PolarHBondContact O-N 3.34Å; L375-I377 PolarHBondContact O-N 3.49Å; L375-F378 WeakPolarHBondContact O-CB 3.47Å; L375-F378 PolarHBondContact O-N 2.7Å; L375-E379 WeakPolarHBondContact O-CG 3.34Å; L375-E379 PolarHBondContact O-N 2.73Å
376	F	93.8	Very high	91.7	Very high	98 Å²	98	49.4 Å²	49.4	43%	0.43	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-40.6	177.4	-179.9	-112.3	0	0	0	112.7	I317 C372 A373 F378 E379 L380	I317-F376 HydrophobicContact CD1-CE2 3.88Å; I317-F376 HydrophobicContact CG1-CD2 4.44Å; I317-F376 HydrophobicContact CG1-CE2 3.88Å; C372-F376 WeakPolarHBondContact O-CB 3.36Å; C372-F376 PolarHBondContact O-N 3.4Å; A373-F376 PolarHBondContact O-N 2.94Å; F376-F378 VanDerWaalsContact C-N 3.3Å; F376-F378 PolarHBondContact O-N 3.11Å; F376-E379 PolarHBondContact O-N 3.47Å; F376-L380 HydrophobicContact CD1-CD1 4.01Å; F376-L380 HydrophobicContact CD2-CG 4.42Å; F376-L380 HydrophobicContact CE1-CD1 3.4Å; F376-L380 HydrophobicContact CE1-CG 4.16Å; F376-L380 HydrophobicContact CE2-CD1 4.11Å; F376-L380 HydrophobicContact CE2-CD2 4.23Å; F376-L380 HydrophobicContact CE2-CG 4.03Å; F376-L380 HydrophobicContact CZ-CD1 3.47Å; F376-L380 VanDerWaalsContact CZ-CD1 3.47Å; F376-L380 HydrophobicContact CZ-CD2 4.2Å; F376-L380 HydrophobicContact CZ-CG 3.9Å; F376-L380 WeakPolarHBondContact O-CG 3.39Å; F376-L380 PolarHBondContact O-N 3.41Å
377	I	93	Very high	91.9	Very high	107 Å²	107	48.2 Å²	48.2	55%	0.549	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-41.1	174.3	-71.1	164.3	0	0	0	110.5	A373 A374 L375 A381	A373-I377 WeakPolarHBondContact O-CB 3.33Å; A373-I377 WeakPolarHBondContact O-CD1 3.45Å; A373-I377 WeakPolarHBondContact O-CG1 3.17Å; A373-I377 PolarHBondContact O-N 2.88Å; A374-I377 PolarHBondContact O-N 3.46Å; L375-I377 PolarHBondContact O-N 3.49Å; I377-A381 VanDerWaalsContact O-CB 3.29Å; I377-A381 WeakPolarHBondContact O-CB 3.38Å; I377-A381 PolarHBondContact O-N 3.24Å
378	F	93.1	Very high	92	Very high	18 Å²	18	57.3 Å²	57.3	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-49.8	176.5	171.1	-101.8	0	0	0	111.7	A374 L375 F376 L380 A381 E382 I394 W395 I408	A374-F378 PolarHBondContact O-N 2.84Å; A374-F378 VanDerWaalsContact O-N 3.11Å; L375-F378 WeakPolarHBondContact O-CB 3.47Å; L375-F378 PolarHBondContact O-N 2.7Å; F376-F378 VanDerWaalsContact C-N 3.3Å; F376-F378 PolarHBondContact O-N 3.11Å; F378-L380 VanDerWaalsContact C-N 3.34Å; F378-L380 PolarHBondContact O-N 3.36Å; F378-A381 PolarHBondContact O-N 2.86Å; F378-A381 VanDerWaalsContact O-N 3.08Å; F378-E382 WeakPolarHBondContact CZ-OE2 3.43Å; F378-E382 PolarHBondContact O-N 3.36Å; F378-I394 HydrophobicContact CD2-CD1 4.2Å; F378-I394 HydrophobicContact CE2-CD1 4.13Å; F378-I394 HydrophobicContact CE2-CG2 4.19Å; F378-W395 HydrophobicContact CE2-CZ2 4.14Å; F378-W395 AromaticContact CZ-CZ2 4Å; F378-W395 HydrophobicContact CZ-CZ2 4Å; F378-I408 HydrophobicContact CD1-CG1 4.37Å; F378-I408 HydrophobicContact CD2-CD1 4.17Å; F378-I408 HydrophobicContact CD2-CG1 4.14Å; F378-I408 HydrophobicContact CE1-CD1 4.24Å; F378-I408 HydrophobicContact CE1-CG1 4.47Å; F378-I408 HydrophobicContact CE2-CD1 3.76Å; F378-I408 HydrophobicContact CE2-CG1 4.24Å; F378-I408 HydrophobicContact CG-CG1 4.21Å; F378-I408 HydrophobicContact CZ-CD1 3.81Å; F378-I408 HydrophobicContact CZ-CG1 4.41Å
379	E	92.7	Very high	92.1	Very high	70 Å²	70	58.7 Å²	58.7	33%	0.327	32%	0.317	S	S	.	.	H	α-helix	trans	-59.7	-42	177.8	-70.3	-60.2	154.5	0	0	112.3	L375 F376 A381 E382 R383 G384	L375-E379 WeakPolarHBondContact O-CG 3.34Å; L375-E379 PolarHBondContact O-N 2.73Å; F376-E379 PolarHBondContact O-N 3.47Å; E379-A381 VanDerWaalsContact C-N 3.34Å; E379-A381 PolarHBondContact O-N 3.1Å; E379-E382 PolarHBondContact O-N 3.17Å; E379-R383 WeakPolarHBondContact O-CA 3.43Å; E379-R383 WeakPolarHBondContact O-CB 3.42Å; E379-R383 PolarHBondContact O-N 2.8Å; E379-G384 PolarHBondContact O-N 3.49Å
380	L	92.1	Very high	92.2	Very high	72 Å²	72	57 Å²	57	38%	0.377	30%	0.301	S	S	.	.	I	π-helix	trans	-66.7	-35.4	175.1	-72.7	-176.1	0	0	0	112.7	V313 F376 F378 E382 G384 V385	V313-L380 HydrophobicContact CG1-CD2 4.42Å; F376-L380 HydrophobicContact CD1-CD1 4.01Å; F376-L380 HydrophobicContact CD2-CG 4.42Å; F376-L380 HydrophobicContact CE1-CD1 3.4Å; F376-L380 HydrophobicContact CE1-CG 4.16Å; F376-L380 HydrophobicContact CE2-CD1 4.11Å; F376-L380 HydrophobicContact CE2-CD2 4.23Å; F376-L380 HydrophobicContact CE2-CG 4.03Å; F376-L380 HydrophobicContact CZ-CD1 3.47Å; F376-L380 VanDerWaalsContact CZ-CD1 3.47Å; F376-L380 HydrophobicContact CZ-CD2 4.2Å; F376-L380 HydrophobicContact CZ-CG 3.9Å; F376-L380 WeakPolarHBondContact O-CG 3.39Å; F376-L380 PolarHBondContact O-N 3.41Å; F378-L380 VanDerWaalsContact C-N 3.34Å; F378-L380 PolarHBondContact O-N 3.36Å; L380-E382 VanDerWaalsContact C-N 3.35Å; L380-G384 CarbonylContact O-C 3.59Å; L380-G384 WeakPolarHBondContact O-CA 3.3Å; L380-G384 PolarHBondContact O-N 2.76Å; L380-G384 VanDerWaalsContact O-N 3.15Å; L380-V385 PolarHBondContact O-N 3.32Å
381	A	92.2	Very high	92.3	Very high	36 Å²	36	54.5 Å²	54.5	30%	0.298	28%	0.284	S	S	.	.	I	π-helix	trans	-71	-30.3	177.8	0	0	0	0	0	112.5	I377 F378 E379 V385 Y392 I394	I377-A381 VanDerWaalsContact O-CB 3.29Å; I377-A381 WeakPolarHBondContact O-CB 3.38Å; I377-A381 PolarHBondContact O-N 3.24Å; F378-A381 PolarHBondContact O-N 2.86Å; F378-A381 VanDerWaalsContact O-N 3.08Å; E379-A381 VanDerWaalsContact C-N 3.34Å; E379-A381 PolarHBondContact O-N 3.1Å; A381-V385 VanDerWaalsContact O-CG2 3.23Å; A381-V385 WeakPolarHBondContact O-CG2 3.45Å; A381-Y392 VanDerWaalsContact O-CE1 3.23Å; A381-Y392 WeakPolarHBondContact O-CE1 3.26Å; A381-I394 HydrophobicContact CB-CD1 4.21Å
382	E	90.7	Very high	92.3	Very high	26 Å²	26	56.2 Å²	56.2	12%	0.121	29%	0.288	C	S	.	.	I	π-helix	trans	-91.1	-71.8	176.5	-175.7	169.7	-169.1	0	0	111.6	F378 E379 L380 V385 Q386 I394	F378-E382 WeakPolarHBondContact CZ-OE2 3.43Å; F378-E382 PolarHBondContact O-N 3.36Å; E379-E382 PolarHBondContact O-N 3.17Å; L380-E382 VanDerWaalsContact C-N 3.35Å; E382-V385 PolarHBondContact O-N 3.32Å; E382-Q386 WeakPolarHBondContact O-CG 3Å; E382-Q386 PolarHBondContact O-N 2.89Å; E382-I394 HydrophobicContact CB-CG2 4.33Å; E382-I394 HydrophobicContact CG-CG2 4.25Å
383	R	90.7	Very high	92.2	Very high	51 Å²	51	54.4 Å²	54.4	19%	0.192	28%	0.276	C	S	.	.	I	π-helix	trans	-71.7	-32.6	-175.6	-58.8	-54.4	-169.9	-177.8	-2.5	112.9	T201 V313 E379 V385 Q386 I387	T201-R383 PolarHBondContact OG1-NH1 2.86Å; V313-R383 HydrophobicContact CG2-CB 3.71Å; E379-R383 WeakPolarHBondContact O-CA 3.43Å; E379-R383 WeakPolarHBondContact O-CB 3.42Å; E379-R383 PolarHBondContact O-N 2.8Å; R383-V385 PolarHBondContact O-N 3.19Å; R383-Q386 PolarHBondContact O-N 3.29Å; R383-I387 PolarHBondContact O-N 2.79Å
384	G	91.5	Very high	92.1	Very high	25 Å²	25	52.3 Å²	52.3	26%	0.258	26%	0.258	S	S	.	.	I	π-helix	trans	-66.5	-35.1	177.5	0	0	0	0	0	113.2	E379 L380 I387	E379-G384 PolarHBondContact O-N 3.49Å; L380-G384 CarbonylContact O-C 3.59Å; L380-G384 WeakPolarHBondContact O-CA 3.3Å; L380-G384 PolarHBondContact O-N 2.76Å; L380-G384 VanDerWaalsContact O-N 3.15Å; G384-I387 WeakPolarHBondContact O-CB 3.08Å
385	V	91.2	Very high	91.9	Very high	60 Å²	60	57.1 Å²	57.1	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-75.1	-34	174.7	-178.9	0	0	0	0	111.1	L380 A381 E382 R383 I387 R388 N389 Y392	L380-V385 PolarHBondContact O-N 3.32Å; A381-V385 VanDerWaalsContact O-CG2 3.23Å; A381-V385 WeakPolarHBondContact O-CG2 3.45Å; E382-V385 PolarHBondContact O-N 3.32Å; R383-V385 PolarHBondContact O-N 3.19Å; V385-I387 PolarHBondContact O-N 3.45Å; V385-I387 VanDerWaalsContact O-N 3.13Å; V385-R388 PolarHBondContact O-N 3.22Å; V385-N389 PolarHBondContact O-N 3.38Å; V385-N389 VanDerWaalsContact O-N 3.14Å; V385-Y392 HydrophobicContact CB-CD1 3.64Å; V385-Y392 HydrophobicContact CB-CE1 3.81Å; V385-Y392 HydrophobicContact CB-CG 4.17Å; V385-Y392 HydrophobicContact CG1-CD1 3.54Å; V385-Y392 HydrophobicContact CG1-CD2 3.93Å; V385-Y392 HydrophobicContact CG1-CE1 3.91Å; V385-Y392 HydrophobicContact CG1-CE2 4.25Å; V385-Y392 HydrophobicContact CG1-CG 3.53Å; V385-Y392 HydrophobicContact CG2-CE1 4.22Å
386	Q	91.2	Very high	91.6	Very high	22 Å²	22	54.4 Å²	54.4	10%	0.103	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-21.1	176.3	-76	172.1	-3.3	0	0	114.2	E382 R383 R388 N389 Y392	E382-Q386 WeakPolarHBondContact O-CG 3Å; E382-Q386 PolarHBondContact O-N 2.89Å; R383-Q386 PolarHBondContact O-N 3.29Å; Q386-R388 PolarHBondContact O-N 3.5Å; Q386-N389 WeakPolarHBondContact CA-O 3.38Å; Q386-N389 CarbonylContact O-C 3.52Å; Q386-Y392 WeakPolarHBondContact CG-O 3.28Å; Q386-Y392 PolarHBondContact NE2-O 3.45Å
387	I	89.5	Confident	91.2	Very high	73 Å²	73	54.4 Å²	54.4	37%	0.374	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-37.4	172.3	-64.3	178.6	0	0	0	111.5	F310 V313 R383 G384 V385	F310-I387 HydrophobicContact CB-CD1 4.14Å; V313-I387 HydrophobicContact CG2-CD1 4.09Å; V313-I387 HydrophobicContact CG2-CG1 4.38Å; R383-I387 PolarHBondContact O-N 2.79Å; G384-I387 WeakPolarHBondContact O-CB 3.08Å; V385-I387 PolarHBondContact O-N 3.45Å; V385-I387 VanDerWaalsContact O-N 3.13Å
388	R	89.3	Confident	90.9	Very high	237 Å²	237	52.8 Å²	52.8	89%	0.894	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-38.5	-178.1	-174.4	177.3	179.8	159.5	1.2	112.6	V385 Q386	V385-R388 PolarHBondContact O-N 3.22Å; Q386-R388 PolarHBondContact O-N 3.5Å
389	N	91.9	Very high	90.8	Very high	37 Å²	37	57.3 Å²	57.3	20%	0.198	28%	0.283	C	S	.	.			trans	-125.8	101.3	177.7	-179.2	6.1	0	0	0	109.8	E164 V385 Q386 F391 Y392	E164-N389 PolarHBondContact OE1-ND2 3.44Å; V385-N389 PolarHBondContact O-N 3.38Å; V385-N389 VanDerWaalsContact O-N 3.14Å; Q386-N389 WeakPolarHBondContact CA-O 3.38Å; Q386-N389 CarbonylContact O-C 3.52Å; N389-F391 PolarHBondContact O-N 3.39Å; N389-F391 VanDerWaalsContact O-N 3.14Å; N389-F391 WeakPolarHBondContact OD1-CB 3.33Å; N389-F391 PolarHBondContact OD1-N 3.32Å; N389-F391 VanDerWaalsContact OD1-N 3.07Å; N389-Y392 WeakPolarHBondContact O-CB 3.41Å; N389-Y392 PolarHBondContact O-N 2.89Å
390	P	93.3	Very high	90.7	Very high	14 Å²	14	54.8 Å²	54.8	9%	0.091	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.3	-177.5	28.2	-35.3	0	0	0	113	A160 F200 T201 L202 Y392	A160-P390 HydrophobicContact CB-CG 3.48Å; A160-P390 VanDerWaalsContact CB-CG 3.48Å; F200-P390 CarbonylContact C-O 3.59Å; F200-P390 VanDerWaalsContact CA-O 3.25Å; F200-P390 WeakPolarHBondContact CA-O 3.46Å; T201-P390 PolarHBondContact N-O 3.08Å; L202-P390 HydrophobicContact CD2-CB 3.84Å; L202-P390 HydrophobicContact CD2-CG 4.35Å; P390-Y392 VanDerWaalsContact C-N 3.34Å
391	F	94.1	Very high	90.6	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.8	176.7	-54	-80.1	0	0	0	113.2	L142 L144 A160 S162 E164 R166 L199 F200 L212 N389 S393	L142-F391 HydrophobicContact CB-CD1 4.09Å; L142-F391 HydrophobicContact CB-CE1 3.72Å; L142-F391 HydrophobicContact CB-CE2 4.23Å; L142-F391 HydrophobicContact CB-CG 4.5Å; L142-F391 HydrophobicContact CB-CZ 3.75Å; L142-F391 HydrophobicContact CD1-CB 4.42Å; L142-F391 HydrophobicContact CD1-CD1 3.5Å; L142-F391 VanDerWaalsContact CD1-CD1 3.5Å; L142-F391 HydrophobicContact CD1-CE1 3.86Å; L142-F391 HydrophobicContact CD1-CG 4.08Å; L142-F391 HydrophobicContact CG-CD1 4.41Å; L142-F391 HydrophobicContact CG-CE1 4.34Å; L144-F391 HydrophobicContact CB-CE1 4.44Å; L144-F391 HydrophobicContact CB-CE2 4.29Å; L144-F391 HydrophobicContact CB-CZ 3.6Å; A160-F391 HydrophobicContact CB-CD2 4.25Å; A160-F391 HydrophobicContact CB-CE2 3.71Å; S162-F391 WeakPolarHBondContact OG-CB 3.35Å; S162-F391 WeakPolarHBondContact OG-CD2 3.33Å; S162-F391 WeakPolarHBondContact OG-CG 3.42Å; E164-F391 HydrophobicContact CG-CB 3.72Å; R166-F391 PolarHBondContact NH2-O 2.93Å; L199-F391 WeakPolarHBondContact O-CA 3.43Å; L199-F391 WeakPolarHBondContact O-CD1 3.09Å; F200-F391 HydrophobicContact CB-CD1 3.66Å; F200-F391 HydrophobicContact CB-CE1 3.98Å; F200-F391 HydrophobicContact CB-CG 4.41Å; F200-F391 HydrophobicContact CD1-CE1 4.26Å; F200-F391 HydrophobicContact CG-CE1 4.5Å; L212-F391 HydrophobicContact CD1-CE1 3.97Å; L212-F391 HydrophobicContact CD1-CZ 4.27Å; N389-F391 PolarHBondContact O-N 3.39Å; N389-F391 VanDerWaalsContact O-N 3.14Å; N389-F391 WeakPolarHBondContact OD1-CB 3.33Å; N389-F391 PolarHBondContact OD1-N 3.32Å; N389-F391 VanDerWaalsContact OD1-N 3.07Å; F391-S393 PolarHBondContact O-N 2.87Å
392	Y	92.4	Very high	90.7	Very high	53 Å²	53	57.7 Å²	57.7	21%	0.208	28%	0.281	C	S	.	.			trans	-68.3	134.1	179.9	176.9	-95.2	0	0	0	111.6	A381 V385 Q386 N389 P390 I394	A381-Y392 VanDerWaalsContact O-CE1 3.23Å; A381-Y392 WeakPolarHBondContact O-CE1 3.26Å; V385-Y392 HydrophobicContact CB-CD1 3.64Å; V385-Y392 HydrophobicContact CB-CE1 3.81Å; V385-Y392 HydrophobicContact CB-CG 4.17Å; V385-Y392 HydrophobicContact CG1-CD1 3.54Å; V385-Y392 HydrophobicContact CG1-CD2 3.93Å; V385-Y392 HydrophobicContact CG1-CE1 3.91Å; V385-Y392 HydrophobicContact CG1-CE2 4.25Å; V385-Y392 HydrophobicContact CG1-CG 3.53Å; V385-Y392 HydrophobicContact CG2-CE1 4.22Å; Q386-Y392 WeakPolarHBondContact CG-O 3.28Å; Q386-Y392 PolarHBondContact NE2-O 3.45Å; N389-Y392 WeakPolarHBondContact O-CB 3.41Å; N389-Y392 PolarHBondContact O-N 2.89Å; P390-Y392 VanDerWaalsContact C-N 3.34Å; Y392-I394 HydrophobicContact CE1-CB 4.43Å
393	S	92.3	Very high	90.8	Very high	7 Å²	7	62.7 Å²	62.7	5%	0.049	31%	0.306	C	S	.	.			trans	-133.1	130.3	170.3	-176.8	0	0	0	0	109.4	F391 W395 S396	F391-S393 PolarHBondContact O-N 2.87Å; S393-W395 PolarHBondContact O-N 3.49Å; S393-S396 PolarHBondContact O-N 3.15Å; S393-S396 PolarHBondContact O-OG 3.4Å
394	I	91.4	Very high	90.9	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.026	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.8	177.6	-167.3	167.7	0	0	0	112.3	F378 A381 E382 Y392 S396 A400 A401	F378-I394 HydrophobicContact CD2-CD1 4.2Å; F378-I394 HydrophobicContact CE2-CD1 4.13Å; F378-I394 HydrophobicContact CE2-CG2 4.19Å; A381-I394 HydrophobicContact CB-CD1 4.21Å; E382-I394 HydrophobicContact CB-CG2 4.33Å; E382-I394 HydrophobicContact CG-CG2 4.25Å; Y392-I394 HydrophobicContact CE1-CB 4.43Å; I394-S396 VanDerWaalsContact C-N 3.3Å; I394-S396 PolarHBondContact O-N 3.27Å; I394-A400 HydrophobicContact CG1-CB 3.94Å; I394-A401 WeakPolarHBondContact O-CA 3.32Å; I394-A401 PolarHBondContact O-N 3.26Å; I394-A401 VanDerWaalsContact O-N 3.1Å
395	W	90	Very high	91	Very high	110 Å²	110	63.7 Å²	63.7	42%	0.417	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.4	-176.7	-53.5	108.3	0	0	0	113.7	F378 S393 A401 I408	F378-W395 HydrophobicContact CE2-CZ2 4.14Å; F378-W395 AromaticContact CZ-CZ2 4Å; F378-W395 HydrophobicContact CZ-CZ2 4Å; S393-W395 PolarHBondContact O-N 3.49Å; W395-A401 HydrophobicContact CE3-CB 4.27Å; W395-I408 HydrophobicContact CH2-CD1 3.89Å; W395-I408 HydrophobicContact CZ2-CD1 4.27Å
396	S	86.5	Confident	91.2	Very high	21 Å²	21	64.6 Å²	64.6	15%	0.147	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-36	180	66.6	0	0	0	0	112.9	V165 S393 I394	V165-S396 WeakPolarHBondContact O-CB 3.35Å; S393-S396 PolarHBondContact O-N 3.15Å; S393-S396 PolarHBondContact O-OG 3.4Å; I394-S396 VanDerWaalsContact C-N 3.3Å; I394-S396 PolarHBondContact O-N 3.27Å
397	H	87	Confident	91.3	Very high	98 Å²	98	64.3 Å²	64.3	45%	0.454	32%	0.316	S	S	.	.	S	Bend	trans	-96.5	122.1	-175.9	-165.3	-82.9	0	0	0	110.7	I399 A400 A401	H397-I399 VanDerWaalsContact C-N 3.29Å; H397-I399 PolarHBondContact ND1-N 2.8Å; H397-I399 PolarHBondContact O-N 3.42Å; H397-I399 VanDerWaalsContact O-N 3.17Å; H397-A400 HydrophobicContact CB-CB 3.93Å; H397-A400 PolarHBondContact O-N 3.45Å; H397-A401 WeakPolarHBondContact O-CB 3.36Å; H397-A401 PolarHBondContact O-N 3.2Å
398	P	86.7	Confident	91.5	Very high	73 Å²	73	63.5 Å²	63.5	47%	0.474	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-34.1	-169.7	22.9	-34	0	0	0	113.3	K402	P398-K402 WeakPolarHBondContact O-CB 3.26Å; P398-K402 WeakPolarHBondContact O-CG 3.43Å; P398-K402 PolarHBondContact O-N 2.86Å; P398-K402 VanDerWaalsContact O-N 3.14Å
399	I	89.9	Confident	91.8	Very high	112 Å²	112	55.7 Å²	55.7	57%	0.574	29%	0.29	S	S	*	.	H	α-helix	trans	-70.1	-42.1	175.4	-62.9	171.6	0	0	0	110.5	H397 K402 M403	H397-I399 VanDerWaalsContact C-N 3.29Å; H397-I399 PolarHBondContact ND1-N 2.8Å; H397-I399 PolarHBondContact O-N 3.42Å; H397-I399 VanDerWaalsContact O-N 3.17Å; I399-K402 PolarHBondContact O-N 3.39Å; I399-M403 HydrophobicContact CG2-SD 4.25Å; I399-M403 WeakPolarHBondContact O-CG 3.43Å; I399-M403 PolarHBondContact O-N 3.39Å
400	A	90.8	Very high	91.9	Very high	18 Å²	18	57.6 Å²	57.6	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-71.5	-42	-177.7	0	0	0	0	0	110.7	I394 H397 K402 M403 G404	I394-A400 HydrophobicContact CG1-CB 3.94Å; H397-A400 HydrophobicContact CB-CB 3.93Å; H397-A400 PolarHBondContact O-N 3.45Å; A400-K402 VanDerWaalsContact C-N 3.35Å; A400-K402 PolarHBondContact O-N 3.03Å; A400-M403 PolarHBondContact O-N 3.49Å; A400-M403 VanDerWaalsContact O-N 3.16Å; A400-G404 PolarHBondContact O-N 3.17Å
401	A	90.8	Very high	91.9	Very high	19 Å²	19	57 Å²	57	16%	0.157	30%	0.296	C	S	.	.	H	α-helix	trans	-58.7	-44.1	173.8	0	0	0	0	0	111.7	I394 W395 H397 G404 L405	I394-A401 WeakPolarHBondContact O-CA 3.32Å; I394-A401 PolarHBondContact O-N 3.26Å; I394-A401 VanDerWaalsContact O-N 3.1Å; W395-A401 HydrophobicContact CE3-CB 4.27Å; H397-A401 WeakPolarHBondContact O-CB 3.36Å; H397-A401 PolarHBondContact O-N 3.2Å; A401-G404 PolarHBondContact O-N 3.05Å; A401-L405 VanDerWaalsContact O-CB 3.25Å; A401-L405 WeakPolarHBondContact O-CB 3.38Å; A401-L405 PolarHBondContact O-N 2.7Å
402	K	93.6	Very high	91.9	Very high	150 Å²	150	59.7 Å²	59.7	65%	0.652	32%	0.318	S	S	*	.	H	α-helix	trans	-62.3	-42.5	174.1	-76.6	174.2	-176.4	179.4	0	112.1	P398 I399 A400 T406	P398-K402 WeakPolarHBondContact O-CB 3.26Å; P398-K402 WeakPolarHBondContact O-CG 3.43Å; P398-K402 PolarHBondContact O-N 2.86Å; P398-K402 VanDerWaalsContact O-N 3.14Å; I399-K402 PolarHBondContact O-N 3.39Å; A400-K402 VanDerWaalsContact C-N 3.35Å; A400-K402 PolarHBondContact O-N 3.03Å; K402-T406 WeakPolarHBondContact O-CB 3.36Å; K402-T406 PolarHBondContact O-N 3.29Å; K402-T406 PolarHBondContact O-OG1 2.93Å
403	M	92.9	Very high	92	Very high	130 Å²	130	62.6 Å²	62.6	64%	0.64	34%	0.337	S	S	*	.	H	α-helix	trans	-66.2	-43.8	176.6	-73.1	179.3	66.8	0	0	112.1	I399 A400 T406 S407	I399-M403 HydrophobicContact CG2-SD 4.25Å; I399-M403 WeakPolarHBondContact O-CG 3.43Å; I399-M403 PolarHBondContact O-N 3.39Å; A400-M403 PolarHBondContact O-N 3.49Å; A400-M403 VanDerWaalsContact O-N 3.16Å; M403-T406 WeakPolarHBondContact O-CB 3.33Å; M403-T406 PolarHBondContact O-N 2.66Å; M403-S407 PolarHBondContact O-N 3.46Å
404	G	92.7	Very high	92	Very high	3 Å²	3	63 Å²	63	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-60.5	-49.7	176.1	0	0	0	0	0	111.5	A400 A401 T406 S407 I408	A400-G404 PolarHBondContact O-N 3.17Å; A401-G404 PolarHBondContact O-N 3.05Å; G404-T406 VanDerWaalsContact C-N 3.31Å; G404-T406 PolarHBondContact O-N 2.74Å; G404-S407 WeakPolarHBondContact O-CB 3.26Å; G404-S407 PolarHBondContact O-N 2.79Å; G404-S407 VanDerWaalsContact O-N 3.1Å; G404-I408 WeakPolarHBondContact O-CG1 3.34Å; G404-I408 PolarHBondContact O-N 3.03Å
405	L	93.9	Very high	92	Very high	95 Å²	95	64.7 Å²	64.7	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-58	-43.1	174.4	-174.4	67.4	0	0	0	111.7	A401 S407 I408 V409	A401-L405 VanDerWaalsContact O-CB 3.25Å; A401-L405 WeakPolarHBondContact O-CB 3.38Å; A401-L405 PolarHBondContact O-N 2.7Å; L405-S407 VanDerWaalsContact C-N 3.31Å; L405-S407 PolarHBondContact O-N 3.43Å; L405-I408 PolarHBondContact O-N 2.82Å; L405-V409 HydrophobicContact CG-CG2 4.41Å; L405-V409 WeakPolarHBondContact O-CB 3.46Å; L405-V409 VanDerWaalsContact O-CG2 3.24Å; L405-V409 WeakPolarHBondContact O-CG2 3.48Å; L405-V409 PolarHBondContact O-N 2.97Å
406	T	94.3	Very high	92.2	Very high	78 Å²	78	66.1 Å²	66.1	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-59.4	-43.1	176.1	-59.3	0	0	0	0	111.1	K402 M403 G404 V409 I410	K402-T406 WeakPolarHBondContact O-CB 3.36Å; K402-T406 PolarHBondContact O-N 3.29Å; K402-T406 PolarHBondContact O-OG1 2.93Å; M403-T406 WeakPolarHBondContact O-CB 3.33Å; M403-T406 PolarHBondContact O-N 2.66Å; G404-T406 VanDerWaalsContact C-N 3.31Å; G404-T406 PolarHBondContact O-N 2.74Å; T406-V409 PolarHBondContact O-N 2.9Å; T406-I410 HydrophobicContact CG2-CD1 3.91Å; T406-I410 VanDerWaalsContact O-CG1 3.28Å; T406-I410 WeakPolarHBondContact O-CG1 3.17Å; T406-I410 PolarHBondContact O-N 3.39Å
407	S	93.8	Very high	92.4	Very high	17 Å²	17	67.1 Å²	67.1	12%	0.119	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-45.7	177.4	-156	0	0	0	0	112.1	A374 M403 G404 L405 V409 I410 G411	A374-S407 PolarHBondContact O-OG 3.16Å; M403-S407 PolarHBondContact O-N 3.46Å; G404-S407 WeakPolarHBondContact O-CB 3.26Å; G404-S407 PolarHBondContact O-N 2.79Å; G404-S407 VanDerWaalsContact O-N 3.1Å; L405-S407 VanDerWaalsContact C-N 3.31Å; L405-S407 PolarHBondContact O-N 3.43Å; S407-V409 PolarHBondContact O-N 2.65Å; S407-I410 PolarHBondContact O-N 3.46Å; S407-G411 PolarHBondContact O-N 2.9Å
408	I	93.6	Very high	92.6	Very high	56 Å²	56	63.1 Å²	63.1	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-60.6	-45.1	176.4	-65.3	166.7	0	0	0	110.6	F378 W395 G404 L405 G411 A412	F378-I408 HydrophobicContact CD1-CG1 4.37Å; F378-I408 HydrophobicContact CD2-CD1 4.17Å; F378-I408 HydrophobicContact CD2-CG1 4.14Å; F378-I408 HydrophobicContact CE1-CD1 4.24Å; F378-I408 HydrophobicContact CE1-CG1 4.47Å; F378-I408 HydrophobicContact CE2-CD1 3.76Å; F378-I408 HydrophobicContact CE2-CG1 4.24Å; F378-I408 HydrophobicContact CG-CG1 4.21Å; F378-I408 HydrophobicContact CZ-CD1 3.81Å; F378-I408 HydrophobicContact CZ-CG1 4.41Å; W395-I408 HydrophobicContact CH2-CD1 3.89Å; W395-I408 HydrophobicContact CZ2-CD1 4.27Å; G404-I408 WeakPolarHBondContact O-CG1 3.34Å; G404-I408 PolarHBondContact O-N 3.03Å; L405-I408 PolarHBondContact O-N 2.82Å; I408-G411 PolarHBondContact O-N 2.92Å; I408-A412 WeakPolarHBondContact O-CB 3.48Å; I408-A412 PolarHBondContact O-N 3.34Å
409	V	95.5	Very high	92.8	Very high	72 Å²	72	64.7 Å²	64.7	44%	0.436	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-43.9	178.8	170.1	0	0	0	0	111.3	L405 T406 S407 G411 A412 L413	L405-V409 HydrophobicContact CG-CG2 4.41Å; L405-V409 WeakPolarHBondContact O-CB 3.46Å; L405-V409 VanDerWaalsContact O-CG2 3.24Å; L405-V409 WeakPolarHBondContact O-CG2 3.48Å; L405-V409 PolarHBondContact O-N 2.97Å; T406-V409 PolarHBondContact O-N 2.9Å; S407-V409 PolarHBondContact O-N 2.65Å; V409-G411 PolarHBondContact O-N 3.23Å; V409-A412 PolarHBondContact O-N 2.94Å; V409-L413 HydrophobicContact CG1-CD1 4.07Å; V409-L413 HydrophobicContact CG1-CG 4.41Å; V409-L413 WeakPolarHBondContact O-CB 3.09Å; V409-L413 VanDerWaalsContact O-CG 3.31Å; V409-L413 WeakPolarHBondContact O-CG 3.33Å; V409-L413 PolarHBondContact O-N 2.9Å
410	I	94.7	Very high	92.9	Very high	77 Å²	77	63.1 Å²	63.1	40%	0.395	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-46	175.2	-69.8	166.7	0	0	0	110.6	A374 T406 S407 L413 C414	A374-I410 HydrophobicContact CB-CG2 4.23Å; T406-I410 HydrophobicContact CG2-CD1 3.91Å; T406-I410 VanDerWaalsContact O-CG1 3.28Å; T406-I410 WeakPolarHBondContact O-CG1 3.17Å; T406-I410 PolarHBondContact O-N 3.39Å; S407-I410 PolarHBondContact O-N 3.46Å; I410-L413 PolarHBondContact O-N 3.29Å; I410-C414 PolarHBondContact O-N 3.04Å; I410-C414 PolarHBondContact O-SG 3.39Å
411	G	93.2	Very high	92.7	Very high	2 Å²	2	64.6 Å²	64.6	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-47.2	175.7	0	0	0	0	0	112.3	C371 S407 I408 V409 C414 A415	C371-G411 PolarHBondContact SG-O 3.3Å; C371-G411 VanDerWaalsContact SG-O 3.35Å; S407-G411 PolarHBondContact O-N 2.9Å; I408-G411 PolarHBondContact O-N 2.92Å; V409-G411 PolarHBondContact O-N 3.23Å; G411-C414 PolarHBondContact O-N 2.83Å; G411-A415 WeakPolarHBondContact O-CB 3.21Å; G411-A415 PolarHBondContact O-N 3.48Å
412	A	93.5	Very high	92.6	Very high	57 Å²	57	64.9 Å²	64.9	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-43.3	178.7	0	0	0	0	0	112.9	I408 V409 C414 A415 F416	I408-A412 WeakPolarHBondContact O-CB 3.48Å; I408-A412 PolarHBondContact O-N 3.34Å; V409-A412 PolarHBondContact O-N 2.94Å; A412-C414 VanDerWaalsContact C-N 3.34Å; A412-C414 PolarHBondContact O-N 2.92Å; A412-A415 PolarHBondContact O-N 2.94Å; A412-F416 WeakPolarHBondContact O-CB 3.45Å; A412-F416 PolarHBondContact O-N 2.87Å
413	L	95.2	Very high	92.4	Very high	114 Å²	114	61.5 Å²	61.5	60%	0.597	34%	0.341	S	S	*	.	H	α-helix	trans	-61.7	-42.7	175.3	-72.7	173.5	0	0	0	111.6	V409 I410 F416 A417	V409-L413 HydrophobicContact CG1-CD1 4.07Å; V409-L413 HydrophobicContact CG1-CG 4.41Å; V409-L413 WeakPolarHBondContact O-CB 3.09Å; V409-L413 VanDerWaalsContact O-CG 3.31Å; V409-L413 WeakPolarHBondContact O-CG 3.33Å; V409-L413 PolarHBondContact O-N 2.9Å; I410-L413 PolarHBondContact O-N 3.29Å; L413-F416 PolarHBondContact O-N 3.19Å; L413-A417 WeakPolarHBondContact O-CB 3.43Å; L413-A417 PolarHBondContact O-N 3.15Å
414	C	93.1	Very high	92.2	Very high	17 Å²	17	59.1 Å²	59.1	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-42.5	175.5	-66	0	0	0	0	111.7	L367 C371 I410 G411 A412 A417 Y418	L367-C414 HydrophobicContact CD1-CB 3.95Å; L367-C414 HydrophobicContact CG-CB 4.4Å; C371-C414 HydrophobicContact CB-CB 3.75Å; I410-C414 PolarHBondContact O-N 3.04Å; I410-C414 PolarHBondContact O-SG 3.39Å; G411-C414 PolarHBondContact O-N 2.83Å; A412-C414 VanDerWaalsContact C-N 3.34Å; A412-C414 PolarHBondContact O-N 2.92Å; C414-A417 PolarHBondContact O-N 3.15Å; C414-Y418 WeakPolarHBondContact O-CB 3.15Å; C414-Y418 PolarHBondContact O-N 3.08Å
415	A	90.9	Very high	91.8	Very high	40 Å²	40	59.5 Å²	59.5	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-41.6	176.6	0	0	0	0	0	112	G411 A412 Y418 M419	G411-A415 WeakPolarHBondContact O-CB 3.21Å; G411-A415 PolarHBondContact O-N 3.48Å; A412-A415 PolarHBondContact O-N 2.94Å; A415-Y418 WeakPolarHBondContact O-CB 3.42Å; A415-Y418 PolarHBondContact O-N 2.82Å; A415-M419 WeakPolarHBondContact O-CG 3.42Å; A415-M419 PolarHBondContact O-N 2.88Å
416	F	93.4	Very high	91.5	Very high	139 Å²	139	56.6 Å²	56.6	61%	0.61	32%	0.318	S	S	*	.	H	α-helix	trans	-65.4	-45	176.9	-175	-108.7	0	0	0	112	A412 L413 Y418 M419 I420	A412-F416 WeakPolarHBondContact O-CB 3.45Å; A412-F416 PolarHBondContact O-N 2.87Å; L413-F416 PolarHBondContact O-N 3.19Å; F416-Y418 VanDerWaalsContact C-N 3.28Å; F416-Y418 PolarHBondContact O-N 3.32Å; F416-M419 PolarHBondContact O-N 2.89Å; F416-I420 HydrophobicContact CD1-CD1 3.69Å; F416-I420 HydrophobicContact CE1-CD1 3.25Å; F416-I420 HydrophobicContact CE1-CG1 4.22Å; F416-I420 HydrophobicContact CE2-CD1 4.43Å; F416-I420 HydrophobicContact CG-CD1 4.46Å; F416-I420 HydrophobicContact CZ-CD1 3.67Å; F416-I420 HydrophobicContact CZ-CG1 4.26Å; F416-I420 WeakPolarHBondContact O-CG1 3.47Å; F416-I420 PolarHBondContact O-N 3.05Å
417	A	91.8	Very high	91.1	Very high	43 Å²	43	56.5 Å²	56.5	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-39.7	173.3	0	0	0	0	0	111.7	L367 L413 C414 Y421	L367-A417 HydrophobicContact CD1-CB 4.35Å; L367-A417 HydrophobicContact CD2-CB 3.93Å; L413-A417 WeakPolarHBondContact O-CB 3.43Å; L413-A417 PolarHBondContact O-N 3.15Å; C414-A417 PolarHBondContact O-N 3.15Å; A417-Y421 VanDerWaalsContact O-CB 3.22Å; A417-Y421 WeakPolarHBondContact O-CB 3.34Å; A417-Y421 PolarHBondContact O-N 3.19Å
418	Y	91	Very high	90.8	Very high	14 Å²	14	60.9 Å²	60.9	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-45.8	173.9	166.5	-90.4	0	0	0	111.6	V327 L331 V368 C414 A415 F416 Y421 L422	V327-Y418 HydrophobicContact CG1-CD1 4.11Å; V327-Y418 HydrophobicContact CG1-CD2 4.03Å; V327-Y418 HydrophobicContact CG1-CE1 3.56Å; V327-Y418 HydrophobicContact CG1-CE2 3.44Å; V327-Y418 VanDerWaalsContact CG1-CE2 3.44Å; V327-Y418 HydrophobicContact CG1-CG 4.34Å; V327-Y418 WeakPolarHBondContact CG1-OH 3.28Å; V327-Y418 PolarHBondContact O-OH 3.29Å; L331-Y418 HydrophobicContact CB-CE2 4.28Å; L331-Y418 HydrophobicContact CD1-CD2 4.3Å; L331-Y418 HydrophobicContact CD1-CE2 3.94Å; V368-Y418 HydrophobicContact CG2-CD2 3.63Å; V368-Y418 HydrophobicContact CG2-CE2 3.93Å; C414-Y418 WeakPolarHBondContact O-CB 3.15Å; C414-Y418 PolarHBondContact O-N 3.08Å; A415-Y418 WeakPolarHBondContact O-CB 3.42Å; A415-Y418 PolarHBondContact O-N 2.82Å; F416-Y418 VanDerWaalsContact C-N 3.28Å; F416-Y418 PolarHBondContact O-N 3.32Å; Y418-Y421 WeakPolarHBondContact O-CB 3.3Å; Y418-Y421 PolarHBondContact O-N 3.49Å; Y418-L422 HydrophobicContact CE1-CB 4.41Å; Y418-L422 HydrophobicContact CE1-CD2 4.05Å; Y418-L422 WeakPolarHBondContact O-CB 3.47Å; Y418-L422 PolarHBondContact O-N 3.39Å
419	M	89.9	Confident	90.2	Very high	105 Å²	105	58.3 Å²	58.3	52%	0.517	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-47.8	179.7	-74.2	-60.2	-67.2	0	0	111.7	A415 F416 Y421 L422 T423	A415-M419 WeakPolarHBondContact O-CG 3.42Å; A415-M419 PolarHBondContact O-N 2.88Å; F416-M419 PolarHBondContact O-N 2.89Å; M419-Y421 VanDerWaalsContact C-N 3.25Å; M419-Y421 PolarHBondContact O-N 3.05Å; M419-L422 PolarHBondContact O-N 2.91Å; M419-T423 PolarHBondContact O-N 2.87Å; M419-T423 PolarHBondContact O-OG1 2.91Å
420	I	91.5	Very high	89.6	Confident	80 Å²	80	59.2 Å²	59.2	41%	0.41	32%	0.319	S	S	.	.	H	α-helix	trans	-54.9	-47.1	174	-71.1	170.2	0	0	0	110.2	F416 T423 I424	F416-I420 HydrophobicContact CD1-CD1 3.69Å; F416-I420 HydrophobicContact CE1-CD1 3.25Å; F416-I420 HydrophobicContact CE1-CG1 4.22Å; F416-I420 HydrophobicContact CE2-CD1 4.43Å; F416-I420 HydrophobicContact CG-CD1 4.46Å; F416-I420 HydrophobicContact CZ-CD1 3.67Å; F416-I420 HydrophobicContact CZ-CG1 4.26Å; F416-I420 WeakPolarHBondContact O-CG1 3.47Å; F416-I420 PolarHBondContact O-N 3.05Å; I420-T423 PolarHBondContact O-N 2.83Å; I420-I424 HydrophobicContact CG2-CD1 3.78Å; I420-I424 HydrophobicContact CG2-CG1 4.46Å; I420-I424 VanDerWaalsContact O-CG1 3.31Å; I420-I424 WeakPolarHBondContact O-CG1 3.39Å; I420-I424 PolarHBondContact O-N 3.5Å
421	Y	87.7	Confident	89.1	Confident	49 Å²	49	60.5 Å²	60.5	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-45.9	-178.5	178.3	-103.2	0	0	0	112.4	L331 R364 A417 Y418 M419 T423 I424 L425	L331-Y421 HydrophobicContact CD1-CD1 4.28Å; L331-Y421 HydrophobicContact CD1-CE1 4.05Å; L331-Y421 HydrophobicContact CG-CE1 4.28Å; R364-Y421 HydrophobicContact CB-CE1 4.35Å; R364-Y421 VanDerWaalsContact CD-CZ 3.41Å; R364-Y421 WeakPolarHBondContact CD-OH 3.5Å; R364-Y421 HydrophobicContact CG-CE1 4.09Å; R364-Y421 PolarHBondContact NE-OH 3.09Å; R364-Y421 PolarHBondContact NH1-OH 3.32Å; A417-Y421 VanDerWaalsContact O-CB 3.22Å; A417-Y421 WeakPolarHBondContact O-CB 3.34Å; A417-Y421 PolarHBondContact O-N 3.19Å; Y418-Y421 WeakPolarHBondContact O-CB 3.3Å; Y418-Y421 PolarHBondContact O-N 3.49Å; M419-Y421 VanDerWaalsContact C-N 3.25Å; M419-Y421 PolarHBondContact O-N 3.05Å; Y421-T423 VanDerWaalsContact C-N 3.34Å; Y421-T423 PolarHBondContact O-N 2.96Å; Y421-I424 PolarHBondContact O-N 2.87Å; Y421-L425 HydrophobicContact CD1-CD1 3.94Å; Y421-L425 HydrophobicContact CE1-CD1 3.19Å; Y421-L425 HydrophobicContact CE1-CG 3.88Å; Y421-L425 HydrophobicContact CE2-CD1 4.46Å; Y421-L425 HydrophobicContact CE2-CG 4.27Å; Y421-L425 VanDerWaalsContact CZ-CD1 3.46Å; Y421-L425 PolarHBondContact O-N 3.04Å; Y421-L425 WeakPolarHBondContact OH-CD1 3.42Å; Y421-L425 WeakPolarHBondContact OH-CD2 3.49Å; Y421-L425 WeakPolarHBondContact OH-CG 3.3Å
422	L	88.8	Confident	88.5	Confident	24 Å²	24	62.6 Å²	62.6	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-61.6	-42.6	175.8	-174.1	69.1	0	0	0	111	W330 Y418 M419 I424 L425 V426	W330-L422 HydrophobicContact CB-CD1 4.41Å; Y418-L422 HydrophobicContact CE1-CB 4.41Å; Y418-L422 HydrophobicContact CE1-CD2 4.05Å; Y418-L422 WeakPolarHBondContact O-CB 3.47Å; Y418-L422 PolarHBondContact O-N 3.39Å; M419-L422 PolarHBondContact O-N 2.91Å; L422-I424 PolarHBondContact O-N 3.42Å; L422-L425 WeakPolarHBondContact O-CB 3.32Å; L422-L425 PolarHBondContact O-N 3.05Å; L422-V426 HydrophobicContact CG-CG2 4.46Å; L422-V426 VanDerWaalsContact O-CG2 3.3Å; L422-V426 WeakPolarHBondContact O-CG2 3.12Å; L422-V426 PolarHBondContact O-N 3.16Å
423	T	89.4	Confident	87.8	Confident	79 Å²	79	60.5 Å²	60.5	49%	0.485	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-46.1	175.4	-58.7	0	0	0	0	111.5	M419 I420 Y421 L425 V426 V427	M419-T423 PolarHBondContact O-N 2.87Å; M419-T423 PolarHBondContact O-OG1 2.91Å; I420-T423 PolarHBondContact O-N 2.83Å; Y421-T423 VanDerWaalsContact C-N 3.34Å; Y421-T423 PolarHBondContact O-N 2.96Å; T423-L425 VanDerWaalsContact C-N 3.32Å; T423-L425 PolarHBondContact O-N 3.47Å; T423-V426 PolarHBondContact O-N 3.23Å; T423-V427 HydrophobicContact CG2-CG2 4.33Å; T423-V427 WeakPolarHBondContact O-CB 3.45Å; T423-V427 VanDerWaalsContact O-CG2 3.26Å; T423-V427 WeakPolarHBondContact O-CG2 3.46Å; T423-V427 PolarHBondContact O-N 3.23Å
424	I	88.4	Confident	87.2	Confident	80 Å²	80	58.8 Å²	58.8	41%	0.41	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-43.5	176.8	-68.1	166.1	0	0	0	110.9	I420 Y421 L422 V427 K428	I420-I424 HydrophobicContact CG2-CD1 3.78Å; I420-I424 HydrophobicContact CG2-CG1 4.46Å; I420-I424 VanDerWaalsContact O-CG1 3.31Å; I420-I424 WeakPolarHBondContact O-CG1 3.39Å; I420-I424 PolarHBondContact O-N 3.5Å; Y421-I424 PolarHBondContact O-N 2.87Å; L422-I424 PolarHBondContact O-N 3.42Å; I424-V427 PolarHBondContact O-N 3.32Å; I424-K428 HydrophobicContact CG2-CD 4.05Å; I424-K428 HydrophobicContact CG2-CG 4.39Å; I424-K428 WeakPolarHBondContact O-CB 3.38Å; I424-K428 VanDerWaalsContact O-CG 3.3Å; I424-K428 WeakPolarHBondContact O-CG 2.96Å; I424-K428 PolarHBondContact O-N 3.13Å
425	L	85.3	Confident	86.6	Confident	11 Å²	11	59.6 Å²	59.6	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-48.3	176.4	-84.2	176	0	0	0	111.8	T334 M338 Y421 L422 T423 V427 K428 A429	T334-L425 HydrophobicContact CG2-CB 3.78Å; M338-L425 HydrophobicContact CE-CD2 4.4Å; M338-L425 HydrophobicContact SD-CB 4.43Å; M338-L425 HydrophobicContact SD-CD2 3.4Å; M338-L425 WeakPolarHBondContact SD-CD2 3.27Å; Y421-L425 HydrophobicContact CD1-CD1 3.94Å; Y421-L425 HydrophobicContact CE1-CD1 3.19Å; Y421-L425 HydrophobicContact CE1-CG 3.88Å; Y421-L425 HydrophobicContact CE2-CD1 4.46Å; Y421-L425 HydrophobicContact CE2-CG 4.27Å; Y421-L425 VanDerWaalsContact CZ-CD1 3.46Å; Y421-L425 PolarHBondContact O-N 3.04Å; Y421-L425 WeakPolarHBondContact OH-CD1 3.42Å; Y421-L425 WeakPolarHBondContact OH-CD2 3.49Å; Y421-L425 WeakPolarHBondContact OH-CG 3.3Å; L422-L425 WeakPolarHBondContact O-CB 3.32Å; L422-L425 PolarHBondContact O-N 3.05Å; T423-L425 VanDerWaalsContact C-N 3.32Å; T423-L425 PolarHBondContact O-N 3.47Å; L425-V427 PolarHBondContact O-N 3.14Å; L425-K428 PolarHBondContact O-N 3.48Å; L425-A429 VanDerWaalsContact O-CB 3.29Å; L425-A429 WeakPolarHBondContact O-CB 3.1Å; L425-A429 PolarHBondContact O-N 3.2Å
426	V	86	Confident	85.8	Confident	34 Å²	34	60.7 Å²	60.7	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-44.3	179.5	171.9	0	0	0	0	110.7	T334 L422 T423 A429 F430 L462	T334-V426 HydrophobicContact CG2-CG2 4.05Å; L422-V426 HydrophobicContact CG-CG2 4.46Å; L422-V426 VanDerWaalsContact O-CG2 3.3Å; L422-V426 WeakPolarHBondContact O-CG2 3.12Å; L422-V426 PolarHBondContact O-N 3.16Å; T423-V426 PolarHBondContact O-N 3.23Å; V426-A429 PolarHBondContact O-N 3.38Å; V426-F430 WeakPolarHBondContact O-CB 3.23Å; V426-F430 PolarHBondContact O-N 3.43Å; V426-L462 HydrophobicContact CG1-CD1 4.17Å; V426-L462 HydrophobicContact CG1-CD2 4.12Å; V426-L462 HydrophobicContact CG2-CD1 4.34Å
427	V	87.2	Confident	85	Confident	77 Å²	77	57.9 Å²	57.9	47%	0.467	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-45.6	176.1	170.9	0	0	0	0	111	T423 I424 L425 F430 I431	T423-V427 HydrophobicContact CG2-CG2 4.33Å; T423-V427 WeakPolarHBondContact O-CB 3.45Å; T423-V427 VanDerWaalsContact O-CG2 3.26Å; T423-V427 WeakPolarHBondContact O-CG2 3.46Å; T423-V427 PolarHBondContact O-N 3.23Å; I424-V427 PolarHBondContact O-N 3.32Å; L425-V427 PolarHBondContact O-N 3.14Å; V427-F430 WeakPolarHBondContact O-CB 3.44Å; V427-F430 PolarHBondContact O-N 3.02Å; V427-I431 HydrophobicContact CG1-CD1 3.83Å; V427-I431 HydrophobicContact CG1-CG1 4.48Å; V427-I431 VanDerWaalsContact O-CG1 3.31Å; V427-I431 WeakPolarHBondContact O-CG1 3.4Å; V427-I431 PolarHBondContact O-N 3.43Å
428	K	86.3	Confident	84.4	Confident	109 Å²	109	65.1 Å²	65.1	47%	0.474	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-43.2	176.3	-77.1	-178.1	175.4	-178.7	0	112	M338 I424 L425 F430 I431 Q432	M338-K428 HydrophobicContact CE-CB 3.54Å; M338-K428 HydrophobicContact CE-CD 4.19Å; M338-K428 HydrophobicContact SD-CB 4.27Å; I424-K428 HydrophobicContact CG2-CD 4.05Å; I424-K428 HydrophobicContact CG2-CG 4.39Å; I424-K428 WeakPolarHBondContact O-CB 3.38Å; I424-K428 VanDerWaalsContact O-CG 3.3Å; I424-K428 WeakPolarHBondContact O-CG 2.96Å; I424-K428 PolarHBondContact O-N 3.13Å; L425-K428 PolarHBondContact O-N 3.48Å; K428-F430 VanDerWaalsContact C-N 3.31Å; K428-F430 PolarHBondContact O-N 3.5Å; K428-I431 PolarHBondContact O-N 2.81Å; K428-Q432 WeakPolarHBondContact O-CB 3.41Å; K428-Q432 VanDerWaalsContact O-CG 3.29Å; K428-Q432 WeakPolarHBondContact O-CG 3.25Å; K428-Q432 PolarHBondContact O-N 3.01Å
429	A	80.8	Confident	83.6	Confident	2 Å²	2	68.5 Å²	68.5	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-60.5	-43.1	175.7	0	0	0	0	0	110.8	T334 M338 L425 V426 Q432 I433 F458	T334-A429 HydrophobicContact CG2-CB 4.25Å; M338-A429 HydrophobicContact CG-CB 3.79Å; M338-A429 HydrophobicContact SD-CB 4.29Å; L425-A429 VanDerWaalsContact O-CB 3.29Å; L425-A429 WeakPolarHBondContact O-CB 3.1Å; L425-A429 PolarHBondContact O-N 3.2Å; V426-A429 PolarHBondContact O-N 3.38Å; A429-Q432 PolarHBondContact O-N 2.62Å; A429-I433 WeakPolarHBondContact O-CB 3.42Å; A429-I433 WeakPolarHBondContact O-CD1 3.43Å; A429-I433 WeakPolarHBondContact O-CG1 3.48Å; A429-I433 PolarHBondContact O-N 3.25Å; A429-F458 HydrophobicContact CB-CE1 4.01Å; A429-F458 HydrophobicContact CB-CE2 4.42Å; A429-F458 HydrophobicContact CB-CZ 3.59Å
430	F	82.6	Confident	82.9	Confident	90 Å²	90	64.3 Å²	64.3	40%	0.395	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-49.1	176.2	-167.1	-102.3	0	0	0	111.9	V426 V427 K428 Q432 I433 L434 M459	V426-F430 WeakPolarHBondContact O-CB 3.23Å; V426-F430 PolarHBondContact O-N 3.43Å; V427-F430 WeakPolarHBondContact O-CB 3.44Å; V427-F430 PolarHBondContact O-N 3.02Å; K428-F430 VanDerWaalsContact C-N 3.31Å; K428-F430 PolarHBondContact O-N 3.5Å; F430-Q432 VanDerWaalsContact C-N 3.34Å; F430-Q432 PolarHBondContact O-N 3.49Å; F430-I433 PolarHBondContact O-N 2.98Å; F430-L434 HydrophobicContact CD1-CD1 3.75Å; F430-L434 HydrophobicContact CD1-CG 4.31Å; F430-L434 HydrophobicContact CE1-CD1 3.52Å; F430-L434 HydrophobicContact CE1-CG 4.15Å; F430-L434 HydrophobicContact CZ-CD1 4.31Å; F430-L434 WeakPolarHBondContact O-CG 3.33Å; F430-L434 PolarHBondContact O-N 2.79Å; F430-M459 HydrophobicContact CD2-CE 3.81Å; F430-M459 HydrophobicContact CE2-CE 3.95Å
431	I	84.3	Confident	82.2	Confident	104 Å²	104	66 Å²	66	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-44.3	176.3	-66.9	166.6	0	0	0	111.1	V427 K428 I433 L434 G435	V427-I431 HydrophobicContact CG1-CD1 3.83Å; V427-I431 HydrophobicContact CG1-CG1 4.48Å; V427-I431 VanDerWaalsContact O-CG1 3.31Å; V427-I431 WeakPolarHBondContact O-CG1 3.4Å; V427-I431 PolarHBondContact O-N 3.43Å; K428-I431 PolarHBondContact O-N 2.81Å; I431-I433 VanDerWaalsContact C-N 3.34Å; I431-I433 PolarHBondContact O-N 3.19Å; I431-L434 PolarHBondContact O-N 2.82Å; I431-G435 PolarHBondContact O-N 3.43Å
432	Q	80.7	Confident	81.7	Confident	47 Å²	47	68.9 Å²	68.9	22%	0.22	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-40.3	178.1	-77.1	-179.9	-2.5	0	0	112.2	K428 A429 F430 G435 K436	K428-Q432 WeakPolarHBondContact O-CB 3.41Å; K428-Q432 VanDerWaalsContact O-CG 3.29Å; K428-Q432 WeakPolarHBondContact O-CG 3.25Å; K428-Q432 PolarHBondContact O-N 3.01Å; A429-Q432 PolarHBondContact O-N 2.62Å; F430-Q432 VanDerWaalsContact C-N 3.34Å; F430-Q432 PolarHBondContact O-N 3.49Å; Q432-G435 PolarHBondContact O-N 2.96Å; Q432-K436 WeakPolarHBondContact O-CB 3.48Å; Q432-K436 WeakPolarHBondContact O-CG 3.46Å; Q432-K436 PolarHBondContact O-N 3.03Å
433	I	79.5	Confident	81	Confident	13 Å²	13	69.3 Å²	69.3	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-67	-41.9	177.5	-70.5	166.7	0	0	0	110.6	A429 F430 I431 G435 K436 R437 I455 F458 M459	A429-I433 WeakPolarHBondContact O-CB 3.42Å; A429-I433 WeakPolarHBondContact O-CD1 3.43Å; A429-I433 WeakPolarHBondContact O-CG1 3.48Å; A429-I433 PolarHBondContact O-N 3.25Å; F430-I433 PolarHBondContact O-N 2.98Å; I431-I433 VanDerWaalsContact C-N 3.34Å; I431-I433 PolarHBondContact O-N 3.19Å; I433-G435 VanDerWaalsContact C-N 3.31Å; I433-G435 PolarHBondContact O-N 2.88Å; I433-K436 PolarHBondContact O-N 3.37Å; I433-R437 HydrophobicContact CG2-CG 4.36Å; I433-R437 WeakPolarHBondContact O-CB 2.93Å; I433-R437 WeakPolarHBondContact O-CG 3.43Å; I433-R437 PolarHBondContact O-N 2.04Å; I433-I455 HydrophobicContact CG1-CG1 4.43Å; I433-I455 HydrophobicContact CG2-CD1 4.46Å; I433-I455 HydrophobicContact CG2-CG1 4.24Å; I433-I455 HydrophobicContact CG2-CG2 3.56Å; I433-F458 HydrophobicContact CD1-CB 4.46Å; I433-F458 HydrophobicContact CD1-CD1 3.12Å; I433-F458 HydrophobicContact CD1-CE1 3.46Å; I433-F458 VanDerWaalsContact CD1-CE1 3.46Å; I433-F458 HydrophobicContact CD1-CG 3.99Å; I433-M459 HydrophobicContact CB-CE 4.04Å; I433-M459 HydrophobicContact CD1-CE 3.84Å; I433-M459 HydrophobicContact CG2-CE 3.52Å
434	L	81.8	Confident	80.6	Confident	77 Å²	77	69.5 Å²	69.5	40%	0.403	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-41.4	173.8	-70	176.8	0	0	0	111.8	F430 I431	F430-L434 HydrophobicContact CD1-CD1 3.75Å; F430-L434 HydrophobicContact CD1-CG 4.31Å; F430-L434 HydrophobicContact CE1-CD1 3.52Å; F430-L434 HydrophobicContact CE1-CG 4.15Å; F430-L434 HydrophobicContact CZ-CD1 4.31Å; F430-L434 WeakPolarHBondContact O-CG 3.33Å; F430-L434 PolarHBondContact O-N 2.79Å; I431-L434 PolarHBondContact O-N 2.82Å
435	G	80.4	Confident	80.2	Confident	34 Å²	34	73 Å²	73	35%	0.351	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-48.7	174.6	0	0	0	0	0	112.8	I431 Q432 I433 R437 R438	I431-G435 PolarHBondContact O-N 3.43Å; Q432-G435 PolarHBondContact O-N 2.96Å; I433-G435 VanDerWaalsContact C-N 3.31Å; I433-G435 PolarHBondContact O-N 2.88Å; G435-R437 VanDerWaalsContact C-N 3.35Å; G435-R437 PolarHBondContact O-N 3.08Å; G435-R438 WeakPolarHBondContact O-CB 3.34Å; G435-R438 PolarHBondContact O-N 3.3Å
436	K	75.2	Confident	79.4	Confident	63 Å²	63	77.3 Å²	77.3	27%	0.274	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-32.3	-179.7	-73.6	-179.3	-179.4	176.1	0	113	M339 Q432 I433 R438 L439 L440	M339-K436 PolarHBondContact O-NZ 3.25Å; M339-K436 VanDerWaalsContact O-NZ 3.13Å; Q432-K436 WeakPolarHBondContact O-CB 3.48Å; Q432-K436 WeakPolarHBondContact O-CG 3.46Å; Q432-K436 PolarHBondContact O-N 3.03Å; I433-K436 PolarHBondContact O-N 3.37Å; K436-R438 PolarHBondContact O-N 3.45Å; K436-L439 PolarHBondContact O-N 2.89Å; K436-L440 WeakPolarHBondContact O-CG 3.3Å; K436-L440 PolarHBondContact O-N 2.84Å
437	R	77.4	Confident	78.8	Confident	80 Å²	80	77.9 Å²	77.9	30%	0.302	39%	0.387	S	S	.	.	H	α-helix	trans	-57.7	-33.4	172.6	-80.4	-176.3	-177.1	-155.1	0.7	112.6	I433 G435 L440 I455 E624	I433-R437 HydrophobicContact CG2-CG 4.36Å; I433-R437 WeakPolarHBondContact O-CB 2.93Å; I433-R437 WeakPolarHBondContact O-CG 3.43Å; I433-R437 PolarHBondContact O-N 2.04Å; G435-R437 VanDerWaalsContact C-N 3.35Å; G435-R437 PolarHBondContact O-N 3.08Å; R437-L440 HydrophobicContact CB-CD1 4.38Å; R437-L440 HydrophobicContact CG-CD1 4.08Å; R437-I455 HydrophobicContact CG-CD1 4.45Å; R437-E624 IonicContact NH1-OE2 3.68Å
438	R	78.1	Confident	78.3	Confident	196 Å²	196	78.7 Å²	78.7	74%	0.74	38%	0.382	S	S	*	.	H	α-helix	trans	-70.3	-32.5	175.7	-61.7	176.8	-178.3	-178.1	-1.2	112.7	G435 K436	G435-R438 WeakPolarHBondContact O-CB 3.34Å; G435-R438 PolarHBondContact O-N 3.3Å; K436-R438 PolarHBondContact O-N 3.45Å
439	L	75.2	Confident	77.6	Confident	84 Å²	84	82.8 Å²	82.8	44%	0.44	40%	0.395	S	S	.	.	H	α-helix	trans	-83.9	-23.2	-179.1	-61.3	175.6	0	0	0	113.3	K436 N441 N442 L585	K436-L439 PolarHBondContact O-N 2.89Å; L439-N441 PolarHBondContact O-N 2.82Å; L439-N441 VanDerWaalsContact O-N 3.14Å; L439-N442 PolarHBondContact O-N 2.88Å; L439-L585 HydrophobicContact CD1-CD1 4.29Å; L439-L585 HydrophobicContact CD2-CD1 4.38Å
440	L	74	Confident	77.1	Confident	18 Å²	18	85.6 Å²	85.6	9%	0.094	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-54.4	-33.5	-178.6	-86.5	157.1	0	0	0	113.3	K436 R437 N442 L443 R448 I455	K436-L440 WeakPolarHBondContact O-CG 3.3Å; K436-L440 PolarHBondContact O-N 2.84Å; R437-L440 HydrophobicContact CB-CD1 4.38Å; R437-L440 HydrophobicContact CG-CD1 4.08Å; L440-N442 PolarHBondContact O-N 3.45Å; L440-L443 HydrophobicContact CD2-CD1 4.49Å; L440-L443 PolarHBondContact O-N 3.29Å; L440-R448 HydrophobicContact CB-CG 4.49Å; L440-R448 HydrophobicContact CD2-CG 3.93Å; L440-R448 PolarHBondContact O-NE 3.31Å; L440-I455 HydrophobicContact CD1-CD1 3.58Å
441	N	76.2	Confident	76.7	Confident	116 Å²	116	84.9 Å²	84.9	62%	0.62	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-66.7	-22.4	-179.5	-73.4	-11.3	0	0	0	113.8	L439 R448	L439-N441 PolarHBondContact O-N 2.82Å; L439-N441 VanDerWaalsContact O-N 3.14Å; N441-R448 PolarHBondContact O-NH2 3.21Å
442	N	78	Confident	76.5	Confident	108 Å²	108	83 Å²	83	58%	0.578	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-95.8	-7	-178.6	-63.9	-17.2	0	0	0	112.8	L439 L440	L439-N442 PolarHBondContact O-N 2.88Å; L440-N442 PolarHBondContact O-N 3.45Å
443	L	75.1	Confident	76.3	Confident	34 Å²	34	81.2 Å²	81.2	18%	0.178	39%	0.39	C	S	.	.	S	Bend	trans	-84	147.8	-178	-67.8	173.4	0	0	0	112.3	L440 Q447 R448 Y451	L440-L443 HydrophobicContact CD2-CD1 4.49Å; L440-L443 PolarHBondContact O-N 3.29Å; L443-Q447 HydrophobicContact CB-CB 4.47Å; L443-R448 HydrophobicContact CB-CB 4.43Å; L443-R448 PolarHBondContact O-NE 3.46Å; L443-R448 PolarHBondContact O-NH2 3.1Å; L443-Y451 HydrophobicContact CD1-CD2 3.94Å; L443-Y451 HydrophobicContact CD1-CE2 4.36Å
444	P	81.3	Confident	76.2	Confident	83 Å²	83	81.4 Å²	81.4	54%	0.539	39%	0.392	S	S	.	.			trans	-51.1	146.5	168	-24.9	33.5	0	0	0	112	E446 Q447 R448	P444-E446 VanDerWaalsContact C-N 3.26Å; P444-E446 PolarHBondContact O-N 3Å; P444-E446 VanDerWaalsContact O-N 3.13Å; P444-Q447 PolarHBondContact O-N 3.01Å; P444-Q447 VanDerWaalsContact O-N 3.11Å; P444-R448 WeakPolarHBondContact O-CB 3.48Å; P444-R448 PolarHBondContact O-N 3.19Å
445	M	77.9	Confident	76.2	Confident	153 Å²	153	78.4 Å²	78.4	75%	0.754	38%	0.376	S	S	*	.	H	α-helix	trans	-53	-39.9	-171.6	-170.6	175.4	-176.3	0	0	113.5	R448 R449	M445-R448 PolarHBondContact O-N 2.88Å; M445-R449 WeakPolarHBondContact O-CB 3.44Å; M445-R449 PolarHBondContact O-N 2.97Å
446	E	69.8	Low	76.3	Confident	101 Å²	101	81.3 Å²	81.3	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-67.1	-45.9	179.8	-60.9	-60.1	166.2	0	0	112.9	P444 R449 Y450 L532	P444-E446 VanDerWaalsContact C-N 3.26Å; P444-E446 PolarHBondContact O-N 3Å; P444-E446 VanDerWaalsContact O-N 3.13Å; E446-R449 PolarHBondContact O-N 2.97Å; E446-Y450 PolarHBondContact O-N 3.07Å; E446-Y450 VanDerWaalsContact O-N 3.13Å; E446-L532 HydrophobicContact CB-CD1 4.5Å; E446-L532 HydrophobicContact CG-CD1 4.28Å
447	Q	72.4	Confident	76.8	Confident	47 Å²	47	78.5 Å²	78.5	22%	0.22	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-41.4	176.5	-71.6	-177.9	-10.9	0	0	110.9	L443 P444 R449 Y450 Y451 L536	L443-Q447 HydrophobicContact CB-CB 4.47Å; P444-Q447 PolarHBondContact O-N 3.01Å; P444-Q447 VanDerWaalsContact O-N 3.11Å; Q447-R449 VanDerWaalsContact C-N 3.32Å; Q447-R449 PolarHBondContact O-N 3.16Å; Q447-Y450 PolarHBondContact O-N 2.95Å; Q447-Y451 HydrophobicContact CB-CD2 4.4Å; Q447-Y451 HydrophobicContact CB-CE2 4.43Å; Q447-Y451 WeakPolarHBondContact O-CD2 3.39Å; Q447-Y451 PolarHBondContact O-N 3.17Å; Q447-L536 HydrophobicContact CG-CD2 3.92Å
448	R	77.5	Confident	77.1	Confident	94 Å²	94	74.7 Å²	74.7	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-56.8	-46	175.8	-172	-174.5	-50.8	-161.6	-0.3	111.4	L440 N441 L443 P444 M445 Y450 S452	L440-R448 HydrophobicContact CB-CG 4.49Å; L440-R448 HydrophobicContact CD2-CG 3.93Å; L440-R448 PolarHBondContact O-NE 3.31Å; N441-R448 PolarHBondContact O-NH2 3.21Å; L443-R448 HydrophobicContact CB-CB 4.43Å; L443-R448 PolarHBondContact O-NE 3.46Å; L443-R448 PolarHBondContact O-NH2 3.1Å; P444-R448 WeakPolarHBondContact O-CB 3.48Å; P444-R448 PolarHBondContact O-N 3.19Å; M445-R448 PolarHBondContact O-N 2.88Å; R448-Y450 PolarHBondContact O-N 2.85Å; R448-S452 WeakPolarHBondContact O-CB 3.41Å; R448-S452 PolarHBondContact O-N 2.89Å
449	R	72	Confident	77.5	Confident	195 Å²	195	66.9 Å²	66.9	74%	0.736	32%	0.322	S	S	*	.	H	α-helix	trans	-62.5	-42.6	178.4	-169.7	174.5	-172.6	162.3	4.4	111.9	M445 E446 Q447 G453	M445-R449 WeakPolarHBondContact O-CB 3.44Å; M445-R449 PolarHBondContact O-N 2.97Å; E446-R449 PolarHBondContact O-N 2.97Å; Q447-R449 VanDerWaalsContact C-N 3.32Å; Q447-R449 PolarHBondContact O-N 3.16Å; R449-G453 PolarHBondContact O-N 3.26Å
450	Y	70.6	Confident	78.1	Confident	60 Å²	60	65.1 Å²	65.1	24%	0.235	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-52	177	176.8	-104	0	0	0	112.5	M1 A2 E446 Q447 R448 G453 I454 L536	M1-Y450 PolarHBondContact N-OH 2.83Å; M1-Y450 VanDerWaalsContact N-OH 3.09Å; A2-Y450 HydrophobicContact CB-CD2 3.97Å; A2-Y450 HydrophobicContact CB-CE2 3.76Å; E446-Y450 PolarHBondContact O-N 3.07Å; E446-Y450 VanDerWaalsContact O-N 3.13Å; Q447-Y450 PolarHBondContact O-N 2.95Å; R448-Y450 PolarHBondContact O-N 2.85Å; Y450-G453 PolarHBondContact O-N 2.74Å; Y450-I454 HydrophobicContact CD1-CD1 4.11Å; Y450-I454 HydrophobicContact CE1-CD1 3.51Å; Y450-I454 HydrophobicContact CE2-CD1 4.07Å; Y450-I454 VanDerWaalsContact CZ-CD1 3.5Å; Y450-I454 PolarHBondContact O-N 3.1Å; Y450-I454 VanDerWaalsContact O-N 3.15Å; Y450-L536 HydrophobicContact CD2-CD1 4.49Å
451	Y	73.9	Confident	78.8	Confident	76 Å²	76	64.7 Å²	64.7	30%	0.298	31%	0.313	S	S	.	.	H	α-helix	trans	-66.7	-38.1	179.8	-76	-68	0	0	0	112.4	M339 L443 Q447 G453 I454 I455	M339-Y451 HydrophobicContact CE-CD1 3.88Å; M339-Y451 HydrophobicContact CE-CE1 4.08Å; M339-Y451 HydrophobicContact SD-CD1 3.96Å; M339-Y451 HydrophobicContact SD-CE1 3.62Å; L443-Y451 HydrophobicContact CD1-CD2 3.94Å; L443-Y451 HydrophobicContact CD1-CE2 4.36Å; Q447-Y451 HydrophobicContact CB-CD2 4.4Å; Q447-Y451 HydrophobicContact CB-CE2 4.43Å; Q447-Y451 WeakPolarHBondContact O-CD2 3.39Å; Q447-Y451 PolarHBondContact O-N 3.17Å; Y451-G453 VanDerWaalsContact C-N 3.3Å; Y451-G453 PolarHBondContact O-N 3.16Å; Y451-I454 PolarHBondContact O-N 2.87Å; Y451-I455 WeakPolarHBondContact O-CG1 3.26Å; Y451-I455 PolarHBondContact O-N 3.16Å
452	S	79.3	Confident	79.4	Confident	63 Å²	63	60.2 Å²	60.2	44%	0.441	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-39.6	173.5	-171.1	0	0	0	0	111.6	R448 I455 Y456	R448-S452 WeakPolarHBondContact O-CB 3.41Å; R448-S452 PolarHBondContact O-N 2.89Å; S452-I455 PolarHBondContact O-N 3.41Å; S452-Y456 VanDerWaalsContact O-CB 3.28Å; S452-Y456 WeakPolarHBondContact O-CB 3.46Å; S452-Y456 PolarHBondContact O-N 3.4Å
453	G	77.3	Confident	79.9	Confident	10 Å²	10	58.7 Å²	58.7	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-49.8	174.4	0	0	0	0	0	112	R449 Y450 Y451 I455 Y456 R457	R449-G453 PolarHBondContact O-N 3.26Å; Y450-G453 PolarHBondContact O-N 2.74Å; Y451-G453 VanDerWaalsContact C-N 3.3Å; Y451-G453 PolarHBondContact O-N 3.16Å; G453-I455 PolarHBondContact O-N 3.32Å; G453-Y456 WeakPolarHBondContact O-CB 3.3Å; G453-Y456 PolarHBondContact O-N 3.35Å; G453-R457 WeakPolarHBondContact O-CG 3.28Å; G453-R457 PolarHBondContact O-N 3.43Å
454	I	77.3	Confident	80.7	Confident	18 Å²	18	60.3 Å²	60.3	9%	0.092	29%	0.288	C	S	.	.	H	α-helix	trans	-62.2	-44.3	179.2	-63.2	171.9	0	0	0	111.8	M339 Y450 Y451 Y456 R457 F458	M339-I454 HydrophobicContact CE-CB 3.98Å; M339-I454 HydrophobicContact CE-CD1 3.56Å; M339-I454 HydrophobicContact CE-CG1 4.36Å; M339-I454 HydrophobicContact CE-CG2 3.53Å; Y450-I454 HydrophobicContact CD1-CD1 4.11Å; Y450-I454 HydrophobicContact CE1-CD1 3.51Å; Y450-I454 HydrophobicContact CE2-CD1 4.07Å; Y450-I454 VanDerWaalsContact CZ-CD1 3.5Å; Y450-I454 PolarHBondContact O-N 3.1Å; Y450-I454 VanDerWaalsContact O-N 3.15Å; Y451-I454 PolarHBondContact O-N 2.87Å; I454-Y456 VanDerWaalsContact C-N 3.32Å; I454-Y456 PolarHBondContact O-N 3.24Å; I454-R457 PolarHBondContact O-N 3.5Å; I454-F458 PolarHBondContact O-N 2.91Å
455	I	81	Confident	81.2	Confident	14 Å²	14	57.2 Å²	57.2	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-43.9	177.4	-71.7	166.9	0	0	0	110.7	I433 R437 L440 Y451 S452 G453 F458 M459	I433-I455 HydrophobicContact CG1-CG1 4.43Å; I433-I455 HydrophobicContact CG2-CD1 4.46Å; I433-I455 HydrophobicContact CG2-CG1 4.24Å; I433-I455 HydrophobicContact CG2-CG2 3.56Å; R437-I455 HydrophobicContact CG-CD1 4.45Å; L440-I455 HydrophobicContact CD1-CD1 3.58Å; Y451-I455 WeakPolarHBondContact O-CG1 3.26Å; Y451-I455 PolarHBondContact O-N 3.16Å; S452-I455 PolarHBondContact O-N 3.41Å; G453-I455 PolarHBondContact O-N 3.32Å; I455-F458 PolarHBondContact O-N 2.81Å; I455-M459 HydrophobicContact CG2-CG 4.45Å; I455-M459 WeakPolarHBondContact O-CB 3.37Å; I455-M459 WeakPolarHBondContact O-CG 3.44Å; I455-M459 PolarHBondContact O-N 2.89Å
456	Y	83	Confident	81.9	Confident	95 Å²	95	54.8 Å²	54.8	37%	0.373	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-47.4	178.1	179	-101.1	0	0	0	111.7	L6 L14 S452 G453 I454 F458 M459 V460	L6-Y456 HydrophobicContact CD1-CE1 4.38Å; L14-Y456 WeakPolarHBondContact CD2-OH 3.33Å; S452-Y456 VanDerWaalsContact O-CB 3.28Å; S452-Y456 WeakPolarHBondContact O-CB 3.46Å; S452-Y456 PolarHBondContact O-N 3.4Å; G453-Y456 WeakPolarHBondContact O-CB 3.3Å; G453-Y456 PolarHBondContact O-N 3.35Å; I454-Y456 VanDerWaalsContact C-N 3.32Å; I454-Y456 PolarHBondContact O-N 3.24Å; Y456-F458 VanDerWaalsContact C-N 3.34Å; Y456-F458 PolarHBondContact O-N 2.79Å; Y456-M459 PolarHBondContact O-N 3.22Å; Y456-V460 HydrophobicContact CD1-CG2 4.25Å; Y456-V460 HydrophobicContact CD2-CG2 4.13Å; Y456-V460 HydrophobicContact CE1-CG2 3.87Å; Y456-V460 HydrophobicContact CE2-CG2 3.74Å; Y456-V460 HydrophobicContact CG-CG2 4.38Å; Y456-V460 WeakPolarHBondContact O-CG2 3.42Å; Y456-V460 PolarHBondContact O-N 3.16Å
457	R	85.1	Confident	83	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.011	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-45.1	177.5	-64.9	-173.4	-154.7	-179.7	2.2	112.5	M1 V4 L6 E7 G453 I454 L461 Y518	M1-R457 PolarHBondContact O-NH1 3.18Å; M1-R457 PolarHBondContact O-NH2 3.32Å; V4-R457 VanDerWaalsContact CB-CZ 3.48Å; L6-R457 HydrophobicContact CD2-CB 4.1Å; L6-R457 HydrophobicContact CD2-CG 3.9Å; L6-R457 HydrophobicContact CG-CG 4.32Å; E7-R457 VanDerWaalsContact CD-CZ 3.41Å; E7-R457 HydrophobicContact CG-CG 4.43Å; E7-R457 IonicContact OE1-CZ 3.02Å; E7-R457 IonicContact OE1-NE 2.73Å; E7-R457 PolarHBondContact OE1-NE 3.28Å; E7-R457 IonicContact OE1-NH2 2.76Å; E7-R457 PolarHBondContact OE1-NH2 3.17Å; E7-R457 IonicContact OE2-CZ 3.65Å; E7-R457 IonicContact OE2-NE 3.86Å; E7-R457 IonicContact OE2-NH2 2.71Å; E7-R457 PolarHBondContact OE2-NH2 3.15Å; G453-R457 WeakPolarHBondContact O-CG 3.28Å; G453-R457 PolarHBondContact O-N 3.43Å; I454-R457 PolarHBondContact O-N 3.5Å; R457-L461 PolarHBondContact O-N 2.8Å; R457-L461 VanDerWaalsContact O-N 3.15Å; R457-Y518 PolarHBondContact O-OH 2.87Å
458	F	84.4	Confident	84	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-49.8	178.4	-179.7	-100.5	0	0	0	111.4	F333 T334 H337 A429 I433 I454 I455 Y456 L461 L462	F333-F458 HydrophobicContact CD1-CD2 4.42Å; F333-F458 HydrophobicContact CD1-CE2 4.39Å; F333-F458 AromaticContact CE1-CD2 3.64Å; F333-F458 HydrophobicContact CE1-CD2 3.64Å; F333-F458 AromaticContact CE1-CE2 3.92Å; F333-F458 HydrophobicContact CE1-CE2 3.92Å; F333-F458 AromaticContact CZ-CD2 3.95Å; F333-F458 HydrophobicContact CZ-CD2 3.95Å; T334-F458 HydrophobicContact CG2-CE2 4.35Å; T334-F458 HydrophobicContact CG2-CZ 4.39Å; H337-F458 HydrophobicContact CB-CB 4.32Å; H337-F458 HydrophobicContact CB-CD2 3.38Å; H337-F458 HydrophobicContact CB-CE2 3.93Å; H337-F458 HydrophobicContact CB-CG 4.04Å; H337-F458 AromaticContact CG-CD2 3.55Å; A429-F458 HydrophobicContact CB-CE1 4.01Å; A429-F458 HydrophobicContact CB-CE2 4.42Å; A429-F458 HydrophobicContact CB-CZ 3.59Å; I433-F458 HydrophobicContact CD1-CB 4.46Å; I433-F458 HydrophobicContact CD1-CD1 3.12Å; I433-F458 HydrophobicContact CD1-CE1 3.46Å; I433-F458 VanDerWaalsContact CD1-CE1 3.46Å; I433-F458 HydrophobicContact CD1-CG 3.99Å; I454-F458 PolarHBondContact O-N 2.91Å; I455-F458 PolarHBondContact O-N 2.81Å; Y456-F458 VanDerWaalsContact C-N 3.34Å; Y456-F458 PolarHBondContact O-N 2.79Å; F458-L461 PolarHBondContact O-N 2.8Å; F458-L462 HydrophobicContact CD1-CD2 4.49Å; F458-L462 HydrophobicContact CE1-CD2 3.71Å; F458-L462 HydrophobicContact CZ-CD2 3.97Å; F458-L462 WeakPolarHBondContact O-CB 3.45Å; F458-L462 PolarHBondContact O-N 3.07Å
459	M	86.6	Confident	84.7	Confident	31 Å²	31	49.6 Å²	49.6	15%	0.153	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-44.3	-177.7	-73	-65.5	-177.6	0	0	112.4	F430 I433 I455 Y456 L461 L462 T463	F430-M459 HydrophobicContact CD2-CE 3.81Å; F430-M459 HydrophobicContact CE2-CE 3.95Å; I433-M459 HydrophobicContact CB-CE 4.04Å; I433-M459 HydrophobicContact CD1-CE 3.84Å; I433-M459 HydrophobicContact CG2-CE 3.52Å; I455-M459 HydrophobicContact CG2-CG 4.45Å; I455-M459 WeakPolarHBondContact O-CB 3.37Å; I455-M459 WeakPolarHBondContact O-CG 3.44Å; I455-M459 PolarHBondContact O-N 2.89Å; Y456-M459 PolarHBondContact O-N 3.22Å; M459-L461 PolarHBondContact O-N 3.14Å; M459-L462 PolarHBondContact O-N 2.92Å; M459-T463 WeakPolarHBondContact O-CB 3.23Å; M459-T463 PolarHBondContact O-N 2.62Å; M459-T463 PolarHBondContact O-OG1 3.18Å
460	V	87	Confident	85.7	Confident	47 Å²	47	42.3 Å²	42.3	29%	0.285	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-47.8	179.1	170.9	0	0	0	0	111	Y456 Y464	Y456-V460 HydrophobicContact CD1-CG2 4.25Å; Y456-V460 HydrophobicContact CD2-CG2 4.13Å; Y456-V460 HydrophobicContact CE1-CG2 3.87Å; Y456-V460 HydrophobicContact CE2-CG2 3.74Å; Y456-V460 HydrophobicContact CG-CG2 4.38Å; Y456-V460 WeakPolarHBondContact O-CG2 3.42Å; Y456-V460 PolarHBondContact O-N 3.16Å; V460-Y464 WeakPolarHBondContact O-CB 3.22Å; V460-Y464 PolarHBondContact O-N 3.4Å
461	L	89.1	Confident	86.7	Confident	9 Å²	9	43 Å²	43	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-71	-38.4	-178.9	-172.3	66.2	0	0	0	112.2	F329 F333 R457 F458 M459 Y464 T465 Y510 V514 Y518	F329-L461 HydrophobicContact CE1-CD2 4.41Å; F329-L461 HydrophobicContact CZ-CD2 3.88Å; F333-L461 HydrophobicContact CD1-CD2 4.11Å; F333-L461 HydrophobicContact CD2-CD2 3.68Å; F333-L461 HydrophobicContact CE1-CB 4.13Å; F333-L461 HydrophobicContact CE1-CD2 3.76Å; F333-L461 HydrophobicContact CE1-CG 4.2Å; F333-L461 HydrophobicContact CE2-CB 4.36Å; F333-L461 HydrophobicContact CE2-CD2 3.3Å; F333-L461 HydrophobicContact CE2-CG 4.37Å; F333-L461 HydrophobicContact CG-CD2 4.07Å; F333-L461 HydrophobicContact CZ-CB 3.67Å; F333-L461 HydrophobicContact CZ-CD2 3.34Å; F333-L461 HydrophobicContact CZ-CG 3.96Å; R457-L461 PolarHBondContact O-N 2.8Å; R457-L461 VanDerWaalsContact O-N 3.15Å; F458-L461 PolarHBondContact O-N 2.8Å; M459-L461 PolarHBondContact O-N 3.14Å; L461-Y464 HydrophobicContact CD1-CD1 4.39Å; L461-Y464 PolarHBondContact O-N 3.04Å; L461-T465 WeakPolarHBondContact O-CB 3.35Å; L461-T465 PolarHBondContact O-N 2.84Å; L461-T465 PolarHBondContact O-OG1 3.11Å; L461-Y510 HydrophobicContact CD1-CE2 4.41Å; L461-V514 HydrophobicContact CD1-CG2 3.73Å; L461-Y518 HydrophobicContact CB-CE2 4.41Å; L461-Y518 HydrophobicContact CD1-CE2 4.41Å; L461-Y518 HydrophobicContact CD2-CE2 3.86Å; L461-Y518 HydrophobicContact CG-CE2 4.45Å
462	L	88.4	Confident	87.6	Confident	23 Å²	23	40.7 Å²	40.7	12%	0.12	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-48.8	176.5	-179.6	64.7	0	0	0	110.7	V426 F458 M459 Y464 T465 I466	V426-L462 HydrophobicContact CG1-CD1 4.17Å; V426-L462 HydrophobicContact CG1-CD2 4.12Å; V426-L462 HydrophobicContact CG2-CD1 4.34Å; F458-L462 HydrophobicContact CD1-CD2 4.49Å; F458-L462 HydrophobicContact CE1-CD2 3.71Å; F458-L462 HydrophobicContact CZ-CD2 3.97Å; F458-L462 WeakPolarHBondContact O-CB 3.45Å; F458-L462 PolarHBondContact O-N 3.07Å; M459-L462 PolarHBondContact O-N 2.92Å; L462-Y464 PolarHBondContact O-N 3.36Å; L462-T465 PolarHBondContact O-N 2.82Å; L462-I466 HydrophobicContact CD1-CD1 4.02Å; L462-I466 HydrophobicContact CD1-CG1 4.38Å; L462-I466 HydrophobicContact CG-CD1 3.91Å; L462-I466 WeakPolarHBondContact O-CG1 3.35Å; L462-I466 PolarHBondContact O-N 2.79Å
463	T	89.1	Confident	88.3	Confident	76 Å²	76	41.9 Å²	41.9	47%	0.466	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-46.5	176.6	-62.5	0	0	0	0	111.2	M459 T465 I466 I467	M459-T463 WeakPolarHBondContact O-CB 3.23Å; M459-T463 PolarHBondContact O-N 2.62Å; M459-T463 PolarHBondContact O-OG1 3.18Å; T463-T465 VanDerWaalsContact C-N 3.32Å; T463-T465 PolarHBondContact O-N 2.92Å; T463-I466 PolarHBondContact O-N 2.71Å; T463-I467 HydrophobicContact CG2-CD1 3.85Å; T463-I467 VanDerWaalsContact O-CG1 3.3Å; T463-I467 WeakPolarHBondContact O-CG1 3.39Å; T463-I467 PolarHBondContact O-N 3.27Å
464	Y	91.2	Very high	88.9	Confident	68 Å²	68	43.2 Å²	43.2	27%	0.267	25%	0.246	S	C	.	.	H	α-helix	trans	-60.7	-42.3	178.1	-177.4	-138.6	0	0	0	112	V460 L461 L462 I467 C468 Y510 A513	V460-Y464 WeakPolarHBondContact O-CB 3.22Å; V460-Y464 PolarHBondContact O-N 3.4Å; L461-Y464 HydrophobicContact CD1-CD1 4.39Å; L461-Y464 PolarHBondContact O-N 3.04Å; L462-Y464 PolarHBondContact O-N 3.36Å; Y464-I467 PolarHBondContact O-N 3.32Å; Y464-C468 WeakPolarHBondContact CE2-SG 3.18Å; Y464-C468 PolarHBondContact O-N 2.62Å; Y464-C468 PolarHBondContact O-SG 2.86Å; Y464-C468 VanDerWaalsContact O-SG 3.4Å; Y464-Y510 AromaticContact CD1-CD2 3.64Å; Y464-Y510 HydrophobicContact CD1-CD2 3.64Å; Y464-Y510 AromaticContact CD1-CE2 3.81Å; Y464-Y510 HydrophobicContact CD1-CE2 3.81Å; Y464-Y510 AromaticContact CE1-CD2 3.32Å; Y464-Y510 HydrophobicContact CE1-CD2 3.32Å; Y464-Y510 AromaticContact CE1-CE2 3.98Å; Y464-Y510 HydrophobicContact CE1-CE2 3.98Å; Y464-Y510 HydrophobicContact CE1-CG 4.09Å; Y464-Y510 HydrophobicContact CG-CD2 4.46Å; Y464-Y510 AromaticContact CZ-CD2 3.9Å; Y464-Y510 WeakPolarHBondContact OH-CA 3.26Å; Y464-A513 HydrophobicContact CE1-CB 4.27Å
465	T	92.6	Very high	89.4	Confident	17 Å²	17	45.8 Å²	45.8	10%	0.104	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-44	177.9	-54.4	0	0	0	0	112	W330 L461 L462 T463 I467 C468 A469 Y510	W330-T465 HydrophobicContact CD2-CG2 4.39Å; W330-T465 HydrophobicContact CZ2-CG2 3.85Å; L461-T465 WeakPolarHBondContact O-CB 3.35Å; L461-T465 PolarHBondContact O-N 2.84Å; L461-T465 PolarHBondContact O-OG1 3.11Å; L462-T465 PolarHBondContact O-N 2.82Å; T463-T465 VanDerWaalsContact C-N 3.32Å; T463-T465 PolarHBondContact O-N 2.92Å; T465-I467 VanDerWaalsContact C-N 3.35Å; T465-C468 PolarHBondContact O-N 3.09Å; T465-A469 WeakPolarHBondContact O-CB 3.27Å; T465-A469 PolarHBondContact O-N 3.5Å; T465-Y510 WeakPolarHBondContact OG1-CE2 3.23Å; T465-Y510 PolarHBondContact OG1-OH 3.12Å
466	I	91.9	Very high	89.8	Confident	103 Å²	103	49.9 Å²	49.9	53%	0.528	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-41.8	177.7	-69.2	169	0	0	0	110.9	L462 T463 A469 G470	L462-I466 HydrophobicContact CD1-CD1 4.02Å; L462-I466 HydrophobicContact CD1-CG1 4.38Å; L462-I466 HydrophobicContact CG-CD1 3.91Å; L462-I466 WeakPolarHBondContact O-CG1 3.35Å; L462-I466 PolarHBondContact O-N 2.79Å; T463-I466 PolarHBondContact O-N 2.71Å; I466-A469 PolarHBondContact O-N 2.74Å; I466-G470 PolarHBondContact O-N 2.8Å
467	I	93.1	Very high	90.1	Very high	92 Å²	92	49.9 Å²	49.9	47%	0.472	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-49.3	176.1	-68.4	168.3	0	0	0	110.4	T463 Y464 T465 A469 G470 L471	T463-I467 HydrophobicContact CG2-CD1 3.85Å; T463-I467 VanDerWaalsContact O-CG1 3.3Å; T463-I467 WeakPolarHBondContact O-CG1 3.39Å; T463-I467 PolarHBondContact O-N 3.27Å; Y464-I467 PolarHBondContact O-N 3.32Å; T465-I467 VanDerWaalsContact C-N 3.35Å; I467-A469 PolarHBondContact O-N 2.94Å; I467-G470 PolarHBondContact O-N 2.94Å; I467-L471 HydrophobicContact CG2-CD1 3.89Å; I467-L471 HydrophobicContact CG2-CG 4.36Å; I467-L471 WeakPolarHBondContact O-CB 3.2Å; I467-L471 VanDerWaalsContact O-CG 3.3Å; I467-L471 WeakPolarHBondContact O-CG 3.42Å; I467-L471 PolarHBondContact O-N 2.78Å
468	C	93.5	Very high	90.1	Very high	3 Å²	3	56 Å²	56	2%	0.02	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-43.6	178.3	-72.6	0	0	0	0	112.5	Y464 T465 T472 M506	Y464-C468 WeakPolarHBondContact CE2-SG 3.18Å; Y464-C468 PolarHBondContact O-N 2.62Å; Y464-C468 PolarHBondContact O-SG 2.86Å; Y464-C468 VanDerWaalsContact O-SG 3.4Å; T465-C468 PolarHBondContact O-N 3.09Å; C468-T472 PolarHBondContact O-N 2.66Å; C468-T472 PolarHBondContact O-OG1 3.45Å; C468-M506 HydrophobicContact CB-CG 4.33Å; C468-M506 HydrophobicContact CB-SD 3.96Å; C468-M506 WeakPolarHBondContact O-CE 3.45Å
469	A	92.3	Very high	90	Very high	37 Å²	37	57 Å²	57	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-45.9	177.2	0	0	0	0	0	111.7	T465 I466 I467 L471 T472 V473	T465-A469 WeakPolarHBondContact O-CB 3.27Å; T465-A469 PolarHBondContact O-N 3.5Å; I466-A469 PolarHBondContact O-N 2.74Å; I467-A469 PolarHBondContact O-N 2.94Å; A469-L471 PolarHBondContact O-N 3.31Å; A469-T472 WeakPolarHBondContact O-CB 3.27Å; A469-T472 PolarHBondContact O-N 3.35Å; A469-V473 WeakPolarHBondContact O-CG2 3.26Å; A469-V473 PolarHBondContact O-N 3.22Å
470	G	92.5	Very high	89.9	Confident	42 Å²	42	61.1 Å²	61.1	43%	0.433	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-43.4	177.9	0	0	0	0	0	112.6	I466 I467 V473 A474	I466-G470 PolarHBondContact O-N 2.8Å; I467-G470 PolarHBondContact O-N 2.94Å; G470-V473 PolarHBondContact O-N 3.38Å; G470-A474 WeakPolarHBondContact O-CB 3.33Å; G470-A474 PolarHBondContact O-N 2.81Å
471	L	92.2	Very high	89.7	Confident	74 Å²	74	64.2 Å²	64.2	39%	0.387	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-42.5	174.3	-71.5	175.8	0	0	0	111.7	I467 A469 V473 A474 F475 M506	I467-L471 HydrophobicContact CG2-CD1 3.89Å; I467-L471 HydrophobicContact CG2-CG 4.36Å; I467-L471 WeakPolarHBondContact O-CB 3.2Å; I467-L471 VanDerWaalsContact O-CG 3.3Å; I467-L471 WeakPolarHBondContact O-CG 3.42Å; I467-L471 PolarHBondContact O-N 2.78Å; A469-L471 PolarHBondContact O-N 3.31Å; L471-V473 VanDerWaalsContact C-N 3.34Å; L471-V473 PolarHBondContact O-N 3.37Å; L471-A474 PolarHBondContact O-N 2.81Å; L471-F475 HydrophobicContact CB-CD2 4.22Å; L471-F475 HydrophobicContact CB-CE2 4.11Å; L471-F475 HydrophobicContact CD2-CE2 4.09Å; L471-F475 WeakPolarHBondContact O-CD2 3.44Å; L471-F475 PolarHBondContact O-N 2.79Å; L471-M506 HydrophobicContact CB-SD 4.31Å
472	T	93.1	Very high	89	Confident	29 Å²	29	65.4 Å²	65.4	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-57.1	-48.4	177.5	-54.3	0	0	0	0	111.2	C468 A469 F476 V503 M506	C468-T472 PolarHBondContact O-N 2.66Å; C468-T472 PolarHBondContact O-OG1 3.45Å; A469-T472 WeakPolarHBondContact O-CB 3.27Å; A469-T472 PolarHBondContact O-N 3.35Å; T472-F476 VanDerWaalsContact O-CB 3.31Å; T472-F476 WeakPolarHBondContact O-CB 3.43Å; T472-F476 PolarHBondContact O-N 3.43Å; T472-V503 HydrophobicContact CG2-CG1 4.16Å; T472-V503 HydrophobicContact CG2-CG2 4.34Å; T472-M506 WeakPolarHBondContact OG1-CE 3.5Å
473	V	92.9	Very high	87.8	Confident	88 Å²	88	73.1 Å²	73.1	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-67.7	-43.6	-179.7	175.5	0	0	0	0	111.2	A469 G470 L471 F476 I477	A469-V473 WeakPolarHBondContact O-CG2 3.26Å; A469-V473 PolarHBondContact O-N 3.22Å; G470-V473 PolarHBondContact O-N 3.38Å; L471-V473 VanDerWaalsContact C-N 3.34Å; L471-V473 PolarHBondContact O-N 3.37Å; V473-F476 PolarHBondContact O-N 2.93Å; V473-I477 HydrophobicContact CG1-CD1 3.88Å; V473-I477 HydrophobicContact CG1-CG1 4.46Å; V473-I477 WeakPolarHBondContact O-CG1 3.28Å; V473-I477 PolarHBondContact O-N 2.95Å
474	A	90.8	Very high	86.3	Confident	37 Å²	37	75.5 Å²	75.5	31%	0.306	40%	0.404	S	S	.	.	H	α-helix	trans	-58.8	-51.4	177.9	0	0	0	0	0	111.1	G470 L471 F476 I477 F478	G470-A474 WeakPolarHBondContact O-CB 3.33Å; G470-A474 PolarHBondContact O-N 2.81Å; L471-A474 PolarHBondContact O-N 2.81Å; A474-F476 VanDerWaalsContact C-N 3.32Å; A474-F476 PolarHBondContact O-N 3.28Å; A474-I477 PolarHBondContact O-N 2.83Å; A474-F478 WeakPolarHBondContact O-CD2 3.06Å; A474-F478 PolarHBondContact O-N 2.81Å
475	F	87.5	Confident	84.8	Confident	73 Å²	73	77 Å²	77	32%	0.32	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-33	179	-70.2	-62.5	0	0	0	113.1	F29 L471 F478 S479 F499	F29-F475 HydrophobicContact CE1-CD2 4.4Å; F29-F475 HydrophobicContact CE1-CE2 4.19Å; F29-F475 HydrophobicContact CE1-CZ 4.28Å; F29-F475 HydrophobicContact CE2-CE2 4.44Å; F29-F475 HydrophobicContact CZ-CD2 4.07Å; F29-F475 AromaticContact CZ-CE2 3.62Å; F29-F475 HydrophobicContact CZ-CE2 3.62Å; F29-F475 AromaticContact CZ-CZ 3.96Å; F29-F475 HydrophobicContact CZ-CZ 3.96Å; L471-F475 HydrophobicContact CB-CD2 4.22Å; L471-F475 HydrophobicContact CB-CE2 4.11Å; L471-F475 HydrophobicContact CD2-CE2 4.09Å; L471-F475 WeakPolarHBondContact O-CD2 3.44Å; L471-F475 PolarHBondContact O-N 2.79Å; F475-F478 PolarHBondContact O-N 2.84Å; F475-S479 WeakPolarHBondContact O-CB 3.47Å; F475-S479 PolarHBondContact O-N 3.43Å; F475-F499 HydrophobicContact CB-CD2 3.47Å; F475-F499 VanDerWaalsContact CB-CD2 3.47Å; F475-F499 HydrophobicContact CB-CE2 3.75Å
476	F	88.5	Confident	83	Confident	99 Å²	99	82.2 Å²	82.2	43%	0.434	43%	0.431	S	S	.	.	H	α-helix	trans	-61.9	-48.1	172.8	177.9	-99.1	0	0	0	111.1	T472 V473 A474 F478 S479 Q480 F499	T472-F476 VanDerWaalsContact O-CB 3.31Å; T472-F476 WeakPolarHBondContact O-CB 3.43Å; T472-F476 PolarHBondContact O-N 3.43Å; V473-F476 PolarHBondContact O-N 2.93Å; A474-F476 VanDerWaalsContact C-N 3.32Å; A474-F476 PolarHBondContact O-N 3.28Å; F476-F478 VanDerWaalsContact C-N 3.34Å; F476-F478 PolarHBondContact O-N 2.84Å; F476-S479 PolarHBondContact O-N 2.87Å; F476-Q480 HydrophobicContact CD1-CG 4.35Å; F476-Q480 HydrophobicContact CE1-CG 3.97Å; F476-Q480 HydrophobicContact CE2-CG 4.19Å; F476-Q480 HydrophobicContact CZ-CG 3.89Å; F476-Q480 WeakPolarHBondContact O-CG 3.34Å; F476-Q480 PolarHBondContact O-N 2.79Å; F476-F499 HydrophobicContact CB-CE2 4.05Å; F476-F499 HydrophobicContact CB-CZ 3.75Å; F476-F499 HydrophobicContact CD2-CE1 4.15Å; F476-F499 AromaticContact CD2-CZ 3.89Å; F476-F499 HydrophobicContact CD2-CZ 3.89Å; F476-F499 HydrophobicContact CG-CZ 4.33Å
477	I	89.6	Confident	81.2	Confident	96 Å²	96	85.3 Å²	85.3	49%	0.492	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-46	177.1	-66.8	166.8	0	0	0	110.4	V473 A474 S479 Q480 V481	V473-I477 HydrophobicContact CG1-CD1 3.88Å; V473-I477 HydrophobicContact CG1-CG1 4.46Å; V473-I477 WeakPolarHBondContact O-CG1 3.28Å; V473-I477 PolarHBondContact O-N 2.95Å; A474-I477 PolarHBondContact O-N 2.83Å; I477-S479 VanDerWaalsContact C-N 3.34Å; I477-S479 PolarHBondContact O-N 2.85Å; I477-Q480 PolarHBondContact O-N 3.25Å; I477-V481 HydrophobicContact CG2-CG2 4.25Å; I477-V481 VanDerWaalsContact O-CG2 3.28Å; I477-V481 WeakPolarHBondContact O-CG2 3.34Å; I477-V481 PolarHBondContact O-N 3.28Å
478	F	85.9	Confident	79.5	Confident	131 Å²	131	88.7 Å²	88.7	58%	0.575	45%	0.448	S	S	*	.	H	α-helix	trans	-57.4	-47.4	175.9	-77.6	-65	0	0	0	111.5	A474 F475 F476 Q480 V481 T482	A474-F478 WeakPolarHBondContact O-CD2 3.06Å; A474-F478 PolarHBondContact O-N 2.81Å; F475-F478 PolarHBondContact O-N 2.84Å; F476-F478 VanDerWaalsContact C-N 3.34Å; F476-F478 PolarHBondContact O-N 2.84Å; F478-Q480 PolarHBondContact O-N 3.07Å; F478-V481 PolarHBondContact O-N 3.01Å; F478-V481 VanDerWaalsContact O-N 3.17Å; F478-T482 PolarHBondContact O-N 2.78Å; F478-T482 PolarHBondContact O-OG1 2.85Å
479	S	82.7	Confident	78.1	Confident	21 Å²	21	91.6 Å²	91.6	15%	0.147	48%	0.478	C	S	.	.	H	α-helix	trans	-62.9	-26.6	180	-174.4	0	0	0	0	114	F475 F476 I477	F475-S479 WeakPolarHBondContact O-CB 3.47Å; F475-S479 PolarHBondContact O-N 3.43Å; F476-S479 PolarHBondContact O-N 2.87Å; I477-S479 VanDerWaalsContact C-N 3.34Å; I477-S479 PolarHBondContact O-N 2.85Å
480	Q	84	Confident	76.6	Confident	118 Å²	118	99.7 Å²	99.7	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-86.4	-26.2	177.4	-64.5	-66.7	-4	0	0	112.6	F476 I477 F478	F476-Q480 HydrophobicContact CD1-CG 4.35Å; F476-Q480 HydrophobicContact CE1-CG 3.97Å; F476-Q480 HydrophobicContact CE2-CG 4.19Å; F476-Q480 HydrophobicContact CZ-CG 3.89Å; F476-Q480 WeakPolarHBondContact O-CG 3.34Å; F476-Q480 PolarHBondContact O-N 2.79Å; I477-Q480 PolarHBondContact O-N 3.25Å; F478-Q480 PolarHBondContact O-N 3.07Å
481	V	83.5	Confident	75.3	Confident	112 Å²	112	105.1 Å²	105.1	68%	0.679	52%	0.522	S	S	*	.	H	α-helix	trans	-87.1	-29.9	-179.1	173.8	0	0	0	0	111.5	I477 F478	I477-V481 HydrophobicContact CG2-CG2 4.25Å; I477-V481 VanDerWaalsContact O-CG2 3.28Å; I477-V481 WeakPolarHBondContact O-CG2 3.34Å; I477-V481 PolarHBondContact O-N 3.28Å; F478-V481 PolarHBondContact O-N 3.01Å; F478-V481 VanDerWaalsContact O-N 3.17Å
482	T	74.7	Confident	74.5	Confident	35 Å²	35	104 Å²	104	22%	0.215	52%	0.52	C	S	.	.			trans	-98.6	100.6	179.2	61	0	0	0	0	110.4	F478 D484	F478-T482 PolarHBondContact O-N 2.78Å; F478-T482 PolarHBondContact O-OG1 2.85Å; T482-D484 VanDerWaalsContact C-N 3.31Å
483	E	62.3	Low	73.8	Confident	184 Å²	184	104 Å²	104	86%	0.86	52%	0.52	S	S	*	.			trans	-80.1	-14.7	171.6	-70.1	179.3	171.7	0	0	112.5
484	D	57.8	Low	73.4	Confident	127 Å²	127	100.7 Å²	100.7	68%	0.679	50%	0.499	S	S	*	.	S	Bend	trans	-96.5	141	-171.7	-67.4	-38.8	0	0	0	114.6	T482 W486	T482-D484 VanDerWaalsContact C-N 3.31Å; D484-W486 PolarHBondContact O-N 3.1Å
485	Q	58.6	Low	73.1	Confident	100 Å²	100	102.8 Å²	102.8	47%	0.467	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-71	117.7	163.2	-62.4	177.2	-16.2	0	0	109.3	K487 E494	Q485-K487 PolarHBondContact O-N 3.22Å; Q485-E494 WeakPolarHBondContact CG-OE1 3.45Å; Q485-E494 WeakPolarHBondContact CG-OE2 3.12Å; Q485-E494 PolarHBondContact NE2-OE1 3.48Å; Q485-E494 PolarHBondContact NE2-OE2 2.96Å; Q485-E494 PolarHBondContact OE1-OE1 2.74Å
486	W	55.1	Low	73.1	Confident	125 Å²	125	101.8 Å²	101.8	47%	0.473	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	122.9	175.5	-63.4	34.5	0	0	0	109	D484 W488 V493 Y495	D484-W486 PolarHBondContact O-N 3.1Å; W486-W488 HydrophobicContact CD2-CZ2 4.48Å; W486-W488 AromaticContact CE3-CE2 3.67Å; W486-W488 HydrophobicContact CE3-CH2 4.2Å; W486-W488 AromaticContact CE3-CZ2 3.32Å; W486-W488 HydrophobicContact CE3-CZ2 3.32Å; W486-W488 AromaticContact CE3-NE1 3.74Å; W486-W488 HydrophobicContact CZ3-CH2 4.17Å; W486-W488 AromaticContact CZ3-CZ2 3.58Å; W486-W488 HydrophobicContact CZ3-CZ2 3.58Å; W486-W488 PolarHBondContact O-N 3.36Å; W486-V493 PolarHBondContact O-N 3.13Å; W486-Y495 HydrophobicContact CB-CE2 3.64Å; W486-Y495 AromaticContact CD1-CE2 3.5Å; W486-Y495 VanDerWaalsContact CD1-CE2 3.5Å; W486-Y495 HydrophobicContact CD2-CE2 4.25Å; W486-Y495 HydrophobicContact CG-CD2 4.49Å; W486-Y495 AromaticContact CG-CE2 3.5Å; W486-Y495 HydrophobicContact CG-CE2 3.5Å
487	K	53.9	Low	73.2	Confident	168 Å²	168	97 Å²	97	73%	0.73	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	90.1	171.2	-65.2	-174.4	179.7	-179.5	0	109.1	Q485 G489	Q485-K487 PolarHBondContact O-N 3.22Å; K487-G489 VanDerWaalsContact C-N 3.34Å; K487-G489 PolarHBondContact O-N 2.92Å; K487-G489 VanDerWaalsContact O-N 3.16Å
488	W	58.1	Low	73.3	Confident	163 Å²	163	93.1 Å²	93.1	62%	0.617	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	83.3	169	-68.1	99.2	0	0	0	108.8	W486 K491 Y495	W486-W488 HydrophobicContact CD2-CZ2 4.48Å; W486-W488 AromaticContact CE3-CE2 3.67Å; W486-W488 HydrophobicContact CE3-CH2 4.2Å; W486-W488 AromaticContact CE3-CZ2 3.32Å; W486-W488 HydrophobicContact CE3-CZ2 3.32Å; W486-W488 AromaticContact CE3-NE1 3.74Å; W486-W488 HydrophobicContact CZ3-CH2 4.17Å; W486-W488 AromaticContact CZ3-CZ2 3.58Å; W486-W488 HydrophobicContact CZ3-CZ2 3.58Å; W486-W488 PolarHBondContact O-N 3.36Å; W488-K491 PolarHBondContact N-O 3.48Å; W488-Y495 PolarHBondContact NE1-OH 2.86Å
489	G	63.9	Low	73.6	Confident	64 Å²	64	88.5 Å²	88.5	66%	0.66	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-140.2	-173.2	0	0	0	0	0	112	K487 K491	K487-G489 VanDerWaalsContact C-N 3.34Å; K487-G489 PolarHBondContact O-N 2.92Å; K487-G489 VanDerWaalsContact O-N 3.16Å; G489-K491 VanDerWaalsContact C-N 3.29Å; G489-K491 PolarHBondContact O-N 3.35Å
490	E	62	Low	74	Confident	208 Å²	208	90 Å²	90	97%	0.972	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-15.5	-177.3	-67.2	178.9	173	0	0	113.8
491	K	65	Low	74.5	Confident	156 Å²	156	84.3 Å²	84.3	68%	0.678	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.9	-179	-64.8	-171.8	178.1	-175.2	0	110.5	W488 G489	W488-K491 PolarHBondContact N-O 3.48Å; G489-K491 VanDerWaalsContact C-N 3.29Å; G489-K491 PolarHBondContact O-N 3.35Å
492	S	74.4	Confident	75	Confident	51 Å²	51	79 Å²	79	36%	0.357	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.8	164.3	55.4	0	0	0	0	108.6
493	V	79.7	Confident	75.9	Confident	29 Å²	29	78.4 Å²	78.4	18%	0.176	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.9	172.8	179.1	0	0	0	0	107.8	L34 W486 Y495	L34-V493 HydrophobicContact CD2-CG2 4.16Å; W486-V493 PolarHBondContact O-N 3.13Å; V493-Y495 PolarHBondContact O-N 2.89Å
494	E	83.7	Confident	77.5	Confident	18 Å²	18	70.5 Å²	70.5	8%	0.084	35%	0.345	C	S	.	.			trans	-86.7	101.3	-179.7	-61.7	-56	135.2	0	0	110.3	G33 Q485 S497 A498	G33-E494 PolarHBondContact O-N 2.72Å; Q485-E494 WeakPolarHBondContact CG-OE1 3.45Å; Q485-E494 WeakPolarHBondContact CG-OE2 3.12Å; Q485-E494 PolarHBondContact NE2-OE1 3.48Å; Q485-E494 PolarHBondContact NE2-OE2 2.96Å; Q485-E494 PolarHBondContact OE1-OE1 2.74Å; E494-S497 WeakPolarHBondContact CB-OG 3.36Å; E494-S497 PolarHBondContact O-OG 3.08Å; E494-S497 VanDerWaalsContact O-OG 3.08Å; E494-A498 VanDerWaalsContact O-CB 3.31Å; E494-A498 WeakPolarHBondContact O-CB 3.24Å; E494-A498 PolarHBondContact O-N 2.99Å; E494-A498 VanDerWaalsContact O-N 3.1Å
495	Y	84.8	Confident	79.3	Confident	80 Å²	80	64.4 Å²	64.4	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-69.2	-37.5	-178	-70.8	-78.5	0	0	0	113.2	W486 W488 V493 S497 A498 F499	W486-Y495 HydrophobicContact CB-CE2 3.64Å; W486-Y495 AromaticContact CD1-CE2 3.5Å; W486-Y495 VanDerWaalsContact CD1-CE2 3.5Å; W486-Y495 HydrophobicContact CD2-CE2 4.25Å; W486-Y495 HydrophobicContact CG-CD2 4.49Å; W486-Y495 AromaticContact CG-CE2 3.5Å; W486-Y495 HydrophobicContact CG-CE2 3.5Å; W488-Y495 PolarHBondContact NE1-OH 2.86Å; V493-Y495 PolarHBondContact O-N 2.89Å; Y495-S497 PolarHBondContact O-N 3.03Å; Y495-A498 WeakPolarHBondContact O-CB 3.37Å; Y495-A498 PolarHBondContact O-N 3.41Å; Y495-F499 WeakPolarHBondContact O-CB 3.32Å; Y495-F499 PolarHBondContact O-N 3.43Å
496	T	87.5	Confident	81	Confident	52 Å²	52	60.1 Å²	60.1	32%	0.319	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-42	-177.3	-46.1	0	0	0	0	111.3	P39 F499 I500	P39-T496 HydrophobicContact CG-CG2 3.64Å; T496-F499 PolarHBondContact O-N 2.9Å; T496-I500 HydrophobicContact CG2-CD1 4.43Å; T496-I500 VanDerWaalsContact O-CG1 3.31Å; T496-I500 WeakPolarHBondContact O-CG1 3.44Å; T496-I500 PolarHBondContact O-N 3.17Å; T496-I500 VanDerWaalsContact O-N 3.11Å
497	S	90.8	Very high	82.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.7	-41	174.8	60.6	0	0	0	0	111.4	G32 A36 P37 E494 Y495 F499 I500 T501	G32-S497 PolarHBondContact O-OG 3.13Å; A36-S497 PolarHBondContact O-OG 2.92Å; P37-S497 WeakPolarHBondContact O-CB 3.27Å; E494-S497 WeakPolarHBondContact CB-OG 3.36Å; E494-S497 PolarHBondContact O-OG 3.08Å; E494-S497 VanDerWaalsContact O-OG 3.08Å; Y495-S497 PolarHBondContact O-N 3.03Å; S497-F499 VanDerWaalsContact C-N 3.27Å; S497-F499 PolarHBondContact O-N 2.99Å; S497-I500 PolarHBondContact O-N 2.76Å; S497-T501 WeakPolarHBondContact O-CG2 3.46Å; S497-T501 PolarHBondContact O-N 2.95Å; S497-T501 PolarHBondContact O-OG1 2.92Å
498	A	91.2	Very high	84.9	Confident	13 Å²	13	47.9 Å²	47.9	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-56.4	-40.7	172.8	0	0	0	0	0	112.6	F29 E494 Y495 T501 G502	F29-A498 VanDerWaalsContact CD1-O 3.28Å; F29-A498 WeakPolarHBondContact CD1-O 3.19Å; E494-A498 VanDerWaalsContact O-CB 3.31Å; E494-A498 WeakPolarHBondContact O-CB 3.24Å; E494-A498 PolarHBondContact O-N 2.99Å; E494-A498 VanDerWaalsContact O-N 3.1Å; Y495-A498 WeakPolarHBondContact O-CB 3.37Å; Y495-A498 PolarHBondContact O-N 3.41Å; A498-T501 PolarHBondContact O-OG1 3.3Å; A498-G502 WeakPolarHBondContact O-CA 3.45Å; A498-G502 PolarHBondContact O-N 2.66Å
499	F	91.5	Very high	86.7	Confident	35 Å²	35	40.6 Å²	40.6	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-52.3	175.6	168.2	-114.7	0	0	0	111.1	F475 F476 Y495 T496 S497 G502 V503	F475-F499 HydrophobicContact CB-CD2 3.47Å; F475-F499 VanDerWaalsContact CB-CD2 3.47Å; F475-F499 HydrophobicContact CB-CE2 3.75Å; F476-F499 HydrophobicContact CB-CE2 4.05Å; F476-F499 HydrophobicContact CB-CZ 3.75Å; F476-F499 HydrophobicContact CD2-CE1 4.15Å; F476-F499 AromaticContact CD2-CZ 3.89Å; F476-F499 HydrophobicContact CD2-CZ 3.89Å; F476-F499 HydrophobicContact CG-CZ 4.33Å; Y495-F499 WeakPolarHBondContact O-CB 3.32Å; Y495-F499 PolarHBondContact O-N 3.43Å; T496-F499 PolarHBondContact O-N 2.9Å; S497-F499 VanDerWaalsContact C-N 3.27Å; S497-F499 PolarHBondContact O-N 2.99Å; F499-G502 PolarHBondContact O-N 3.2Å; F499-V503 HydrophobicContact CD2-CG2 3.61Å; F499-V503 HydrophobicContact CE2-CG2 3.35Å; F499-V503 HydrophobicContact CZ-CG2 4.05Å; F499-V503 WeakPolarHBondContact O-CB 3.41Å; F499-V503 WeakPolarHBondContact O-CG2 3.42Å; F499-V503 PolarHBondContact O-N 3.28Å
500	I	91.9	Very high	88.2	Confident	51 Å²	51	37.6 Å²	37.6	26%	0.262	19%	0.185	S	C	.	.	H	α-helix	trans	-62.1	-48.7	-177.2	-64.8	164.4	0	0	0	111	P39 F245 W249 T496 S497 Y504	P39-I500 HydrophobicContact CB-CD1 3.81Å; P39-I500 HydrophobicContact CG-CD1 3.86Å; F245-I500 HydrophobicContact CE2-CD1 4.49Å; F245-I500 HydrophobicContact CZ-CB 4.2Å; F245-I500 HydrophobicContact CZ-CD1 4.09Å; F245-I500 HydrophobicContact CZ-CG2 3.81Å; W249-I500 HydrophobicContact CE3-CG2 4.28Å; W249-I500 HydrophobicContact CH2-CG2 3.89Å; W249-I500 HydrophobicContact CZ3-CG2 3.63Å; T496-I500 HydrophobicContact CG2-CD1 4.43Å; T496-I500 VanDerWaalsContact O-CG1 3.31Å; T496-I500 WeakPolarHBondContact O-CG1 3.44Å; T496-I500 PolarHBondContact O-N 3.17Å; T496-I500 VanDerWaalsContact O-N 3.11Å; S497-I500 PolarHBondContact O-N 2.76Å; I500-Y504 VanDerWaalsContact O-CB 3.27Å; I500-Y504 WeakPolarHBondContact O-CB 3.36Å; I500-Y504 PolarHBondContact O-N 3.14Å
501	T	94.4	Very high	89.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-36.8	179.3	64.3	0	0	0	0	112	F28 G32 L252 S497 A498 G505	F28-T501 WeakPolarHBondContact O-CB 3.34Å; F28-T501 PolarHBondContact O-OG1 3.49Å; G32-T501 WeakPolarHBondContact CA-OG1 3.35Å; G32-T501 PolarHBondContact N-OG1 2.69Å; L252-T501 HydrophobicContact CD1-CG2 3.55Å; S497-T501 WeakPolarHBondContact O-CG2 3.46Å; S497-T501 PolarHBondContact O-N 2.95Å; S497-T501 PolarHBondContact O-OG1 2.92Å; A498-T501 PolarHBondContact O-OG1 3.3Å; T501-G505 PolarHBondContact O-N 3.33Å
502	G	94	Very high	91.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.3	-49.1	178.3	0	0	0	0	0	112.2	Q25 A498 F499 Y504 G505 M506	Q25-G502 PolarHBondContact NE2-O 2.76Å; A498-G502 WeakPolarHBondContact O-CA 3.45Å; A498-G502 PolarHBondContact O-N 2.66Å; F499-G502 PolarHBondContact O-N 3.2Å; G502-Y504 VanDerWaalsContact C-N 3.35Å; G502-Y504 PolarHBondContact O-N 2.78Å; G502-G505 PolarHBondContact O-N 2.82Å; G502-M506 WeakPolarHBondContact O-CB 3.49Å; G502-M506 PolarHBondContact O-N 2.85Å
503	V	94	Very high	92.3	Very high	22 Å²	22	19 Å²	19	13%	0.133	10%	0.097	C	C	.	.	H	α-helix	trans	-63.8	-42.1	176.6	172.5	0	0	0	0	110.9	T472 F499 G505 M506 W507	T472-V503 HydrophobicContact CG2-CG1 4.16Å; T472-V503 HydrophobicContact CG2-CG2 4.34Å; F499-V503 HydrophobicContact CD2-CG2 3.61Å; F499-V503 HydrophobicContact CE2-CG2 3.35Å; F499-V503 HydrophobicContact CZ-CG2 4.05Å; F499-V503 WeakPolarHBondContact O-CB 3.41Å; F499-V503 WeakPolarHBondContact O-CG2 3.42Å; F499-V503 PolarHBondContact O-N 3.28Å; V503-G505 PolarHBondContact O-N 2.85Å; V503-M506 HydrophobicContact CG2-CE 4.49Å; V503-M506 PolarHBondContact O-N 2.79Å; V503-W507 PolarHBondContact O-N 2.96Å; V503-W507 VanDerWaalsContact O-N 3.11Å
504	Y	94.9	Very high	92.9	Very high	18 Å²	18	17.7 Å²	17.7	7%	0.071	9%	0.089	C	C	.	.	H	α-helix	trans	-56.8	-48.5	172.9	171.1	-96.4	0	0	0	112	F28 W249 L252 K253 S256 N296 I500 G502 M506 N508	F28-Y504 HydrophobicContact CD1-CD1 4.48Å; F28-Y504 HydrophobicContact CE1-CD1 4.19Å; F28-Y504 HydrophobicContact CE1-CE1 4.14Å; W249-Y504 AromaticContact CH2-CD2 3.73Å; W249-Y504 HydrophobicContact CH2-CD2 3.73Å; W249-Y504 AromaticContact CH2-CG 3.8Å; W249-Y504 HydrophobicContact CH2-CG 3.8Å; W249-Y504 HydrophobicContact CZ2-CD2 4.37Å; W249-Y504 HydrophobicContact CZ3-CD1 4.38Å; W249-Y504 HydrophobicContact CZ3-CD2 4.24Å; W249-Y504 AromaticContact CZ3-CG 3.88Å; W249-Y504 HydrophobicContact CZ3-CG 3.88Å; L252-Y504 HydrophobicContact CB-CE1 4.15Å; K253-Y504 WeakPolarHBondContact CA-OH 3.5Å; K253-Y504 HydrophobicContact CG-CE2 4.4Å; S256-Y504 WeakPolarHBondContact CB-OH 3.49Å; S256-Y504 PolarHBondContact OG-OH 3.24Å; N296-Y504 VanDerWaalsContact OD1-CE2 3.32Å; N296-Y504 WeakPolarHBondContact OD1-CE2 3.36Å; N296-Y504 PolarHBondContact OD1-OH 2.69Å; I500-Y504 VanDerWaalsContact O-CB 3.27Å; I500-Y504 WeakPolarHBondContact O-CB 3.36Å; I500-Y504 PolarHBondContact O-N 3.14Å; G502-Y504 VanDerWaalsContact C-N 3.35Å; G502-Y504 PolarHBondContact O-N 2.78Å; Y504-M506 VanDerWaalsContact C-N 3.31Å; Y504-M506 PolarHBondContact O-N 2.82Å; Y504-N508 VanDerWaalsContact CE2-ND2 3.29Å; Y504-N508 WeakPolarHBondContact CE2-ND2 3.27Å; Y504-N508 VanDerWaalsContact CZ-ND2 3.26Å; Y504-N508 WeakPolarHBondContact O-CB 3.26Å; Y504-N508 PolarHBondContact O-N 3.38Å; Y504-N508 VanDerWaalsContact O-N 3.15Å; Y504-N508 PolarHBondContact O-ND2 3.09Å
505	G	95	Very high	93.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.1	-41.4	175.4	0	0	0	0	0	112.7	Q25 F28 T501 G502 V503 N508 V509	Q25-G505 PolarHBondContact OE1-O 2.93Å; F28-G505 VanDerWaalsContact CD2-CA 3.45Å; F28-G505 VanDerWaalsContact CG-CA 3.49Å; T501-G505 PolarHBondContact O-N 3.33Å; G502-G505 PolarHBondContact O-N 2.82Å; V503-G505 PolarHBondContact O-N 2.85Å; G505-N508 WeakPolarHBondContact O-CB 3.44Å; G505-N508 PolarHBondContact O-N 2.82Å; G505-V509 WeakPolarHBondContact O-CB 3.47Å; G505-V509 VanDerWaalsContact O-CG2 3.27Å; G505-V509 WeakPolarHBondContact O-CG2 3.46Å; G505-V509 PolarHBondContact O-N 2.85Å
506	M	95	Very high	93.8	Very high	9 Å²	9	14.7 Å²	14.7	4%	0.044	8%	0.081	C	C	.	.	H	α-helix	trans	-64.6	-46.2	-176.5	-176.2	169.6	55.4	0	0	111.9	C468 L471 T472 G502 V503 Y504 N508 V509 Y510	C468-M506 HydrophobicContact CB-CG 4.33Å; C468-M506 HydrophobicContact CB-SD 3.96Å; C468-M506 WeakPolarHBondContact O-CE 3.45Å; L471-M506 HydrophobicContact CB-SD 4.31Å; T472-M506 WeakPolarHBondContact OG1-CE 3.5Å; G502-M506 WeakPolarHBondContact O-CB 3.49Å; G502-M506 PolarHBondContact O-N 2.85Å; V503-M506 HydrophobicContact CG2-CE 4.49Å; V503-M506 PolarHBondContact O-N 2.79Å; Y504-M506 VanDerWaalsContact C-N 3.31Å; Y504-M506 PolarHBondContact O-N 2.82Å; M506-N508 VanDerWaalsContact C-N 3.33Å; M506-V509 PolarHBondContact O-N 2.91Å; M506-Y510 WeakPolarHBondContact O-CB 3.35Å; M506-Y510 PolarHBondContact O-N 2.82Å
507	W	95.7	Very high	93.9	Very high	30 Å²	30	13.3 Å²	13.3	11%	0.114	7%	0.072	C	C	.	.	H	α-helix	trans	-70.5	-31.7	178.3	-70.8	111.8	0	0	0	112.3	F322 L326 W330 V503 Y510 V511	F322-W507 HydrophobicContact CE1-CB 4.33Å; F322-W507 HydrophobicContact CZ-CB 4.17Å; L326-W507 HydrophobicContact CD1-CE3 4.39Å; L326-W507 HydrophobicContact CD1-CZ3 4.1Å; L326-W507 HydrophobicContact CD2-CD2 4.34Å; L326-W507 HydrophobicContact CD2-CE3 3.8Å; L326-W507 HydrophobicContact CD2-CH2 3.95Å; L326-W507 HydrophobicContact CD2-CZ2 4.44Å; L326-W507 HydrophobicContact CD2-CZ3 3.6Å; L326-W507 HydrophobicContact CG-CZ3 4.41Å; W330-W507 AromaticContact CH2-CH2 3.86Å; W330-W507 HydrophobicContact CH2-CH2 3.86Å; W330-W507 HydrophobicContact CH2-CZ3 4.46Å; W330-W507 AromaticContact CZ2-CH2 3.56Å; W330-W507 HydrophobicContact CZ2-CH2 3.56Å; W330-W507 AromaticContact CZ2-CZ3 3.79Å; W330-W507 HydrophobicContact CZ2-CZ3 3.79Å; V503-W507 PolarHBondContact O-N 2.96Å; V503-W507 VanDerWaalsContact O-N 3.11Å; W507-Y510 HydrophobicContact CE3-CD1 4.04Å; W507-Y510 HydrophobicContact CE3-CG 4.18Å; W507-Y510 HydrophobicContact CZ3-CD1 4.11Å; W507-Y510 HydrophobicContact CZ3-CE1 4.28Å; W507-Y510 HydrophobicContact CZ3-CG 4.26Å; W507-V511 WeakPolarHBondContact O-CG2 2.91Å; W507-V511 PolarHBondContact O-N 2.83Å; W507-V511 VanDerWaalsContact O-N 3.07Å
508	N	96.5	Very high	93.9	Very high	7 Å²	7	13.7 Å²	13.7	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-63	-52.7	170.9	-90.6	-77.9	0	0	0	112.2	V260 N296 Y504 G505 M506 Y510 V511 V512	V260-N508 WeakPolarHBondContact CG2-OD1 3.48Å; N296-N508 PolarHBondContact ND2-OD1 3.16Å; Y504-N508 VanDerWaalsContact CE2-ND2 3.29Å; Y504-N508 WeakPolarHBondContact CE2-ND2 3.27Å; Y504-N508 VanDerWaalsContact CZ-ND2 3.26Å; Y504-N508 WeakPolarHBondContact O-CB 3.26Å; Y504-N508 PolarHBondContact O-N 3.38Å; Y504-N508 VanDerWaalsContact O-N 3.15Å; Y504-N508 PolarHBondContact O-ND2 3.09Å; G505-N508 WeakPolarHBondContact O-CB 3.44Å; G505-N508 PolarHBondContact O-N 2.82Å; M506-N508 VanDerWaalsContact C-N 3.33Å; N508-Y510 VanDerWaalsContact C-N 3.28Å; N508-Y510 PolarHBondContact O-N 2.92Å; N508-V511 PolarHBondContact O-N 3.48Å; N508-V512 WeakPolarHBondContact O-CB 3.34Å; N508-V512 VanDerWaalsContact O-CG2 3.29Å; N508-V512 WeakPolarHBondContact O-CG2 3.49Å; N508-V512 PolarHBondContact O-N 2.91Å
509	V	95.6	Very high	93.8	Very high	10 Å²	10	13.1 Å²	13.1	6%	0.061	7%	0.068	C	C	.	.	H	α-helix	trans	-59.3	-41.3	176.5	168.7	0	0	0	0	110.6	M21 V24 F28 G505 M506 V512 A513	M21-V509 HydrophobicContact CB-CG1 3.67Å; M21-V509 HydrophobicContact CG-CG1 4.07Å; M21-V509 HydrophobicContact SD-CG1 3.79Å; V24-V509 HydrophobicContact CB-CG2 4.4Å; V24-V509 HydrophobicContact CG1-CG2 3.76Å; F28-V509 HydrophobicContact CE2-CG2 4.39Å; G505-V509 WeakPolarHBondContact O-CB 3.47Å; G505-V509 VanDerWaalsContact O-CG2 3.27Å; G505-V509 WeakPolarHBondContact O-CG2 3.46Å; G505-V509 PolarHBondContact O-N 2.85Å; M506-V509 PolarHBondContact O-N 2.91Å; V509-V512 PolarHBondContact O-N 2.91Å; V509-A513 VanDerWaalsContact O-CB 3.24Å; V509-A513 WeakPolarHBondContact O-CB 3.01Å; V509-A513 PolarHBondContact O-N 3.34Å
510	Y	95.8	Very high	93.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.4	-53.2	177.8	177.6	-90.3	0	0	0	112	L326 F329 W330 L461 Y464 T465 M506 W507 N508 A513 V514	L326-Y510 HydrophobicContact CD1-CE1 4.09Å; F329-Y510 HydrophobicContact CE1-CE1 4.31Å; W330-Y510 PolarHBondContact NE1-OH 2.88Å; L461-Y510 HydrophobicContact CD1-CE2 4.41Å; Y464-Y510 AromaticContact CD1-CD2 3.64Å; Y464-Y510 HydrophobicContact CD1-CD2 3.64Å; Y464-Y510 AromaticContact CD1-CE2 3.81Å; Y464-Y510 HydrophobicContact CD1-CE2 3.81Å; Y464-Y510 AromaticContact CE1-CD2 3.32Å; Y464-Y510 HydrophobicContact CE1-CD2 3.32Å; Y464-Y510 AromaticContact CE1-CE2 3.98Å; Y464-Y510 HydrophobicContact CE1-CE2 3.98Å; Y464-Y510 HydrophobicContact CE1-CG 4.09Å; Y464-Y510 HydrophobicContact CG-CD2 4.46Å; Y464-Y510 AromaticContact CZ-CD2 3.9Å; Y464-Y510 WeakPolarHBondContact OH-CA 3.26Å; T465-Y510 WeakPolarHBondContact OG1-CE2 3.23Å; T465-Y510 PolarHBondContact OG1-OH 3.12Å; M506-Y510 WeakPolarHBondContact O-CB 3.35Å; M506-Y510 PolarHBondContact O-N 2.82Å; W507-Y510 HydrophobicContact CE3-CD1 4.04Å; W507-Y510 HydrophobicContact CE3-CG 4.18Å; W507-Y510 HydrophobicContact CZ3-CD1 4.11Å; W507-Y510 HydrophobicContact CZ3-CE1 4.28Å; W507-Y510 HydrophobicContact CZ3-CG 4.26Å; N508-Y510 VanDerWaalsContact C-N 3.28Å; N508-Y510 PolarHBondContact O-N 2.92Å; Y510-A513 PolarHBondContact O-N 2.82Å; Y510-V514 HydrophobicContact CD1-CG2 4.36Å; Y510-V514 HydrophobicContact CE1-CG2 4.05Å; Y510-V514 WeakPolarHBondContact O-CG2 3.31Å; Y510-V514 PolarHBondContact O-N 3.03Å
511	V	95.9	Very high	92.8	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.006	6%	0.059	C	C	.	.	H	α-helix	trans	-69	-38.7	-178.2	175.5	0	0	0	0	111.4	L288 L292 F322 W507 N508 A513 V514 L515	L288-V511 HydrophobicContact CD2-CG2 4.12Å; L288-V511 HydrophobicContact CG-CG1 4.27Å; L288-V511 HydrophobicContact CG-CG2 4.13Å; L292-V511 HydrophobicContact CB-CG1 4.39Å; L292-V511 HydrophobicContact CD2-CB 3.43Å; L292-V511 VanDerWaalsContact CD2-CB 3.43Å; L292-V511 HydrophobicContact CD2-CG1 3.63Å; L292-V511 HydrophobicContact CD2-CG2 3.84Å; F322-V511 HydrophobicContact CE2-CG2 4.13Å; F322-V511 HydrophobicContact CZ-CG2 4.4Å; W507-V511 WeakPolarHBondContact O-CG2 2.91Å; W507-V511 PolarHBondContact O-N 2.83Å; W507-V511 VanDerWaalsContact O-N 3.07Å; N508-V511 PolarHBondContact O-N 3.48Å; V511-A513 VanDerWaalsContact C-N 3.32Å; V511-A513 PolarHBondContact O-N 3.36Å; V511-V514 PolarHBondContact O-N 2.97Å; V511-L515 HydrophobicContact CG1-CD1 3.98Å; V511-L515 HydrophobicContact CG1-CG 4.32Å; V511-L515 WeakPolarHBondContact O-CB 3.35Å; V511-L515 WeakPolarHBondContact O-CG 3.05Å; V511-L515 PolarHBondContact O-N 3.43Å
512	V	95.6	Very high	91.5	Very high	18 Å²	18	15.2 Å²	15.2	11%	0.109	8%	0.081	C	C	.	.	H	α-helix	trans	-61.3	-42.8	174	171.3	0	0	0	0	110.8	V260 A263 N508 V509 L515 C516	V260-V512 HydrophobicContact CG2-CG2 3.85Å; A263-V512 HydrophobicContact CB-CG1 4.32Å; N508-V512 WeakPolarHBondContact O-CB 3.34Å; N508-V512 VanDerWaalsContact O-CG2 3.29Å; N508-V512 WeakPolarHBondContact O-CG2 3.49Å; N508-V512 PolarHBondContact O-N 2.91Å; V509-V512 PolarHBondContact O-N 2.91Å; V512-L515 PolarHBondContact O-N 2.98Å; V512-C516 WeakPolarHBondContact O-CB 3.34Å; V512-C516 PolarHBondContact O-N 3.15Å; V512-C516 PolarHBondContact O-SG 3.12Å; V512-C516 VanDerWaalsContact O-SG 3.32Å
513	A	94	Very high	89.8	Confident	5 Å²	5	22 Å²	22	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-61.9	-43.3	174.6	0	0	0	0	0	111.6	F17 Y464 V509 Y510 V511 C516 L517	F17-A513 HydrophobicContact CE1-CB 3.99Å; F17-A513 HydrophobicContact CZ-CB 4.24Å; Y464-A513 HydrophobicContact CE1-CB 4.27Å; V509-A513 VanDerWaalsContact O-CB 3.24Å; V509-A513 WeakPolarHBondContact O-CB 3.01Å; V509-A513 PolarHBondContact O-N 3.34Å; Y510-A513 PolarHBondContact O-N 2.82Å; V511-A513 VanDerWaalsContact C-N 3.32Å; V511-A513 PolarHBondContact O-N 3.36Å; A513-C516 PolarHBondContact O-N 2.92Å; A513-L517 WeakPolarHBondContact O-CB 3.41Å; A513-L517 VanDerWaalsContact O-CG 3.22Å; A513-L517 WeakPolarHBondContact O-CG 3.44Å; A513-L517 PolarHBondContact O-N 3.17Å
514	V	93.6	Very high	88	Confident	2 Å²	2	24.3 Å²	24.3	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-49.6	175	172	0	0	0	0	111	I285 F329 L461 Y510 V511 C516 Y518	I285-V514 HydrophobicContact CD1-CG1 3.98Å; I285-V514 HydrophobicContact CG1-CG1 3.93Å; I285-V514 HydrophobicContact CG2-CG1 4.02Å; F329-V514 HydrophobicContact CE2-CG1 4.44Å; F329-V514 HydrophobicContact CZ-CG1 4.05Å; L461-V514 HydrophobicContact CD1-CG2 3.73Å; Y510-V514 HydrophobicContact CD1-CG2 4.36Å; Y510-V514 HydrophobicContact CE1-CG2 4.05Å; Y510-V514 WeakPolarHBondContact O-CG2 3.31Å; Y510-V514 PolarHBondContact O-N 3.03Å; V511-V514 PolarHBondContact O-N 2.97Å; V514-C516 VanDerWaalsContact C-N 3.35Å; V514-C516 PolarHBondContact O-N 2.99Å; V514-Y518 HydrophobicContact CG1-CD2 4.25Å; V514-Y518 VanDerWaalsContact O-CB 3.25Å; V514-Y518 WeakPolarHBondContact O-CB 3.48Å; V514-Y518 PolarHBondContact O-N 3.46Å
515	L	94.4	Very high	86	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.1	-44.7	178.4	-73.4	166.5	0	0	0	112	A263 L264 F267 I285 V511 V512 S519	A263-L515 HydrophobicContact CB-CB 4.41Å; A263-L515 HydrophobicContact CB-CD1 4.14Å; L264-L515 HydrophobicContact CB-CD1 4.5Å; L264-L515 HydrophobicContact CD1-CD2 4.34Å; F267-L515 HydrophobicContact CB-CB 4.43Å; F267-L515 HydrophobicContact CB-CD2 3.88Å; F267-L515 HydrophobicContact CD1-CD2 3.88Å; F267-L515 HydrophobicContact CD2-CD2 4.44Å; F267-L515 VanDerWaalsContact CD2-O 3.27Å; F267-L515 WeakPolarHBondContact CD2-O 3.27Å; F267-L515 HydrophobicContact CG-CD2 3.81Å; I285-L515 HydrophobicContact CG2-CD2 3.71Å; I285-L515 HydrophobicContact CG2-CG 4.43Å; V511-L515 HydrophobicContact CG1-CD1 3.98Å; V511-L515 HydrophobicContact CG1-CG 4.32Å; V511-L515 WeakPolarHBondContact O-CB 3.35Å; V511-L515 WeakPolarHBondContact O-CG 3.05Å; V511-L515 PolarHBondContact O-N 3.43Å; V512-L515 PolarHBondContact O-N 2.98Å; L515-S519 WeakPolarHBondContact O-CB 3.47Å; L515-S519 PolarHBondContact O-N 3.27Å
516	C	92.5	Very high	83.9	Confident	35 Å²	35	33.1 Å²	33.1	24%	0.236	16%	0.161	C	C	.	.	H	α-helix	trans	-70.6	-50.6	-179.9	-71.9	0	0	0	0	112.3	F17 V512 A513 V514 S519	F17-C516 HydrophobicContact CZ-CB 4.32Å; V512-C516 WeakPolarHBondContact O-CB 3.34Å; V512-C516 PolarHBondContact O-N 3.15Å; V512-C516 PolarHBondContact O-SG 3.12Å; V512-C516 VanDerWaalsContact O-SG 3.32Å; A513-C516 PolarHBondContact O-N 2.92Å; V514-C516 VanDerWaalsContact C-N 3.35Å; V514-C516 PolarHBondContact O-N 2.99Å; C516-S519 WeakPolarHBondContact O-CB 3.48Å; C516-S519 PolarHBondContact O-N 3.18Å; C516-S519 PolarHBondContact O-OG 3.39Å
517	L	90.7	Very high	81.9	Confident	24 Å²	24	37.5 Å²	37.5	13%	0.126	19%	0.188	C	C	.	.	H	α-helix	trans	-72.1	-33.9	-174.3	-67.5	176.5	0	0	0	112.6	V4 L6 L9 L14 F17 A513 S519	V4-L517 WeakPolarHBondContact CG1-O 3.43Å; L6-L517 HydrophobicContact CB-CB 4.3Å; L6-L517 WeakPolarHBondContact CB-O 3.37Å; L6-L517 HydrophobicContact CD1-CD1 4.36Å; L6-L517 HydrophobicContact CD1-CD2 4.17Å; L6-L517 PolarHBondContact N-O 2.74Å; L9-L517 HydrophobicContact CD1-CD2 3.98Å; L14-L517 HydrophobicContact CD1-CD2 3.96Å; F17-L517 HydrophobicContact CD1-CD2 4.23Å; F17-L517 HydrophobicContact CE1-CD1 4.17Å; F17-L517 HydrophobicContact CE1-CD2 4.23Å; F17-L517 HydrophobicContact CE1-CG 4.09Å; A513-L517 WeakPolarHBondContact O-CB 3.41Å; A513-L517 VanDerWaalsContact O-CG 3.22Å; A513-L517 WeakPolarHBondContact O-CG 3.44Å; A513-L517 PolarHBondContact O-N 3.17Å; L517-S519 VanDerWaalsContact C-N 3.34Å
518	Y	90.1	Very high	80	Confident	8 Å²	8	39 Å²	39	3%	0.031	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.6	177.4	-78	-100.7	0	0	0	114.1	V4 L6 L281 I285 F333 R457 L461 V514	V4-Y518 VanDerWaalsContact CG1-CA 3.45Å; L6-Y518 HydrophobicContact CD2-CE2 4.37Å; L281-Y518 HydrophobicContact CD2-CD1 4.1Å; L281-Y518 HydrophobicContact CD2-CE1 4.08Å; I285-Y518 HydrophobicContact CD1-CD1 4.06Å; I285-Y518 HydrophobicContact CD1-CG 3.89Å; F333-Y518 HydrophobicContact CE2-CE1 4.07Å; F333-Y518 AromaticContact CE2-CZ 3.84Å; F333-Y518 VanDerWaalsContact CE2-OH 3.25Å; F333-Y518 WeakPolarHBondContact CE2-OH 3.37Å; R457-Y518 PolarHBondContact O-OH 2.87Å; L461-Y518 HydrophobicContact CB-CE2 4.41Å; L461-Y518 HydrophobicContact CD1-CE2 4.41Å; L461-Y518 HydrophobicContact CD2-CE2 3.86Å; L461-Y518 HydrophobicContact CG-CE2 4.45Å; V514-Y518 HydrophobicContact CG1-CD2 4.25Å; V514-Y518 VanDerWaalsContact O-CB 3.25Å; V514-Y518 WeakPolarHBondContact O-CB 3.48Å; V514-Y518 PolarHBondContact O-N 3.46Å
519	S	89	Confident	78.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-63.8	144.7	174.9	67.8	0	0	0	0	112.2	V5 L515 C516 L517 S521	V5-S519 WeakPolarHBondContact CG2-O 3.47Å; V5-S519 VanDerWaalsContact CG2-OG 3.27Å; V5-S519 WeakPolarHBondContact CG2-OG 3.36Å; V5-S519 PolarHBondContact N-O 3.29Å; L515-S519 WeakPolarHBondContact O-CB 3.47Å; L515-S519 PolarHBondContact O-N 3.27Å; C516-S519 WeakPolarHBondContact O-CB 3.48Å; C516-S519 PolarHBondContact O-N 3.18Å; C516-S519 PolarHBondContact O-OG 3.39Å; L517-S519 VanDerWaalsContact C-N 3.34Å; S519-S521 PolarHBondContact O-N 2.79Å
520	P	83.6	Confident	76.3	Confident	13 Å²	13	42.3 Å²	42.3	8%	0.084	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-57.8	132.3	171.4	-26.1	32.8	0	0	0	112.8	R270 V271 L274	R270-P520 HydrophobicContact CB-CB 4.44Å; R270-P520 HydrophobicContact CB-CG 4.17Å; V271-P520 HydrophobicContact CG2-CG 4.14Å; L274-P520 HydrophobicContact CD1-CB 4.06Å; L274-P520 HydrophobicContact CD1-CG 3.59Å; L274-P520 HydrophobicContact CD2-CB 4.44Å; L274-P520 HydrophobicContact CG-CB 4.43Å; L274-P520 HydrophobicContact CG-CG 4.39Å
521	S	78.6	Confident	74.4	Confident	18 Å²	18	47.6 Å²	47.6	13%	0.126	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-86.5	138	-180	-174.9	0	0	0	0	112	G3 T8 S519 K523 F524	G3-S521 WeakPolarHBondContact O-CB 3.49Å; G3-S521 PolarHBondContact O-N 3.15Å; T8-S521 WeakPolarHBondContact OG1-CB 2.95Å; T8-S521 PolarHBondContact OG1-OG 3.45Å; S519-S521 PolarHBondContact O-N 2.79Å; S521-K523 PolarHBondContact O-N 3.45Å; S521-K523 VanDerWaalsContact O-N 3.12Å; S521-F524 PolarHBondContact O-N 2.93Å
522	H	66.8	Low	72.6	Confident	99 Å²	99	50.2 Å²	50.2	46%	0.458	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-58.1	-23.9	173.7	-81	-67.9	0	0	0	114.2	R270 F524 R525	R270-H522 VanDerWaalsContact CZ-CD2 3.49Å; R270-H522 PolarHBondContact NH1-CD2 3.1Å; R270-H522 PolarHBondContact NH1-CE1 3.28Å; R270-H522 PolarHBondContact NH1-ND1 2.97Å; R270-H522 PolarHBondContact NH1-NE2 3.25Å; R270-H522 PolarHBondContact NH2-CD2 2.85Å; R270-H522 PolarHBondContact NH2-NE2 3.39Å; H522-F524 PolarHBondContact O-N 2.77Å; H522-R525 PolarHBondContact CE1-NH1 3.04Å; H522-R525 PolarHBondContact ND1-NH1 3.43Å; H522-R525 WeakPolarHBondContact O-CB 2.88Å; H522-R525 PolarHBondContact O-N 2.71Å
523	K	59	Low	70.8	Confident	144 Å²	144	54.3 Å²	54.3	63%	0.626	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-68.4	-20.8	-174.5	-70.5	-173.9	-179.3	177.1	0	113.7	S521 R525	S521-K523 PolarHBondContact O-N 3.45Å; S521-K523 VanDerWaalsContact O-N 3.12Å; K523-R525 VanDerWaalsContact C-N 3.27Å
524	F	55.7	Low	69.1	Low	70 Å²	70	58.1 Å²	58.1	31%	0.307	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-88.5	4.7	175.3	-76.9	-96	0	0	0	113.3	A2 T8 S521 H522 S526	A2-F524 HydrophobicContact CB-CE1 4.06Å; T8-F524 HydrophobicContact CG2-CD2 4.11Å; T8-F524 HydrophobicContact CG2-CE2 3.63Å; S521-F524 PolarHBondContact O-N 2.93Å; H522-F524 PolarHBondContact O-N 2.77Å; F524-S526 VanDerWaalsContact C-N 3.29Å
525	R	52.7	Low	67.3	Low	144 Å²	144	67 Å²	67	54%	0.543	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-82.2	-5.7	176.2	-150.3	173.6	176	172	-1.7	112.9	E273 H522 K523	E273-R525 IonicContact OE1-CZ 3.52Å; E273-R525 IonicContact OE1-NE 2.7Å; E273-R525 PolarHBondContact OE1-NE 3.17Å; E273-R525 IonicContact OE1-NH1 2.78Å; E273-R525 PolarHBondContact OE1-NH1 3.36Å; E273-R525 IonicContact OE1-NH2 2.84Å; E273-R525 PolarHBondContact OE1-NH2 3.19Å; E273-R525 IonicContact OE2-CZ 3.32Å; E273-R525 VanDerWaalsContact OE2-CZ 3.27Å; E273-R525 IonicContact OE2-NH1 2.92Å; E273-R525 PolarHBondContact OE2-NH1 2.83Å; E273-R525 IonicContact OE2-NH2 3.64Å; E273-R525 PolarHBondContact OE2-NH2 2.97Å; H522-R525 PolarHBondContact CE1-NH1 3.04Å; H522-R525 PolarHBondContact ND1-NH1 3.43Å; H522-R525 WeakPolarHBondContact O-CB 2.88Å; H522-R525 PolarHBondContact O-N 2.71Å; K523-R525 VanDerWaalsContact C-N 3.27Å
526	S	52.1	Low	65.5	Low	59 Å²	59	68.8 Å²	68.8	41%	0.413	34%	0.338	S	S	.	.	S	Bend	trans	-82.4	148.8	176.4	70.8	0	0	0	0	111.2	F524 A528 G529 Q530	F524-S526 VanDerWaalsContact C-N 3.29Å; S526-A528 PolarHBondContact O-N 3.07Å; S526-G529 WeakPolarHBondContact O-CA 3.28Å; S526-G529 PolarHBondContact O-N 2.87Å; S526-G529 PolarHBondContact OG-N 3.08Å; S526-Q530 PolarHBondContact O-N 3.02Å
527	V	53.2	Low	63.7	Low	101 Å²	101	71.5 Å²	71.5	61%	0.612	35%	0.35	S	S	*	.	H	α-helix	trans	-50.1	-33.9	175.2	179.9	0	0	0	0	111.5	Q531	V527-Q531 HydrophobicContact CG1-CG 4.34Å; V527-Q531 VanDerWaalsContact O-CB 3.31Å; V527-Q531 WeakPolarHBondContact O-CB 3.43Å; V527-Q531 WeakPolarHBondContact O-CG 3.45Å; V527-Q531 PolarHBondContact O-N 2.01Å
528	A	54.4	Low	61.7	Low	61 Å²	61	75.1 Å²	75.1	50%	0.504	37%	0.369	S	S	.	.	H	α-helix	trans	-65.4	-36.4	175.5	0	0	0	0	0	113.6	S526 L532	S526-A528 PolarHBondContact O-N 3.07Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 PolarHBondContact O-N 3.06Å
529	G	56.7	Low	59.6	Low	10 Å²	10	81.4 Å²	81.4	10%	0.103	40%	0.398	C	S	.	.	H	α-helix	trans	-70.6	-41	176.8	0	0	0	0	0	112.8	S526 L532 Y533	S526-G529 WeakPolarHBondContact O-CA 3.28Å; S526-G529 PolarHBondContact O-N 2.87Å; S526-G529 PolarHBondContact OG-N 3.08Å; G529-L532 PolarHBondContact O-N 2.86Å; G529-Y533 PolarHBondContact O-N 2.85Å
530	Q	57.4	Low	57.3	Low	76 Å²	76	87.5 Å²	87.5	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-66.3	-40.4	171.6	-85.2	163	-38.7	0	0	111.6	E275 S526 L532 Y533 N534	E275-Q530 PolarHBondContact OE2-NE2 3.1Å; E275-Q530 VanDerWaalsContact OE2-NE2 3.13Å; S526-Q530 PolarHBondContact O-N 3.02Å; Q530-L532 VanDerWaalsContact C-N 3.34Å; Q530-L532 PolarHBondContact O-N 2.64Å; Q530-Y533 PolarHBondContact O-N 2.94Å; Q530-N534 WeakPolarHBondContact O-CB 3.43Å; Q530-N534 PolarHBondContact O-N 3.27Å
531	Q	57.1	Low	55.1	Low	111 Å²	111	91.3 Å²	91.3	52%	0.519	46%	0.457	S	S	.	.	H	α-helix	trans	-61.9	-39.5	173.7	-78.5	174.5	-10.8	0	0	112.3	V527 N534 R535	V527-Q531 HydrophobicContact CG1-CG 4.34Å; V527-Q531 VanDerWaalsContact O-CB 3.31Å; V527-Q531 WeakPolarHBondContact O-CB 3.43Å; V527-Q531 WeakPolarHBondContact O-CG 3.45Å; V527-Q531 PolarHBondContact O-N 2.01Å; Q531-N534 PolarHBondContact O-N 3.26Å; Q531-R535 WeakPolarHBondContact O-CB 3.06Å; Q531-R535 WeakPolarHBondContact O-CG 3.32Å; Q531-R535 PolarHBondContact O-N 3.28Å
532	L	56.9	Low	53.1	Low	57 Å²	57	95.1 Å²	95.1	30%	0.298	48%	0.48	S	S	.	.	H	α-helix	trans	-66	-42.7	175.4	-171.9	69.3	0	0	0	111.6	E446 A528 G529 Q530 R535 L536	E446-L532 HydrophobicContact CB-CD1 4.5Å; E446-L532 HydrophobicContact CG-CD1 4.28Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 PolarHBondContact O-N 3.06Å; G529-L532 PolarHBondContact O-N 2.86Å; Q530-L532 VanDerWaalsContact C-N 3.34Å; Q530-L532 PolarHBondContact O-N 2.64Å; L532-R535 PolarHBondContact O-N 3.16Å; L532-L536 HydrophobicContact CG-CD1 4.28Å; L532-L536 VanDerWaalsContact O-CG 3.29Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 2.58Å
533	Y	58.4	Low	51.5	Low	104 Å²	104	96.3 Å²	96.3	41%	0.408	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-45.5	174.9	-176.6	-104	0	0	0	112	G529 Q530 R535 L536 L537	G529-Y533 PolarHBondContact O-N 2.85Å; Q530-Y533 PolarHBondContact O-N 2.94Å; Y533-R535 PolarHBondContact O-N 3.49Å; Y533-L536 PolarHBondContact O-N 3.02Å; Y533-L537 HydrophobicContact CD1-CD1 3.86Å; Y533-L537 HydrophobicContact CE1-CD1 3.29Å; Y533-L537 HydrophobicContact CE1-CG 4.37Å; Y533-L537 HydrophobicContact CE2-CD1 4.39Å; Y533-L537 PolarHBondContact O-N 3.43Å; Y533-L537 VanDerWaalsContact O-N 3.11Å
534	N	58.4	Low	50.1	Low	85 Å²	85	95.7 Å²	95.7	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-39.5	176.9	-74.6	-13.7	0	0	0	111.8	Q530 Q531 L536 L537 I538	Q530-N534 WeakPolarHBondContact O-CB 3.43Å; Q530-N534 PolarHBondContact O-N 3.27Å; Q531-N534 PolarHBondContact O-N 3.26Å; N534-L536 VanDerWaalsContact C-N 3.3Å; N534-L536 PolarHBondContact O-N 3.31Å; N534-L537 PolarHBondContact O-N 2.91Å; N534-I538 HydrophobicContact CB-CD1 4.24Å; N534-I538 WeakPolarHBondContact O-CB 3.42Å; N534-I538 WeakPolarHBondContact O-CD1 3.42Å; N534-I538 WeakPolarHBondContact O-CG1 3.32Å; N534-I538 PolarHBondContact O-N 2.97Å
535	R	55.6	Low	49	Very low	189 Å²	189	98.4 Å²	98.4	71%	0.713	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-36.1	173.6	-78.7	-174.9	-175.8	-174.1	2.4	112.9	Q531 L532 Y533 H539	Q531-R535 WeakPolarHBondContact O-CB 3.06Å; Q531-R535 WeakPolarHBondContact O-CG 3.32Å; Q531-R535 PolarHBondContact O-N 3.28Å; L532-R535 PolarHBondContact O-N 3.16Å; Y533-R535 PolarHBondContact O-N 3.49Å; R535-H539 PolarHBondContact O-N 2.9Å
536	L	56.6	Low	48	Very low	36 Å²	36	97.9 Å²	97.9	19%	0.188	54%	0.538	C	S	.	.	H	α-helix	trans	-72.2	-27.4	178	-71.5	165.3	0	0	0	112.9	Q447 Y450 L532 Y533 N534	Q447-L536 HydrophobicContact CG-CD2 3.92Å; Y450-L536 HydrophobicContact CD2-CD1 4.49Å; L532-L536 HydrophobicContact CG-CD1 4.28Å; L532-L536 VanDerWaalsContact O-CG 3.29Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 2.58Å; Y533-L536 PolarHBondContact O-N 3.02Å; N534-L536 VanDerWaalsContact C-N 3.3Å; N534-L536 PolarHBondContact O-N 3.31Å
537	L	55.2	Low	47	Very low	93 Å²	93	102.6 Å²	102.6	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-84.1	-41.2	174.8	-76.3	171.2	0	0	0	113.1	Y533 N534 H539 N540	Y533-L537 HydrophobicContact CD1-CD1 3.86Å; Y533-L537 HydrophobicContact CE1-CD1 3.29Å; Y533-L537 HydrophobicContact CE1-CG 4.37Å; Y533-L537 HydrophobicContact CE2-CD1 4.39Å; Y533-L537 PolarHBondContact O-N 3.43Å; Y533-L537 VanDerWaalsContact O-N 3.11Å; N534-L537 PolarHBondContact O-N 2.91Å; L537-H539 PolarHBondContact O-N 3.44Å; L537-N540 PolarHBondContact O-N 3.01Å
538	I	47.5	Very low	46	Very low	100 Å²	100	105.5 Å²	105.5	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-73.1	-28.1	-173.4	-65.4	164.6	0	0	0	112.2	N534 N540 S541 V542	N534-I538 HydrophobicContact CB-CD1 4.24Å; N534-I538 WeakPolarHBondContact O-CB 3.42Å; N534-I538 WeakPolarHBondContact O-CD1 3.42Å; N534-I538 WeakPolarHBondContact O-CG1 3.32Å; N534-I538 PolarHBondContact O-N 2.97Å; I538-N540 PolarHBondContact O-N 3.18Å; I538-S541 PolarHBondContact O-N 2.76Å; I538-S541 PolarHBondContact O-OG 3.23Å; I538-V542 HydrophobicContact CG2-CG2 4.25Å; I538-V542 WeakPolarHBondContact O-CG2 3.35Å
539	H	45.9	Very low	45	Very low	139 Å²	139	108.3 Å²	108.3	64%	0.644	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-9.2	178.8	-133.9	-58.2	0	0	0	114.1	R535 L537	R535-H539 PolarHBondContact O-N 2.9Å; L537-H539 PolarHBondContact O-N 3.44Å
540	N	42.1	Very low	43.9	Very low	128 Å²	128	110.7 Å²	110.7	68%	0.684	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-4.5	174.9	-78.2	-9.8	0	0	0	113.6	L537 I538	L537-N540 PolarHBondContact O-N 3.01Å; I538-N540 PolarHBondContact O-N 3.18Å
541	S	36.4	Very low	42.7	Very low	93 Å²	93	113.5 Å²	113.5	65%	0.65	63%	0.629	S	S	*	*	S	Bend	trans	-121.3	2.8	-175.8	55	0	0	0	0	115.6	I538	I538-S541 PolarHBondContact O-N 2.76Å; I538-S541 PolarHBondContact O-OG 3.23Å
542	V	36.2	Very low	41.6	Very low	99 Å²	99	114.1 Å²	114.1	60%	0.6	64%	0.64	S	S	*	*			trans	-126.2	38.4	-168.5	-166.9	0	0	0	0	113.6	I538	I538-V542 HydrophobicContact CG2-CG2 4.25Å; I538-V542 WeakPolarHBondContact O-CG2 3.35Å
543	T	34.2	Very low	40.3	Very low	123 Å²	123	118.7 Å²	118.7	76%	0.755	67%	0.665	S	S	*	*			trans	-123.3	45.7	171.9	-26.7	0	0	0	0	111.4
544	T	30.4	Very low	39.1	Very low	131 Å²	131	118.6 Å²	118.6	80%	0.804	68%	0.68	S	S	*	*			trans	-150.4	71.1	171.8	-42	0	0	0	0	110.2
545	T	31.8	Very low	37.8	Very low	128 Å²	128	121.5 Å²	121.5	79%	0.785	70%	0.695	S	S	*	*			trans	-145.3	101.3	157.3	28.1	0	0	0	0	108.3
546	T	32.3	Very low	36.8	Very low	133 Å²	133	118.5 Å²	118.5	82%	0.816	70%	0.698	S	S	*	*			trans	-60.4	126.2	173	-20	0	0	0	0	109.7
547	I	30.5	Very low	35.4	Very low	157 Å²	157	122.6 Å²	122.6	81%	0.805	73%	0.728	S	S	*	*			trans	-74.1	124.4	171.6	-62.9	167.8	0	0	0	107.7
548	L	32.7	Very low	34.2	Very low	163 Å²	163	122.3 Å²	122.3	85%	0.853	74%	0.739	S	S	*	*			trans	-121.9	124.1	161.1	-97.1	153.7	0	0	0	107.6
549	P	33.3	Very low	33.4	Very low	119 Å²	119	122.5 Å²	122.5	77%	0.773	75%	0.75	S	S	*	*			trans	-95.4	154.5	179.2	36.7	-30.7	0	0	0	111.7
550	G	33.8	Very low	32.7	Very low	61 Å²	61	122.3 Å²	122.3	63%	0.629	76%	0.759	S	S	*	*			trans	130.7	89.5	167.9	0	0	0	0	0	112.4
551	T	31.8	Very low	32	Very low	135 Å²	135	123.9 Å²	123.9	83%	0.828	77%	0.765	S	S	*	*				92.8	134	96.4	42.1	0	0	0	0	114.7
552	T	33.5	Very low	31.7	Very low	124 Å²	124	124.1 Å²	124.1	76%	0.761	77%	0.773	S	S	*	*			trans	80	96.4	155.4	47.8	0	0	0	0	120.9
553	N	30.2	Very low	31.4	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	78%	0.779	S	S	*	*				50.3	133.1	120.4	-68.7	-4.7	0	0	0	122.4
554	S	33.2	Very low	31.3	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	78%	0.782	S	S	*	*			trans	95.2	106.2	143.2	71.7	0	0	0	0	119.1
555	N	31.2	Very low	31.2	Very low	145 Å²	145	128 Å²	128	78%	0.775	78%	0.778	S	S	*	*				70.6	124.8	126.4	-62.2	-5.5	0	0	0	121.8
556	T	33.5	Very low	30.9	Very low	126 Å²	126	127.9 Å²	127.9	77%	0.773	77%	0.773	S	S	*	*			trans	81.3	114.7	134.8	46.8	0	0	0	0	121.3
557	C	27.2	Very low	30.8	Very low	122 Å²	122	126.7 Å²	126.7	82%	0.824	77%	0.77	S	S	*	*				77	113.5	129.8	-73	0	0	0	0	121.9
558	A	31.2	Very low	30.8	Very low	87 Å²	87	128 Å²	128	72%	0.719	77%	0.77	S	S	*	*				78.5	114.2	119.9	0	0	0	0	0	120.6
559	S	29.1	Very low	30.4	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	77%	0.769	S	S	*	*			trans	49.3	124.9	135.8	61.1	0	0	0	0	120.1
560	T	31.7	Very low	30.2	Very low	135 Å²	135	125.4 Å²	125.4	83%	0.828	76%	0.764	S	S	*	*				169.3	142.4	102.7	-64.4	0	0	0	0	110.8
561	I	26.9	Very low	29.9	Very low	160 Å²	160	130.6 Å²	130.6	82%	0.821	77%	0.772	S	S	*	*			trans	-75.2	137.8	-179.6	-67	159.6	0	0	0	111
562	A	31.8	Very low	29.6	Very low	98 Å²	98	130.4 Å²	130.4	81%	0.81	77%	0.766	S	S	*	*			trans	-167.4	136.6	142.9	0	0	0	0	0	112.5
563	T	28.3	Very low	29.5	Very low	121 Å²	121	132 Å²	132	74%	0.742	77%	0.768	S	S	*	*			trans	-78.9	162.7	-178.7	41.8	0	0	0	0	114.7
564	I	31.9	Very low	29.2	Very low	156 Å²	156	131.7 Å²	131.7	80%	0.8	77%	0.767	S	S	*	*			trans	143.9	113.9	131.1	-72.8	166.7	0	0	0	114.1
565	H	29	Very low	29.1	Very low	157 Å²	157	133.2 Å²	133.2	73%	0.727	77%	0.765	S	S	*	*			trans	53.3	128.9	136.4	-105.3	-103.3	0	0	0	125.3
566	D	26.3	Very low	29	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	77%	0.767	S	S	*	*			trans	52.3	125.4	136.8	-71.8	-2.7	0	0	0	123
567	S	30.5	Very low	28.7	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	76%	0.764	S	S	*	*				167.8	138	99	47.3	0	0	0	0	114.5
568	F	28.9	Very low	28.8	Very low	185 Å²	185	140.5 Å²	140.5	81%	0.811	77%	0.767	S	S	*	*			trans	57.5	105.4	141.5	-89.4	-98.9	0	0	0	123.9
569	I	25.5	Very low	28.7	Very low	161 Å²	161	144.7 Å²	144.7	83%	0.826	77%	0.772	S	S	*	*				27.1	124.1	120.3	-53.8	172.6	0	0	0	119
570	G	27.9	Very low	28.6	Very low	66 Å²	66	145 Å²	145	68%	0.68	78%	0.775	S	S	*	*			trans	173.8	98.9	156.1	0	0	0	0	0	116.3
571	H	27.6	Very low	28.5	Very low	170 Å²	170	147.8 Å²	147.8	79%	0.787	78%	0.778	S	S	*	*			trans	63.7	129.2	145	-90.6	-71	0	0	0	124.6
572	D	26.9	Very low	28.7	Very low	131 Å²	131	145.3 Å²	145.3	70%	0.701	77%	0.77	S	S	*	*			trans	79.9	135.3	137.5	-63.4	-25.4	0	0	0	122.4
573	I	30.1	Very low	28.5	Very low	158 Å²	158	148.4 Å²	148.4	81%	0.81	77%	0.772	S	S	*	*			trans	137	120.7	133.8	-64.2	172.2	0	0	0	111.1
574	D	24.9	Very low	28.5	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	77%	0.769	S	S	*	*			trans	-47.7	169.1	177.7	-69.4	-54.9	0	0	0	115.7
575	I	30.1	Very low	28.6	Very low	135 Å²	135	147.7 Å²	147.7	69%	0.692	76%	0.759	S	S	*	*			trans	128.6	130.3	136.9	-66	162.8	0	0	0	114.6
576	Y	29.5	Very low	28.7	Very low	209 Å²	209	145.3 Å²	145.3	82%	0.82	76%	0.756	S	S	*	*			trans	76.4	96.5	162	-76.2	-61.2	0	0	0	120.5
577	D	27.7	Very low	29	Very low	133 Å²	133	143.3 Å²	143.3	71%	0.711	75%	0.75	S	S	*	*				47.4	109.2	106.3	-152	13.1	0	0	0	117.6
578	K	29	Very low	29.1	Very low	203 Å²	203	148.4 Å²	148.4	88%	0.883	76%	0.758	S	S	*	*			trans	-165.8	117.6	142.2	-114.3	167.6	-176.6	178.9	0	114.6
579	Q	29.9	Very low	29.3	Very low	175 Å²	175	147.9 Å²	147.9	82%	0.818	76%	0.758	S	S	*	*			trans	-12.2	137.8	159.3	-77.7	166.5	-44.5	0	0	119.4
580	S	26.4	Very low	29.6	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	76%	0.756	S	S	*	*			trans	-57.3	124.5	162.1	58.1	0	0	0	0	112.7
581	E	28.9	Very low	29.7	Very low	192 Å²	192	149.8 Å²	149.8	90%	0.897	76%	0.762	S	S	*	*			trans	-108.9	110.7	164.5	-85.8	-170.8	159	0	0	111.9
582	T	31.2	Very low	29.8	Very low	108 Å²	108	149.3 Å²	149.3	66%	0.663	77%	0.765	S	S	*	*			trans	-51.4	135.8	163.6	-43.4	0	0	0	0	111.2	Q584	T582-Q584 HydrophobicContact CG2-CG 4.12Å; T582-Q584 PolarHBondContact O-N 3.18Å
583	I	27.5	Very low	30	Very low	163 Å²	163	153.1 Å²	153.1	84%	0.836	77%	0.771	S	S	*	*			trans	-70	86.7	161.7	-59.2	175.8	0	0	0	107.3
584	Q	29.3	Very low	30.1	Very low	149 Å²	149	153.8 Å²	153.8	70%	0.696	77%	0.768	S	S	*	*			trans	-88.6	120.4	159.4	-77.2	-162.1	-11.9	0	0	108.4	T582 V586	T582-Q584 HydrophobicContact CG2-CG 4.12Å; T582-Q584 PolarHBondContact O-N 3.18Å; Q584-V586 VanDerWaalsContact C-N 3.29Å; Q584-V586 HydrophobicContact CB-CG2 4.4Å; Q584-V586 PolarHBondContact O-N 3.02Å
585	L	33.2	Very low	30.5	Very low	113 Å²	113	153.8 Å²	153.8	59%	0.592	76%	0.763	S	S	*	*			trans	-67.7	92.6	161.5	-71	161.7	0	0	0	107.2	L439	L439-L585 HydrophobicContact CD1-CD1 4.29Å; L439-L585 HydrophobicContact CD2-CD1 4.38Å
586	V	30.6	Very low	30.6	Very low	108 Å²	108	154 Å²	154	66%	0.655	77%	0.766	S	S	*	*			trans	-70.6	126.2	-179.7	-178.9	0	0	0	0	109.6	Q584	Q584-V586 VanDerWaalsContact C-N 3.29Å; Q584-V586 HydrophobicContact CB-CG2 4.4Å; Q584-V586 PolarHBondContact O-N 3.02Å
587	P	34.1	Very low	30.7	Very low	83 Å²	83	152 Å²	152	54%	0.539	77%	0.769	S	S	.	*			trans	-70.1	149.8	173.4	28.5	-32	0	0	0	111	Q589	P587-Q589 PolarHBondContact O-N 2.83Å
588	K	31.9	Very low	31	Very low	216 Å²	216	151.1 Å²	151.1	94%	0.939	77%	0.77	S	S	*	*			trans	-55	103.5	179.5	-162.5	-179.2	-173.7	-175.1	0	110.8
589	Q	32.6	Very low	31	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.813	77%	0.765	S	S	*	*			trans	-77.6	125.9	168.1	-84.9	-176.1	-22.4	0	0	109.8	P587	P587-Q589 PolarHBondContact O-N 2.83Å
590	S	32.9	Very low	31.1	Very low	111 Å²	111	145 Å²	145	78%	0.776	77%	0.766	S	S	*	*			trans	-64.1	124.3	165.6	46.2	0	0	0	0	109.5	D592	S590-D592 PolarHBondContact O-N 2.96Å
591	I	28.4	Very low	31.1	Very low	155 Å²	155	144.6 Å²	144.6	80%	0.795	76%	0.764	S	S	*	*			trans	-71.8	111.4	167.8	-62.9	166.8	0	0	0	106.6
592	D	31.8	Very low	31.3	Very low	160 Å²	160	142.5 Å²	142.5	86%	0.856	76%	0.764	S	S	*	*			trans	-139.8	136.6	156.9	-110.6	-29.3	0	0	0	109.9	S590	S590-D592 PolarHBondContact O-N 2.96Å
593	Y	29.2	Very low	31.3	Very low	211 Å²	211	142.6 Å²	142.6	83%	0.827	77%	0.769	S	S	*	*			trans	-78.3	150.6	-169.1	-105.2	-101.1	0	0	0	112.8
594	K	32.6	Very low	31.2	Very low	172 Å²	172	143 Å²	143	75%	0.748	77%	0.772	S	S	*	*			trans	105	117.3	153	-76.3	-175.3	167.6	-165.5	0	121.2
595	E	33.3	Very low	31.2	Very low	146 Å²	146	140.7 Å²	140.7	68%	0.682	77%	0.773	S	S	*	*			trans	78	106.2	130.9	-72.9	177.6	131.6	0	0	122.1
596	N	33.1	Very low	31	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	78%	0.782	S	S	*	*				53.9	105.3	123.1	-61.5	-21.5	0	0	0	120.5
597	L	31.7	Very low	31.1	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	79%	0.788	S	S	*	*				160.1	148.7	102.7	-128.7	75.6	0	0	0	110.9
598	P	32.5	Very low	31	Very low	113 Å²	113	148.2 Å²	148.2	73%	0.734	80%	0.804	S	S	*	*			trans	-111.4	176.1	-163.1	40.5	-30.2	0	0	0	116.1
599	S	29.7	Very low	30.9	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	80%	0.797	S	S	*	*			trans	94.4	116.7	159.1	75.8	0	0	0	0	118
600	T	31.8	Very low	30.8	Very low	138 Å²	138	143.8 Å²	143.8	85%	0.847	80%	0.8	S	S	*	*				-172.6	128.3	105.9	-52.8	0	0	0	0	109.8
601	S	27.4	Very low	30.8	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	80%	0.796	S	S	*	*			trans	-82.5	139.3	175.8	49.5	0	0	0	0	112.5
602	T	31.9	Very low	31.1	Very low	148 Å²	148	145.2 Å²	145.2	91%	0.908	80%	0.795	S	S	*	*			trans	-154.6	147.1	143.6	-1.6	0	0	0	0	112.3
603	S	32.3	Very low	31.4	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	79%	0.794	S	S	*	*			trans	-88.9	154.2	-155.2	47.4	0	0	0	0	116.3
604	L	25.7	Very low	31.8	Very low	171 Å²	171	142.4 Å²	142.4	90%	0.895	79%	0.792	S	S	*	*			trans	-48.6	145.6	164.3	-98.6	78.6	0	0	0	114.1
605	S	29.4	Very low	32.2	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	78%	0.784	S	S	*	*				-162	136.4	122.6	58	0	0	0	0	112.8
606	N	27.3	Very low	32.6	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	78%	0.779	S	S	*	*			trans	65.2	126.7	154	-60	-18	0	0	0	120
607	V	33.2	Very low	32.8	Very low	129 Å²	129	133 Å²	133	78%	0.782	76%	0.764	S	S	*	*				179	121.4	119.4	156.7	0	0	0	0	110.5
608	E	33	Very low	33.3	Very low	185 Å²	185	131 Å²	131	86%	0.864	75%	0.754	S	S	*	*			trans	50.1	111	149.1	-67.3	175.9	138.1	0	0	122.5
609	A	28.9	Very low	33.7	Very low	97 Å²	97	132.6 Å²	132.6	80%	0.802	75%	0.749	S	S	*	*			trans	-113.5	104.1	158.6	0	0	0	0	0	110.4
610	K	30.9	Very low	34.2	Very low	199 Å²	199	132.5 Å²	132.5	87%	0.865	74%	0.735	S	S	*	*			trans	-178.6	130.4	149.2	-104.8	166.2	-176.3	-179.7	0	110.6
611	S	32.8	Very low	34.7	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	72%	0.722	S	S	*	*	S	Bend	trans	124	-1.2	152.2	76.8	0	0	0	0	120.6
612	Y	34.5	Very low	35.3	Very low	197 Å²	197	136 Å²	136	77%	0.773	72%	0.724	S	S	*	*			trans	-100.8	4.9	-174.2	-65.8	-77.5	0	0	0	117.4
613	L	37.8	Very low	35.6	Very low	162 Å²	162	135.7 Å²	135.7	85%	0.848	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-12.7	-163.9	-122.7	138.1	0	0	0	116.3
614	L	37.6	Very low	36.1	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-25.8	-175.2	-106.5	154.1	0	0	0	114.1
615	T	40.8	Very low	36.7	Very low	92 Å²	92	131.5 Å²	131.5	56%	0.564	69%	0.686	S	S	*	*	H	α-helix	trans	-84.6	-28.2	-173.3	-1.4	0	0	0	0	113.6
616	E	41.8	Very low	37	Very low	125 Å²	125	135.4 Å²	135.4	58%	0.584	69%	0.691	S	S	*	*	H	α-helix	trans	-78.2	-28.7	179.5	-77.6	-64.7	121.9	0	0	113	L618 K619 F620	E616-L618 VanDerWaalsContact C-N 3.34Å; E616-L618 PolarHBondContact O-N 3.28Å; E616-K619 PolarHBondContact O-N 3.2Å; E616-F620 PolarHBondContact O-N 3.07Å
617	G	38.7	Very low	37.1	Very low	42 Å²	42	138.6 Å²	138.6	43%	0.433	70%	0.701	S	S	.	*	H	α-helix	trans	-65	-35.2	176.8	0	0	0	0	0	113.6
618	L	41	Very low	37.3	Very low	129 Å²	129	139.1 Å²	139.1	68%	0.675	70%	0.697	S	S	*	*	H	α-helix	trans	-79.3	-31.6	179.8	-93.3	148.3	0	0	0	113.2	E616 F620	E616-L618 VanDerWaalsContact C-N 3.34Å; E616-L618 PolarHBondContact O-N 3.28Å; L618-F620 VanDerWaalsContact C-N 3.34Å
619	K	41	Very low	37.5	Very low	146 Å²	146	136.7 Å²	136.7	64%	0.635	69%	0.688	S	S	*	*	H	α-helix	trans	-71.9	-28.4	174	-78.8	-177.5	178.9	176.3	0	112.6	E616 R622	E616-K619 PolarHBondContact O-N 3.2Å; K619-R622 WeakPolarHBondContact O-CB 2.94Å; K619-R622 PolarHBondContact O-N 2.98Å
620	F	40.6	Very low	38	Very low	110 Å²	110	138.9 Å²	138.9	48%	0.482	68%	0.682	S	S	.	*	H	α-helix	trans	-72.5	-33.1	-179.2	-163	-94.3	0	0	0	113.3	E616 L618 R622 K623 E624	E616-F620 PolarHBondContact O-N 3.07Å; L618-F620 VanDerWaalsContact C-N 3.34Å; F620-R622 PolarHBondContact O-N 3.42Å; F620-K623 PolarHBondContact O-N 3.31Å; F620-K623 VanDerWaalsContact O-N 3.08Å; F620-E624 HydrophobicContact CE1-CG 4.13Å; F620-E624 HydrophobicContact CZ-CG 4.42Å; F620-E624 PolarHBondContact O-N 2.72Å
621	I	41.3	Very low	38.4	Very low	111 Å²	111	135.4 Å²	135.4	57%	0.569	67%	0.671	S	S	*	*	H	α-helix	trans	-62.3	-27.5	175.1	-64.9	173.3	0	0	0	111.6	K623 A625	I621-K623 VanDerWaalsContact C-N 3.32Å; I621-K623 PolarHBondContact O-N 3.2Å; I621-A625 WeakPolarHBondContact O-CB 3.42Å
622	R	39.9	Very low	38.7	Very low	205 Å²	205	137.6 Å²	137.6	77%	0.774	67%	0.67	S	S	*	*	H	α-helix	trans	-73	-21.1	177.1	-159.6	176.9	-167	172	4.7	113.4	K619 F620	K619-R622 WeakPolarHBondContact O-CB 2.94Å; K619-R622 PolarHBondContact O-N 2.98Å; F620-R622 PolarHBondContact O-N 3.42Å
623	K	39.3	Very low	39	Very low	142 Å²	142	133.7 Å²	133.7	62%	0.617	66%	0.663	S	S	*	*	H	α-helix	trans	-96.9	-32	-173	-147.5	178.9	-179.1	-174	0	113.7	F620 I621	F620-K623 PolarHBondContact O-N 3.31Å; F620-K623 VanDerWaalsContact O-N 3.08Å; I621-K623 VanDerWaalsContact C-N 3.32Å; I621-K623 PolarHBondContact O-N 3.2Å
624	E	42.6	Very low	39.1	Very low	118 Å²	118	131.6 Å²	131.6	55%	0.551	65%	0.65	S	S	*	*	H	α-helix	trans	-89.7	-6.7	173.9	-77.7	-166.4	160.6	0	0	113.9	R437 F620	R437-E624 IonicContact NH1-OE2 3.68Å; F620-E624 HydrophobicContact CE1-CG 4.13Å; F620-E624 HydrophobicContact CZ-CG 4.42Å; F620-E624 PolarHBondContact O-N 2.72Å
625	A	37.7	Very low	39.2	Very low	74 Å²	74	130.2 Å²	130.2	61%	0.612	64%	0.639	S	S	*	*	S	Bend	trans	-89.7	-4.2	171	0	0	0	0	0	113.2	I621	I621-A625 WeakPolarHBondContact O-CB 3.42Å
626	F	35.7	Very low	39.1	Very low	184 Å²	184	133.4 Å²	133.4	81%	0.807	65%	0.645	S	S	*	*			trans	-128.6	11.6	-175.7	-93.2	-82.1	0	0	0	114.2
627	E	29.3	Very low	38.8	Very low	215 Å²	215	134.2 Å²	134.2	100%	1.005	65%	0.651	S	S	*	*			trans	-128	0	166.1	-75.4	-179.6	-179.9	0	0	109

Retrieved 627 of 627 residues in 1085.8 ms (Link to these results)

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