A0A3Q0KUZ5_SCHMA Loading...

Engulfment and cell motility, putative

AlphaFold DB , UniProt , Accession A0A3Q0KUZ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 283 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	55	Low	54.5	Low	188 Å²	188	108.1 Å²	108.1	93%	0.926	56%	0.563	S	S	*	*				0	-54.2	0	-160.5	171.4	71.5	0	0	113	I3 H4 I5	M1-I3 PolarHBondContact O-N 3.35Å; M1-H4 VanDerWaalsContact O-CB 3.31Å; M1-H4 WeakPolarHBondContact O-CB 3.13Å; M1-H4 PolarHBondContact O-N 3.41Å; M1-H4 VanDerWaalsContact O-N 3.11Å; M1-I5 PolarHBondContact O-N 2.91Å
2	Y	52.1	Low	55.3	Low	134 Å²	134	104 Å²	104	53%	0.525	55%	0.546	S	S	.	.	H	α-helix	trans	-59.8	-42.3	-177.7	-125.8	-90.4	0	0	0	114.4	H4 I5 L6 K42	Y2-H4 VanDerWaalsContact C-N 3.26Å; Y2-H4 PolarHBondContact O-N 3.48Å; Y2-I5 PolarHBondContact O-N 3.41Å; Y2-I5 VanDerWaalsContact O-N 3.14Å; Y2-L6 HydrophobicContact CD1-CD1 4.47Å; Y2-L6 PolarHBondContact O-N 2.92Å; Y2-L6 VanDerWaalsContact O-N 3.09Å; Y2-K42 PolarHBondContact OH-NZ 2.87Å
3	I	50.9	Low	56.5	Low	133 Å²	133	101.2 Å²	101.2	68%	0.682	56%	0.558	S	S	*	*	H	α-helix	trans	-59.4	-39	175.5	-63.4	172.5	0	0	0	110.9	M1 I5 L6 L7	M1-I3 PolarHBondContact O-N 3.35Å; I3-I5 PolarHBondContact O-N 3.35Å; I3-L6 PolarHBondContact O-N 3.11Å; I3-L7 HydrophobicContact CG2-CD1 3.8Å; I3-L7 WeakPolarHBondContact O-CB 3.36Å; I3-L7 WeakPolarHBondContact O-CG 3.39Å; I3-L7 PolarHBondContact O-N 3.46Å
4	H	53.2	Low	58.3	Low	132 Å²	132	99.1 Å²	99.1	61%	0.611	54%	0.537	S	S	*	.	H	α-helix	trans	-65.8	-36.7	177.1	-122.5	-61.7	0	0	0	112.5	M1 Y2 L8	M1-H4 VanDerWaalsContact O-CB 3.31Å; M1-H4 WeakPolarHBondContact O-CB 3.13Å; M1-H4 PolarHBondContact O-N 3.41Å; M1-H4 VanDerWaalsContact O-N 3.11Å; Y2-H4 VanDerWaalsContact C-N 3.26Å; Y2-H4 PolarHBondContact O-N 3.48Å; H4-L8 WeakPolarHBondContact O-CB 3.31Å; H4-L8 VanDerWaalsContact O-CG 3.26Å; H4-L8 WeakPolarHBondContact O-CG 3.17Å; H4-L8 PolarHBondContact O-N 2.88Å
5	I	58.1	Low	60.3	Low	63 Å²	63	93.9 Å²	93.9	32%	0.323	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-46.1	177.1	-65.5	170.3	0	0	0	110.3	M1 Y2 I3 L8 V9	M1-I5 PolarHBondContact O-N 2.91Å; Y2-I5 PolarHBondContact O-N 3.41Å; Y2-I5 VanDerWaalsContact O-N 3.14Å; I3-I5 PolarHBondContact O-N 3.35Å; I5-L8 PolarHBondContact O-N 2.84Å; I5-V9 WeakPolarHBondContact O-CG2 3.26Å; I5-V9 PolarHBondContact O-N 3.3Å
6	L	56.3	Low	62.3	Low	112 Å²	112	93.6 Å²	93.6	59%	0.586	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-43.7	177.6	-73.8	166.9	0	0	0	111.3	Y2 I3 L8 V9 S10	Y2-L6 HydrophobicContact CD1-CD1 4.47Å; Y2-L6 PolarHBondContact O-N 2.92Å; Y2-L6 VanDerWaalsContact O-N 3.09Å; I3-L6 PolarHBondContact O-N 3.11Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 2.96Å; L6-V9 PolarHBondContact O-N 3.43Å; L6-S10 PolarHBondContact O-N 3.37Å; L6-S10 PolarHBondContact O-OG 3.28Å
7	L	50.6	Low	64.2	Low	90 Å²	90	88.4 Å²	88.4	47%	0.471	48%	0.477	S	S	.	.	H	α-helix	trans	-59	-41.8	173.6	-83.5	161.8	0	0	0	112.3	I3 S10 V11	I3-L7 HydrophobicContact CG2-CD1 3.8Å; I3-L7 WeakPolarHBondContact O-CB 3.36Å; I3-L7 WeakPolarHBondContact O-CG 3.39Å; I3-L7 PolarHBondContact O-N 3.46Å; L7-S10 WeakPolarHBondContact CA-OG 3.4Å; L7-S10 PolarHBondContact O-N 2.89Å; L7-S10 PolarHBondContact O-OG 3Å; L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.46Å; L7-V11 WeakPolarHBondContact O-CG2 3.42Å; L7-V11 PolarHBondContact O-N 3.17Å
8	L	58.3	Low	65.9	Low	69 Å²	69	83.7 Å²	83.7	36%	0.361	45%	0.452	S	S	.	.	H	α-helix	trans	-69.8	-37.2	178.6	-73.8	166.4	0	0	0	112.2	H4 I5 L6 S10 V11 T12	H4-L8 WeakPolarHBondContact O-CB 3.31Å; H4-L8 VanDerWaalsContact O-CG 3.26Å; H4-L8 WeakPolarHBondContact O-CG 3.17Å; H4-L8 PolarHBondContact O-N 2.88Å; I5-L8 PolarHBondContact O-N 2.84Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 2.96Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-V11 PolarHBondContact O-N 3.09Å; L8-T12 PolarHBondContact O-N 3.14Å; L8-T12 PolarHBondContact O-OG1 3.05Å; L8-T12 VanDerWaalsContact O-OG1 3.05Å
9	V	60.4	Low	67.4	Low	64 Å²	64	81 Å²	81	39%	0.388	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-40.1	173.7	174.4	0	0	0	0	110.4	I5 L6 G13	I5-V9 WeakPolarHBondContact O-CG2 3.26Å; I5-V9 PolarHBondContact O-N 3.3Å; L6-V9 PolarHBondContact O-N 3.43Å; V9-G13 WeakPolarHBondContact O-CA 3.48Å; V9-G13 PolarHBondContact O-N 3.04Å
10	S	53.5	Low	68.9	Low	89 Å²	89	77.6 Å²	77.6	62%	0.622	42%	0.416	S	S	*	.	H	α-helix	trans	-69.1	-33.7	177.5	67.6	0	0	0	0	112.8	L6 L7 L8	L6-S10 PolarHBondContact O-N 3.37Å; L6-S10 PolarHBondContact O-OG 3.28Å; L7-S10 WeakPolarHBondContact CA-OG 3.4Å; L7-S10 PolarHBondContact O-N 2.89Å; L7-S10 PolarHBondContact O-OG 3Å; L8-S10 VanDerWaalsContact C-N 3.34Å
11	V	51.4	Low	70.2	Confident	115 Å²	115	74.2 Å²	74.2	70%	0.697	40%	0.398	S	S	*	.	H	α-helix	trans	-79.2	-40.5	-179.9	170.9	0	0	0	0	112.4	L7 L8	L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.46Å; L7-V11 WeakPolarHBondContact O-CG2 3.42Å; L7-V11 PolarHBondContact O-N 3.17Å; L8-V11 PolarHBondContact O-N 3.09Å
12	T	63.4	Low	72.1	Confident	59 Å²	59	68 Å²	68	36%	0.362	38%	0.377	S	S	.	.	H	α-helix	trans	-105	-11.2	-174.6	77.2	0	0	0	0	114.2	L8 R14 R19	L8-T12 PolarHBondContact O-N 3.14Å; L8-T12 PolarHBondContact O-OG1 3.05Å; L8-T12 VanDerWaalsContact O-OG1 3.05Å; T12-R14 WeakPolarHBondContact O-CG 3.5Å; T12-R14 PolarHBondContact O-N 2.89Å; T12-R14 WeakPolarHBondContact OG1-CB 3.35Å; T12-R14 PolarHBondContact OG1-N 3.21Å; T12-R19 WeakPolarHBondContact OG1-CD 3.31Å
13	G	71.2	Confident	74.2	Confident	68 Å²	68	65.6 Å²	65.6	70%	0.701	38%	0.38	S	S	*	.	S	Bend	trans	64.3	5.1	-171.4	0	0	0	0	0	114.8	V9	V9-G13 WeakPolarHBondContact O-CA 3.48Å; V9-G13 PolarHBondContact O-N 3.04Å
14	R	81.5	Confident	76.3	Confident	71 Å²	71	63.2 Å²	63.2	27%	0.268	36%	0.363	S	S	.	.			trans	-115.1	142.2	-168.4	-73.1	176.4	-178.4	171.6	6	111.6	T12 S18 R19 D75	T12-R14 WeakPolarHBondContact O-CG 3.5Å; T12-R14 PolarHBondContact O-N 2.89Å; T12-R14 WeakPolarHBondContact OG1-CB 3.35Å; T12-R14 PolarHBondContact OG1-N 3.21Å; R14-S18 WeakPolarHBondContact CB-OG 3.46Å; R14-S18 WeakPolarHBondContact CD-OG 3.33Å; R14-S18 WeakPolarHBondContact CG-OG 3.36Å; R14-R19 HydrophobicContact CB-CG 3.89Å; R14-R19 PolarHBondContact O-NH1 2.53Å; R14-D75 IonicContact CZ-OD1 2.73Å; R14-D75 IonicContact CZ-OD2 3.85Å; R14-D75 IonicContact NE-OD2 3.75Å; R14-D75 PolarHBondContact NE-OD2 3.48Å; R14-D75 IonicContact NH2-OD1 3.22Å; R14-D75 PolarHBondContact NH2-OD1 2.93Å; R14-D75 IonicContact NH2-OD2 2.8Å; R14-D75 PolarHBondContact NH2-OD2 2.83Å
15	C	89.2	Confident	78.4	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.149	36%	0.359	C	S	.	.			trans	-69.6	164.4	171.6	77.9	0	0	0	0	111.6	L17 S18 R19 K69	C15-L17 PolarHBondContact O-N 2.8Å; C15-S18 WeakPolarHBondContact O-CB 3.22Å; C15-S18 PolarHBondContact O-N 2.75Å; C15-R19 PolarHBondContact O-N 2.95Å; C15-K69 HydrophobicContact CB-CB 4.31Å; C15-K69 HydrophobicContact CB-CD 4.32Å
16	E	92.1	Very high	80.2	Confident	89 Å²	89	63.9 Å²	63.9	42%	0.416	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-46.1	-176.5	-173.4	-175.1	-166.4	0	0	113.3	S18 R19 I20 S37	E16-S18 VanDerWaalsContact C-N 3.32Å; E16-S18 PolarHBondContact O-N 3.44Å; E16-R19 PolarHBondContact O-N 3.39Å; E16-I20 HydrophobicContact CG-CD1 3.88Å; E16-I20 HydrophobicContact CG-CG1 4.47Å; E16-I20 WeakPolarHBondContact O-CG1 3.38Å; E16-I20 PolarHBondContact O-N 2.76Å; E16-S37 VanDerWaalsContact CD-OG 3.26Å; E16-S37 PolarHBondContact OE2-OG 3.46Å
17	L	95	Very high	82.1	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-58.6	-46.5	178.7	-62	177	0	0	0	111.1	C15 R19 I20 I21 I34 S37 I46 V65 F79 Y83	C15-L17 PolarHBondContact O-N 2.8Å; L17-R19 VanDerWaalsContact C-N 3.35Å; L17-R19 PolarHBondContact O-N 2.98Å; L17-I20 PolarHBondContact O-N 2.87Å; L17-I21 WeakPolarHBondContact O-CG1 3.35Å; L17-I21 PolarHBondContact O-N 3.16Å; L17-I34 HydrophobicContact CD2-CD1 3.86Å; L17-S37 WeakPolarHBondContact CD2-OG 3.4Å; L17-I46 HydrophobicContact CD1-CG2 4.44Å; L17-V65 HydrophobicContact CD1-CG1 3.59Å; L17-F79 HydrophobicContact CB-CE2 4.32Å; L17-F79 HydrophobicContact CB-CZ 4.39Å; L17-Y83 HydrophobicContact CD1-CE2 4.02Å; L17-Y83 HydrophobicContact CD2-CE2 4.2Å
18	S	94.8	Very high	84.4	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-43.1	176.1	158.8	0	0	0	0	112.3	R14 C15 E16 A22 Q76	R14-S18 WeakPolarHBondContact CB-OG 3.46Å; R14-S18 WeakPolarHBondContact CD-OG 3.33Å; R14-S18 WeakPolarHBondContact CG-OG 3.36Å; C15-S18 WeakPolarHBondContact O-CB 3.22Å; C15-S18 PolarHBondContact O-N 2.75Å; E16-S18 VanDerWaalsContact C-N 3.32Å; E16-S18 PolarHBondContact O-N 3.44Å; S18-A22 PolarHBondContact O-N 2.69Å; S18-Q76 PolarHBondContact O-NE2 3.25Å; S18-Q76 PolarHBondContact OG-NE2 3.04Å; S18-Q76 PolarHBondContact OG-OE1 3.38Å
19	R	94.5	Very high	86.3	Confident	33 Å²	33	51.8 Å²	51.8	13%	0.125	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-42.5	174.7	-68.6	-170.3	-58.4	-107.2	4.5	112.2	T12 R14 C15 E16 L17 A22 S23	T12-R19 WeakPolarHBondContact OG1-CD 3.31Å; R14-R19 HydrophobicContact CB-CG 3.89Å; R14-R19 PolarHBondContact O-NH1 2.53Å; C15-R19 PolarHBondContact O-N 2.95Å; E16-R19 PolarHBondContact O-N 3.39Å; L17-R19 VanDerWaalsContact C-N 3.35Å; L17-R19 PolarHBondContact O-N 2.98Å; R19-A22 PolarHBondContact O-N 3.22Å; R19-S23 VanDerWaalsContact O-CB 3.22Å; R19-S23 WeakPolarHBondContact O-CB 3.4Å; R19-S23 PolarHBondContact O-N 3.2Å; R19-S23 PolarHBondContact O-OG 3.18Å
20	I	96.5	Very high	88	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.062	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-47.7	179.9	-68.7	161.9	0	0	0	110.6	E16 L17 A22 S23 Y24 R30 R33 I34	E16-I20 HydrophobicContact CG-CD1 3.88Å; E16-I20 HydrophobicContact CG-CG1 4.47Å; E16-I20 WeakPolarHBondContact O-CG1 3.38Å; E16-I20 PolarHBondContact O-N 2.76Å; L17-I20 PolarHBondContact O-N 2.87Å; I20-A22 VanDerWaalsContact C-N 3.31Å; I20-A22 PolarHBondContact O-N 2.97Å; I20-S23 PolarHBondContact O-N 2.91Å; I20-Y24 HydrophobicContact CB-CD2 4.47Å; I20-Y24 HydrophobicContact CG2-CD2 4.12Å; I20-Y24 WeakPolarHBondContact O-CD2 3.4Å; I20-Y24 PolarHBondContact O-N 2.98Å; I20-Y24 VanDerWaalsContact O-N 3.12Å; I20-R30 HydrophobicContact CG2-CG 4.22Å; I20-R33 HydrophobicContact CD1-CB 3.93Å; I20-R33 HydrophobicContact CG1-CB 4.12Å; I20-R33 HydrophobicContact CG2-CB 3.69Å; I20-I34 HydrophobicContact CB-CD1 3.89Å; I20-I34 HydrophobicContact CD1-CD1 4.31Å; I20-I34 HydrophobicContact CG2-CD1 3.61Å; I20-I34 HydrophobicContact CG2-CG1 3.83Å
21	I	96.8	Very high	90.2	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-58.8	-43.1	179.3	-66.8	-57.3	0	0	0	111.3	L17 R30 I34 F79 D82 Y83	L17-I21 WeakPolarHBondContact O-CG1 3.35Å; L17-I21 PolarHBondContact O-N 3.16Å; I21-R30 HydrophobicContact CD1-CG 4.1Å; I21-R30 PolarHBondContact O-NH2 3.2Å; I21-I34 HydrophobicContact CD1-CD1 3.89Å; I21-I34 HydrophobicContact CD1-CG1 4.18Å; I21-I34 HydrophobicContact CG1-CD1 4.18Å; I21-F79 HydrophobicContact CB-CD2 4.06Å; I21-F79 HydrophobicContact CB-CE2 4.34Å; I21-F79 HydrophobicContact CG1-CD2 3.83Å; I21-F79 HydrophobicContact CG1-CE2 3.7Å; I21-F79 HydrophobicContact CG2-CD2 4.21Å; I21-D82 HydrophobicContact CD1-CB 4.17Å; I21-D82 HydrophobicContact CG2-CB 3.65Å; I21-Y83 HydrophobicContact CD1-CD2 4.48Å
22	A	94.8	Very high	92.4	Very high	58 Å²	58	42 Å²	42	48%	0.479	24%	0.24	S	C	.	.	H	α-helix	trans	-72.8	-30.6	179.4	0	0	0	0	0	114.4	S18 R19 I20	S18-A22 PolarHBondContact O-N 2.69Å; R19-A22 PolarHBondContact O-N 3.22Å; I20-A22 VanDerWaalsContact C-N 3.31Å; I20-A22 PolarHBondContact O-N 2.97Å
23	S	95	Very high	94	Very high	83 Å²	83	43.4 Å²	43.4	58%	0.58	24%	0.239	S	C	*	.	H	α-helix	trans	-98.7	-18.2	-167.5	-49.5	0	0	0	0	114.3	R19 I20	R19-S23 VanDerWaalsContact O-CB 3.22Å; R19-S23 WeakPolarHBondContact O-CB 3.4Å; R19-S23 PolarHBondContact O-N 3.2Å; R19-S23 PolarHBondContact O-OG 3.18Å; I20-S23 PolarHBondContact O-N 2.91Å
24	Y	96.4	Very high	95.3	Very high	83 Å²	83	40.2 Å²	40.2	33%	0.325	21%	0.206	S	C	.	.	S	Bend	trans	-119.6	140.2	-173.5	-66.4	-83	0	0	0	112.3	I20 P29 R30 R33	I20-Y24 HydrophobicContact CB-CD2 4.47Å; I20-Y24 HydrophobicContact CG2-CD2 4.12Å; I20-Y24 WeakPolarHBondContact O-CD2 3.4Å; I20-Y24 PolarHBondContact O-N 2.98Å; I20-Y24 VanDerWaalsContact O-N 3.12Å; Y24-P29 HydrophobicContact CD1-CB 4.46Å; Y24-R30 VanDerWaalsContact O-CZ 3.29Å; Y24-R30 PolarHBondContact O-NE 3.44Å; Y24-R30 PolarHBondContact O-NH2 3.41Å; Y24-R33 VanDerWaalsContact CZ-CD 3.41Å; Y24-R33 PolarHBondContact OH-NE 3.45Å; Y24-R33 VanDerWaalsContact OH-NE 3.16Å
25	P	95.9	Very high	96.1	Very high	83 Å²	83	36.9 Å²	36.9	54%	0.539	19%	0.193	S	C	.	.			trans	-68.5	157.8	177.8	30.7	-36.2	0	0	0	111.5	P29 R30	P25-P29 HydrophobicContact CG-CB 4.14Å; P25-P29 HydrophobicContact CG-CG 4.22Å; P25-R30 WeakPolarHBondContact O-CB 3.44Å
26	K	96.2	Very high	96.5	Very high	125 Å²	125	39.1 Å²	39.1	54%	0.543	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	142.7	175	-176.1	-179.4	178.1	-177.5	0	111.3	Y85	K26-Y85 HydrophobicContact CD-CE1 4.24Å; K26-Y85 WeakPolarHBondContact CE-OH 3.28Å; K26-Y85 HydrophobicContact CG-CD1 4.22Å; K26-Y85 HydrophobicContact CG-CE1 3.71Å
27	G	96.9	Very high	96.7	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.7	-157.5	180	0	0	0	0	0	112.8	P29 R30 T31 Y217	G27-P29 VanDerWaalsContact C-CD 3.41Å; G27-R30 PolarHBondContact O-N 3.02Å; G27-R30 VanDerWaalsContact O-N 3.12Å; G27-T31 PolarHBondContact O-N 3.17Å; G27-T31 PolarHBondContact O-OG1 3.24Å; G27-Y217 VanDerWaalsContact CA-O 3.25Å; G27-Y217 WeakPolarHBondContact CA-O 3.43Å
28	A	98.1	Very high	96.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-54	-39.7	-175.2	0	0	0	0	0	114.8	R30 T31 L32 C214 N218 V271	A28-R30 VanDerWaalsContact C-N 3.26Å; A28-R30 PolarHBondContact O-N 3.3Å; A28-T31 PolarHBondContact O-N 3.08Å; A28-L32 HydrophobicContact CB-CD1 4.16Å; A28-L32 VanDerWaalsContact O-CB 3.31Å; A28-L32 WeakPolarHBondContact O-CB 3.27Å; A28-L32 WeakPolarHBondContact O-CG 3.22Å; A28-L32 PolarHBondContact O-N 3.39Å; A28-L32 VanDerWaalsContact O-N 3.08Å; A28-C214 HydrophobicContact CB-CB 4.27Å; A28-N218 VanDerWaalsContact CB-OD1 3.28Å; A28-N218 WeakPolarHBondContact CB-OD1 3.46Å; A28-N218 PolarHBondContact N-OD1 3.38Å; A28-V271 HydrophobicContact CB-CG2 4.44Å; A28-V271 WeakPolarHBondContact CB-O 3.02Å
29	P	97.9	Very high	96.8	Very high	16 Å²	16	40 Å²	40	10%	0.104	20%	0.204	C	C	.	.	H	α-helix	trans	-54.7	-40.1	177.4	-27.2	34.8	0	0	0	113.7	Y24 P25 G27 R33 V271	Y24-P29 HydrophobicContact CD1-CB 4.46Å; P25-P29 HydrophobicContact CG-CB 4.14Å; P25-P29 HydrophobicContact CG-CG 4.22Å; G27-P29 VanDerWaalsContact C-CD 3.41Å; P29-R33 VanDerWaalsContact O-CD 3.31Å; P29-R33 WeakPolarHBondContact O-CD 3.28Å; P29-R33 WeakPolarHBondContact O-CG 3.47Å; P29-R33 PolarHBondContact O-NH1 3.1Å; P29-V271 HydrophobicContact CB-CG2 4.4Å; P29-V271 HydrophobicContact CG-CG2 3.93Å
30	R	98	Very high	96.8	Very high	23 Å²	23	44.4 Å²	44.4	9%	0.087	23%	0.231	C	C	.	.	H	α-helix	trans	-84.1	-51.3	178.7	-177.9	-169.6	-66.5	-175.7	-6.2	111.4	I20 I21 Y24 P25 G27 A28 L32 R33 I34 D82 C86	I20-R30 HydrophobicContact CG2-CG 4.22Å; I21-R30 HydrophobicContact CD1-CG 4.1Å; I21-R30 PolarHBondContact O-NH2 3.2Å; Y24-R30 VanDerWaalsContact O-CZ 3.29Å; Y24-R30 PolarHBondContact O-NE 3.44Å; Y24-R30 PolarHBondContact O-NH2 3.41Å; P25-R30 WeakPolarHBondContact O-CB 3.44Å; G27-R30 PolarHBondContact O-N 3.02Å; G27-R30 VanDerWaalsContact O-N 3.12Å; A28-R30 VanDerWaalsContact C-N 3.26Å; A28-R30 PolarHBondContact O-N 3.3Å; R30-L32 PolarHBondContact O-N 2.79Å; R30-R33 PolarHBondContact O-N 3.42Å; R30-R33 VanDerWaalsContact O-N 3.11Å; R30-I34 HydrophobicContact CG-CG1 4.43Å; R30-I34 PolarHBondContact O-N 2.94Å; R30-D82 IonicContact NH1-OD1 3.73Å; R30-D82 PolarHBondContact NH1-OD1 3.41Å; R30-D82 IonicContact NH1-OD2 2.76Å; R30-C86 VanDerWaalsContact CD-SG 3.59Å
31	T	98.3	Very high	96.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-39.2	-170.6	-54.9	0	0	0	0	112.7	G27 A28 R33 I34 E35 C86 Q89 I90 Y217	G27-T31 PolarHBondContact O-N 3.17Å; G27-T31 PolarHBondContact O-OG1 3.24Å; A28-T31 PolarHBondContact O-N 3.08Å; T31-R33 VanDerWaalsContact C-N 3.28Å; T31-R33 PolarHBondContact O-N 2.86Å; T31-I34 PolarHBondContact O-N 3.29Å; T31-E35 WeakPolarHBondContact O-CB 3.37Å; T31-E35 PolarHBondContact O-N 3.41Å; T31-C86 HydrophobicContact CG2-CB 4.32Å; T31-Q89 HydrophobicContact CG2-CB 3.9Å; T31-Q89 PolarHBondContact OG1-OE1 3.17Å; T31-I90 HydrophobicContact CG2-CD1 4.21Å; T31-I90 HydrophobicContact CG2-CG1 3.75Å; T31-Y217 HydrophobicContact CG2-CD1 4Å; T31-Y217 HydrophobicContact CG2-CD2 3.55Å; T31-Y217 HydrophobicContact CG2-CE1 4.05Å; T31-Y217 HydrophobicContact CG2-CE2 3.58Å; T31-Y217 HydrophobicContact CG2-CG 3.76Å
32	L	97.9	Very high	96.4	Very high	38 Å²	38	52 Å²	52	20%	0.199	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-36.1	175.1	-72.8	169	0	0	0	112.6	A28 R30 N36 K213 Y217	A28-L32 HydrophobicContact CB-CD1 4.16Å; A28-L32 VanDerWaalsContact O-CB 3.31Å; A28-L32 WeakPolarHBondContact O-CB 3.27Å; A28-L32 WeakPolarHBondContact O-CG 3.22Å; A28-L32 PolarHBondContact O-N 3.39Å; A28-L32 VanDerWaalsContact O-N 3.08Å; R30-L32 PolarHBondContact O-N 2.79Å; L32-N36 WeakPolarHBondContact O-CB 3.5Å; L32-N36 VanDerWaalsContact O-CG 3.23Å; L32-N36 PolarHBondContact O-N 2.85Å; L32-N36 PolarHBondContact O-ND2 3.25Å; L32-K213 HydrophobicContact CD2-CB 3.92Å; L32-K213 HydrophobicContact CD2-CD 4.11Å; L32-Y217 HydrophobicContact CD2-CD2 4.15Å; L32-Y217 HydrophobicContact CD2-CE2 3.92Å; L32-Y217 HydrophobicContact CG-CD2 4.09Å; L32-Y217 HydrophobicContact CG-CE2 4.28Å
33	R	98.1	Very high	96.3	Very high	90 Å²	90	52.2 Å²	52.2	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-73.4	-40.8	179	-71.3	176.9	171.4	74.1	-2.8	111.3	I20 Y24 P29 R30 T31 N36 S37	I20-R33 HydrophobicContact CD1-CB 3.93Å; I20-R33 HydrophobicContact CG1-CB 4.12Å; I20-R33 HydrophobicContact CG2-CB 3.69Å; Y24-R33 VanDerWaalsContact CZ-CD 3.41Å; Y24-R33 PolarHBondContact OH-NE 3.45Å; Y24-R33 VanDerWaalsContact OH-NE 3.16Å; P29-R33 VanDerWaalsContact O-CD 3.31Å; P29-R33 WeakPolarHBondContact O-CD 3.28Å; P29-R33 WeakPolarHBondContact O-CG 3.47Å; P29-R33 PolarHBondContact O-NH1 3.1Å; R30-R33 PolarHBondContact O-N 3.42Å; R30-R33 VanDerWaalsContact O-N 3.11Å; T31-R33 VanDerWaalsContact C-N 3.28Å; T31-R33 PolarHBondContact O-N 2.86Å; R33-N36 PolarHBondContact O-N 3.04Å; R33-S37 WeakPolarHBondContact O-CB 3.46Å; R33-S37 PolarHBondContact O-N 3.06Å
34	I	97.9	Very high	96.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-50	171.1	-65.4	-61.6	0	0	0	109.9	L17 I20 I21 R30 T31 N36 S37 L38 Y83 C86 I90	L17-I34 HydrophobicContact CD2-CD1 3.86Å; I20-I34 HydrophobicContact CB-CD1 3.89Å; I20-I34 HydrophobicContact CD1-CD1 4.31Å; I20-I34 HydrophobicContact CG2-CD1 3.61Å; I20-I34 HydrophobicContact CG2-CG1 3.83Å; I21-I34 HydrophobicContact CD1-CD1 3.89Å; I21-I34 HydrophobicContact CD1-CG1 4.18Å; I21-I34 HydrophobicContact CG1-CD1 4.18Å; R30-I34 HydrophobicContact CG-CG1 4.43Å; R30-I34 PolarHBondContact O-N 2.94Å; T31-I34 PolarHBondContact O-N 3.29Å; I34-N36 VanDerWaalsContact C-N 3.32Å; I34-N36 PolarHBondContact O-N 3.45Å; I34-S37 PolarHBondContact O-N 3.04Å; I34-S37 VanDerWaalsContact O-N 3.13Å; I34-L38 HydrophobicContact CG2-CD1 4.1Å; I34-L38 HydrophobicContact CG2-CG 4.33Å; I34-L38 WeakPolarHBondContact O-CG 3.18Å; I34-L38 PolarHBondContact O-N 3.16Å; I34-Y83 HydrophobicContact CD1-CD2 4.23Å; I34-Y83 HydrophobicContact CD1-CE2 4.36Å; I34-Y83 HydrophobicContact CG2-CD2 4.24Å; I34-Y83 HydrophobicContact CG2-CE2 3.8Å; I34-C86 HydrophobicContact CB-CB 4.19Å; I34-C86 HydrophobicContact CG1-CB 4.14Å; I34-C86 HydrophobicContact CG2-CB 4.03Å; I34-I90 HydrophobicContact CG2-CD1 4.01Å
35	E	97.8	Very high	95.9	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-57.4	-44.7	178.6	-162	-163.6	165.5	0	0	111.9	T31 L38 R39 L50 I90 K213 Y217	T31-E35 WeakPolarHBondContact O-CB 3.37Å; T31-E35 PolarHBondContact O-N 3.41Å; E35-L38 PolarHBondContact O-N 3.1Å; E35-R39 VanDerWaalsContact CD-NH2 3.32Å; E35-R39 WeakPolarHBondContact O-CB 3.31Å; E35-R39 PolarHBondContact O-N 2.97Å; E35-R39 IonicContact OE1-NH2 3.1Å; E35-R39 PolarHBondContact OE1-NH2 3.12Å; E35-R39 IonicContact OE2-NH2 2.75Å; E35-L50 HydrophobicContact CG-CD2 3.55Å; E35-I90 HydrophobicContact CB-CD1 3.74Å; E35-I90 HydrophobicContact CB-CG1 4.04Å; E35-I90 HydrophobicContact CG-CD1 4.1Å; E35-I90 HydrophobicContact CG-CG1 4.11Å; E35-I90 HydrophobicContact CG-CG2 4.06Å; E35-K213 IonicContact OE1-NZ 3.51Å; E35-K213 PolarHBondContact OE1-NZ 2.95Å; E35-K213 WeakPolarHBondContact OE2-CE 3.44Å; E35-K213 IonicContact OE2-NZ 2.79Å; E35-K213 PolarHBondContact OE2-NZ 3.14Å; E35-Y217 PolarHBondContact OE2-OH 3.05Å
36	N	96.8	Very high	95.8	Very high	69 Å²	69	49.9 Å²	49.9	37%	0.369	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-38.9	177.1	-74.2	-26.2	0	0	0	112.6	L32 R33 I34 L38 R39 N40	L32-N36 WeakPolarHBondContact O-CB 3.5Å; L32-N36 VanDerWaalsContact O-CG 3.23Å; L32-N36 PolarHBondContact O-N 2.85Å; L32-N36 PolarHBondContact O-ND2 3.25Å; R33-N36 PolarHBondContact O-N 3.04Å; I34-N36 VanDerWaalsContact C-N 3.32Å; I34-N36 PolarHBondContact O-N 3.45Å; N36-L38 VanDerWaalsContact C-N 3.35Å; N36-R39 PolarHBondContact O-N 2.89Å; N36-R39 PolarHBondContact OD1-NH1 2.85Å; N36-R39 VanDerWaalsContact OD1-NH1 3.13Å; N36-N40 WeakPolarHBondContact O-CB 3.33Å; N36-N40 PolarHBondContact O-N 3.27Å; N36-N40 VanDerWaalsContact O-N 3.1Å; N36-N40 PolarHBondContact O-ND2 3.18Å
37	S	96.5	Very high	95.7	Very high	11 Å²	11	46 Å²	46	8%	0.077	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-39.6	175.5	-174.3	0	0	0	0	111.3	E16 L17 R33 I34 N40 S41	E16-S37 VanDerWaalsContact CD-OG 3.26Å; E16-S37 PolarHBondContact OE2-OG 3.46Å; L17-S37 WeakPolarHBondContact CD2-OG 3.4Å; R33-S37 WeakPolarHBondContact O-CB 3.46Å; R33-S37 PolarHBondContact O-N 3.06Å; I34-S37 PolarHBondContact O-N 3.04Å; I34-S37 VanDerWaalsContact O-N 3.13Å; S37-N40 PolarHBondContact O-N 3.49Å; S37-S41 PolarHBondContact O-N 3.36Å
38	L	96.4	Very high	95.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-47.4	174	-68.6	179.7	0	0	0	112.4	I34 E35 N36 N40 S41 I46 L50 Y83 I87 I90	I34-L38 HydrophobicContact CG2-CD1 4.1Å; I34-L38 HydrophobicContact CG2-CG 4.33Å; I34-L38 WeakPolarHBondContact O-CG 3.18Å; I34-L38 PolarHBondContact O-N 3.16Å; E35-L38 PolarHBondContact O-N 3.1Å; N36-L38 VanDerWaalsContact C-N 3.35Å; L38-N40 PolarHBondContact O-N 3.39Å; L38-S41 VanDerWaalsContact O-CB 3.27Å; L38-S41 WeakPolarHBondContact O-CB 3.38Å; L38-S41 PolarHBondContact O-N 2.76Å; L38-I46 HydrophobicContact CD2-CG2 3.64Å; L38-I46 WeakPolarHBondContact CD2-O 3.5Å; L38-L50 HydrophobicContact CB-CD1 4.47Å; L38-L50 HydrophobicContact CB-CD2 3.72Å; L38-L50 HydrophobicContact CB-CG 3.82Å; L38-L50 HydrophobicContact CD1-CD2 4.35Å; L38-Y83 WeakPolarHBondContact CD2-OH 3.44Å; L38-I87 HydrophobicContact CD1-CD1 3.66Å; L38-I90 HydrophobicContact CD1-CD1 4.14Å
39	R	95.4	Very high	95.2	Very high	104 Å²	104	50.4 Å²	50.4	39%	0.392	25%	0.245	S	C	.	.	H	α-helix	trans	-56.1	-40.7	177.5	-167.2	-179.7	-61.5	133	8.6	112.1	E35 N36 Q47 L50	E35-R39 VanDerWaalsContact CD-NH2 3.32Å; E35-R39 WeakPolarHBondContact O-CB 3.31Å; E35-R39 PolarHBondContact O-N 2.97Å; E35-R39 IonicContact OE1-NH2 3.1Å; E35-R39 PolarHBondContact OE1-NH2 3.12Å; E35-R39 IonicContact OE2-NH2 2.75Å; N36-R39 PolarHBondContact O-N 2.89Å; N36-R39 PolarHBondContact OD1-NH1 2.85Å; N36-R39 VanDerWaalsContact OD1-NH1 3.13Å; R39-Q47 PolarHBondContact O-NE2 2.89Å; R39-L50 HydrophobicContact CB-CD1 4.15Å
40	N	94.6	Very high	95	Very high	127 Å²	127	51 Å²	51	68%	0.679	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	1.7	-179.3	-63.6	-49.2	0	0	0	113.9	N36 S37 L38 K42	N36-N40 WeakPolarHBondContact O-CB 3.33Å; N36-N40 PolarHBondContact O-N 3.27Å; N36-N40 VanDerWaalsContact O-N 3.1Å; N36-N40 PolarHBondContact O-ND2 3.18Å; S37-N40 PolarHBondContact O-N 3.49Å; L38-N40 PolarHBondContact O-N 3.39Å; N40-K42 PolarHBondContact O-N 3.04Å
41	S	93.6	Very high	94.6	Very high	19 Å²	19	54.4 Å²	54.4	13%	0.133	27%	0.266	C	S	.	.			trans	-67.9	128.2	178.9	177.3	0	0	0	0	111.1	S37 L38 N43	S37-S41 PolarHBondContact O-N 3.36Å; L38-S41 VanDerWaalsContact O-CB 3.27Å; L38-S41 WeakPolarHBondContact O-CB 3.38Å; L38-S41 PolarHBondContact O-N 2.76Å; S41-N43 VanDerWaalsContact C-N 3.31Å; S41-N43 PolarHBondContact OG-N 3Å; S41-N43 VanDerWaalsContact OG-N 3.16Å; S41-N43 PolarHBondContact OG-O 3.4Å; S41-N43 VanDerWaalsContact OG-O 3.04Å
42	K	91.4	Very high	94.1	Very high	161 Å²	161	55.3 Å²	55.3	70%	0.7	27%	0.271	S	S	*	.	S	Bend	trans	-73.8	-23.2	170.5	-64	-177.3	176.3	-177.6	0	112.9	Y2 N40 K44	Y2-K42 PolarHBondContact OH-NZ 2.87Å; N40-K42 PolarHBondContact O-N 3.04Å; K42-K44 PolarHBondContact O-N 3.11Å
43	N	92.6	Very high	93.2	Very high	62 Å²	62	55.7 Å²	55.7	33%	0.332	28%	0.284	S	S	.	.			trans	-82	115.4	176.4	-179.9	-42.9	0	0	0	108.8	S41 S45 I46 Q47	S41-N43 VanDerWaalsContact C-N 3.31Å; S41-N43 PolarHBondContact OG-N 3Å; S41-N43 VanDerWaalsContact OG-N 3.16Å; S41-N43 PolarHBondContact OG-O 3.4Å; S41-N43 VanDerWaalsContact OG-O 3.04Å; N43-S45 WeakPolarHBondContact OD1-CA 3.33Å; N43-S45 WeakPolarHBondContact OD1-CB 3.43Å; N43-S45 PolarHBondContact OD1-N 3.34Å; N43-I46 HydrophobicContact CB-CB 4.21Å; N43-I46 HydrophobicContact CB-CD1 4.06Å; N43-I46 HydrophobicContact CB-CG1 4.22Å; N43-I46 PolarHBondContact O-N 3Å; N43-I46 PolarHBondContact OD1-N 2.95Å; N43-I46 VanDerWaalsContact OD1-N 3.1Å; N43-Q47 PolarHBondContact O-N 3.23Å
44	K	92.2	Very high	92.1	Very high	139 Å²	139	62 Å²	62	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-63.9	-41.4	-177.8	-70.1	-65.9	-179.3	-178.9	0	113.2	K42 I46 Q47 N48	K42-K44 PolarHBondContact O-N 3.11Å; K44-I46 PolarHBondContact O-N 2.89Å; K44-Q47 PolarHBondContact O-N 2.89Å; K44-Q47 VanDerWaalsContact O-N 3.14Å; K44-N48 PolarHBondContact O-N 3.09Å; K44-N48 PolarHBondContact O-OD1 2.85Å; K44-N48 VanDerWaalsContact O-OD1 3.12Å
45	S	91.7	Very high	90.7	Very high	57 Å²	57	68.1 Å²	68.1	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-60.6	-32.7	176.9	-50.7	0	0	0	0	112.4	N43 H61	N43-S45 WeakPolarHBondContact OD1-CA 3.33Å; N43-S45 WeakPolarHBondContact OD1-CB 3.43Å; N43-S45 PolarHBondContact OD1-N 3.34Å; S45-H61 PolarHBondContact O-CE1 2.99Å; S45-H61 VanDerWaalsContact O-CE1 3.23Å; S45-H61 PolarHBondContact O-ND1 2.92Å
46	I	93.1	Very high	89.8	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.015	38%	0.377	C	S	.	.	H	α-helix	trans	-77.6	-45.6	172.8	-64.6	177.5	0	0	0	110.8	L17 L38 N43 K44 N48 G49 H61 L64 V65 A68 K69	L17-I46 HydrophobicContact CD1-CG2 4.44Å; L38-I46 HydrophobicContact CD2-CG2 3.64Å; L38-I46 WeakPolarHBondContact CD2-O 3.5Å; N43-I46 HydrophobicContact CB-CB 4.21Å; N43-I46 HydrophobicContact CB-CD1 4.06Å; N43-I46 HydrophobicContact CB-CG1 4.22Å; N43-I46 PolarHBondContact O-N 3Å; N43-I46 PolarHBondContact OD1-N 2.95Å; N43-I46 VanDerWaalsContact OD1-N 3.1Å; K44-I46 PolarHBondContact O-N 2.89Å; I46-N48 PolarHBondContact O-N 3.13Å; I46-N48 VanDerWaalsContact O-N 3.16Å; I46-G49 PolarHBondContact O-N 3.34Å; I46-H61 PolarHBondContact O-CE1 3.31Å; I46-H61 VanDerWaalsContact O-CE1 3.27Å; I46-L64 HydrophobicContact CG1-CD2 4.18Å; I46-V65 HydrophobicContact CG1-CG2 4.14Å; I46-V65 HydrophobicContact CG2-CG2 4.43Å; I46-A68 HydrophobicContact CD1-CB 4.16Å; I46-K69 HydrophobicContact CD1-CD 4.07Å; I46-K69 HydrophobicContact CD1-CG 3.85Å
47	Q	94.4	Very high	89.3	Confident	45 Å²	45	72 Å²	72	21%	0.21	38%	0.379	C	S	.	.	H	α-helix	trans	-56.4	-32.7	178.7	-176.6	174.3	61.1	0	0	112.5	R39 N43 K44 G49 L50	R39-Q47 PolarHBondContact O-NE2 2.89Å; N43-Q47 PolarHBondContact O-N 3.23Å; K44-Q47 PolarHBondContact O-N 2.89Å; K44-Q47 VanDerWaalsContact O-N 3.14Å; Q47-G49 PolarHBondContact O-N 3.39Å; Q47-L50 HydrophobicContact CG-CD1 4.09Å; Q47-L50 WeakPolarHBondContact O-CG 3.44Å; Q47-L50 PolarHBondContact O-N 2.97Å; Q47-L50 VanDerWaalsContact O-N 3.1Å
48	N	93	Very high	89.1	Confident	93 Å²	93	72 Å²	72	50%	0.497	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-56.7	-16.4	175.6	-71.3	-4.7	0	0	0	113.8	K44 I46 L50 L51 L52	K44-N48 PolarHBondContact O-N 3.09Å; K44-N48 PolarHBondContact O-OD1 2.85Å; K44-N48 VanDerWaalsContact O-OD1 3.12Å; I46-N48 PolarHBondContact O-N 3.13Å; I46-N48 VanDerWaalsContact O-N 3.16Å; N48-L50 PolarHBondContact O-N 3.48Å; N48-L51 CarbonylContact O-C 3.46Å; N48-L51 VanDerWaalsContact O-C 3.23Å; N48-L51 PolarHBondContact O-N 3.21Å; N48-L52 WeakPolarHBondContact O-CD2 3.43Å; N48-L52 PolarHBondContact O-N 3.39Å
49	G	92.5	Very high	89	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-61.8	-17.6	173.6	0	0	0	0	0	114.7	I46 Q47 H61 N91	I46-G49 PolarHBondContact O-N 3.34Å; Q47-G49 PolarHBondContact O-N 3.39Å; G49-H61 VanDerWaalsContact CA-CE1 3.42Å; G49-H61 WeakPolarHBondContact CA-CE1 3.37Å; G49-H61 VanDerWaalsContact CA-NE2 3.32Å; G49-H61 WeakPolarHBondContact CA-NE2 3.35Å; G49-H61 PolarHBondContact N-CE1 3.14Å; G49-H61 VanDerWaalsContact N-CE1 3.28Å; G49-N91 PolarHBondContact O-ND2 3.42Å
50	L	92.9	Very high	89	Confident	29 Å²	29	75.5 Å²	75.5	15%	0.152	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-66.9	-37.4	175.3	-68.6	167	0	0	0	113.1	E35 L38 R39 Q47 N48 I90	E35-L50 HydrophobicContact CG-CD2 3.55Å; L38-L50 HydrophobicContact CB-CD1 4.47Å; L38-L50 HydrophobicContact CB-CD2 3.72Å; L38-L50 HydrophobicContact CB-CG 3.82Å; L38-L50 HydrophobicContact CD1-CD2 4.35Å; R39-L50 HydrophobicContact CB-CD1 4.15Å; Q47-L50 HydrophobicContact CG-CD1 4.09Å; Q47-L50 WeakPolarHBondContact O-CG 3.44Å; Q47-L50 PolarHBondContact O-N 2.97Å; Q47-L50 VanDerWaalsContact O-N 3.1Å; N48-L50 PolarHBondContact O-N 3.48Å; L50-I90 HydrophobicContact CD2-CG2 4.35Å; L50-I90 WeakPolarHBondContact O-CG2 3.32Å
51	L	90.4	Very high	89	Confident	94 Å²	94	69.8 Å²	69.8	49%	0.492	38%	0.375	S	S	.	.	S	Bend	trans	-151.6	93.5	179.4	-175.7	63.6	0	0	0	107.7	N48 N91 W94	N48-L51 CarbonylContact O-C 3.46Å; N48-L51 VanDerWaalsContact O-C 3.23Å; N48-L51 PolarHBondContact O-N 3.21Å; L51-N91 WeakPolarHBondContact CA-OD1 3.46Å; L51-W94 HydrophobicContact CD1-CB 3.87Å
52	L	87.3	Confident	89.2	Confident	19 Å²	19	69.2 Å²	69.2	10%	0.099	37%	0.37	C	S	.	.			trans	-70.8	127.4	173.6	-62.2	175.2	0	0	0	107.5	N48 T56 A58 H61 I87 N91	N48-L52 WeakPolarHBondContact O-CD2 3.43Å; N48-L52 PolarHBondContact O-N 3.39Å; L52-T56 HydrophobicContact CD2-CG2 3.87Å; L52-A58 HydrophobicContact CD1-CB 3.8Å; L52-H61 HydrophobicContact CD1-CB 4.37Å; L52-H61 HydrophobicContact CD2-CB 3.87Å; L52-I87 HydrophobicContact CD1-CG2 3.74Å; L52-N91 WeakPolarHBondContact CB-OD1 3.41Å; L52-N91 WeakPolarHBondContact CG-OD1 3.1Å; L52-N91 PolarHBondContact N-OD1 3.36Å
53	G	78.3	Confident	89.4	Confident	46 Å²	46	69.7 Å²	69.7	47%	0.474	37%	0.367	S	S	.	.			trans	-63	157.5	172.4	0	0	0	0	0	110.8	C55 T56	G53-C55 PolarHBondContact O-N 3.42Å; G53-T56 PolarHBondContact O-N 2.79Å
54	K	74.7	Confident	89.5	Confident	222 Å²	222	69.9 Å²	69.9	97%	0.965	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-29.5	-177.5	-66.5	-176.3	178.9	-179.5	0	114.9
55	C	69.3	Low	89.7	Confident	130 Å²	130	63.2 Å²	63.2	88%	0.878	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.2	-178.9	-53.8	0	0	0	0	114.5	G53	G53-C55 PolarHBondContact O-N 3.42Å
56	T	78.5	Confident	89.9	Confident	72 Å²	72	61.9 Å²	61.9	44%	0.442	33%	0.327	S	S	.	.			trans	-100.1	109	-176.4	-52.5	0	0	0	0	110.3	L52 G53	L52-T56 HydrophobicContact CD2-CG2 3.87Å; G53-T56 PolarHBondContact O-N 2.79Å
57	D	86.9	Confident	90	Very high	78 Å²	78	65.9 Å²	65.9	42%	0.417	36%	0.355	S	S	.	.			trans	-67.8	134.4	171.9	158.5	61.9	0	0	0	111.3	K59 S60 H61	D57-K59 VanDerWaalsContact C-N 3.27Å; D57-K59 PolarHBondContact O-N 2.98Å; D57-K59 PolarHBondContact OD1-N 3.16Å; D57-K59 VanDerWaalsContact OD2-CB 3.26Å; D57-K59 WeakPolarHBondContact OD2-CB 3.43Å; D57-K59 PolarHBondContact OD2-N 3.27Å; D57-S60 WeakPolarHBondContact O-CB 3.43Å; D57-S60 PolarHBondContact O-N 3.13Å; D57-S60 VanDerWaalsContact O-N 3.09Å; D57-S60 PolarHBondContact OD2-N 3.01Å; D57-S60 PolarHBondContact OD2-OG 3.12Å; D57-H61 PolarHBondContact O-N 3.24Å
58	A	92.5	Very high	89.9	Confident	13 Å²	13	65.7 Å²	65.7	11%	0.107	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-33.5	-178.2	0	0	0	0	0	112.6	L52 S60 H61 V62 L84 I87 N88	L52-A58 HydrophobicContact CD1-CB 3.8Å; A58-S60 VanDerWaalsContact C-N 3.31Å; A58-S60 PolarHBondContact O-N 2.9Å; A58-H61 WeakPolarHBondContact O-CB 3.39Å; A58-H61 PolarHBondContact O-N 3.34Å; A58-V62 VanDerWaalsContact O-CG2 3.29Å; A58-V62 WeakPolarHBondContact O-CG2 3.48Å; A58-V62 PolarHBondContact O-N 3.25Å; A58-L84 HydrophobicContact CB-CD1 3.51Å; A58-I87 HydrophobicContact CB-CG2 4.01Å; A58-N88 WeakPolarHBondContact CB-OD1 3.49Å
59	K	94.8	Very high	89.9	Confident	122 Å²	122	65.3 Å²	65.3	53%	0.53	36%	0.355	S	S	.	.	H	α-helix	trans	-66.6	-36.4	176.5	-55.5	176.8	179.1	174	0	111.4	D57 H61 V62 R63 L84	D57-K59 VanDerWaalsContact C-N 3.27Å; D57-K59 PolarHBondContact O-N 2.98Å; D57-K59 PolarHBondContact OD1-N 3.16Å; D57-K59 VanDerWaalsContact OD2-CB 3.26Å; D57-K59 WeakPolarHBondContact OD2-CB 3.43Å; D57-K59 PolarHBondContact OD2-N 3.27Å; K59-H61 VanDerWaalsContact C-N 3.34Å; K59-V62 WeakPolarHBondContact O-CB 3.15Å; K59-V62 PolarHBondContact O-N 3.12Å; K59-R63 WeakPolarHBondContact O-CG 3.35Å; K59-R63 PolarHBondContact O-N 3.19Å; K59-L84 HydrophobicContact CG-CD1 4.24Å; K59-L84 HydrophobicContact CG-CD2 3.93Å
60	S	94.4	Very high	89.9	Confident	55 Å²	55	73.5 Å²	73.5	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-40.4	175	-58.5	0	0	0	0	111.5	D57 A58 R63 L64	D57-S60 WeakPolarHBondContact O-CB 3.43Å; D57-S60 PolarHBondContact O-N 3.13Å; D57-S60 VanDerWaalsContact O-N 3.09Å; D57-S60 PolarHBondContact OD2-N 3.01Å; D57-S60 PolarHBondContact OD2-OG 3.12Å; A58-S60 VanDerWaalsContact C-N 3.31Å; A58-S60 PolarHBondContact O-N 2.9Å; S60-R63 PolarHBondContact O-N 2.97Å; S60-L64 PolarHBondContact O-N 3.02Å; S60-L64 VanDerWaalsContact O-N 3.12Å
61	H	95	Very high	89.8	Confident	7 Å²	7	72.8 Å²	72.8	3%	0.032	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-41.5	171.7	-178.2	77.7	0	0	0	112.6	S45 I46 G49 L52 D57 A58 K59 R63 L64 V65	S45-H61 PolarHBondContact O-CE1 2.99Å; S45-H61 VanDerWaalsContact O-CE1 3.23Å; S45-H61 PolarHBondContact O-ND1 2.92Å; I46-H61 PolarHBondContact O-CE1 3.31Å; I46-H61 VanDerWaalsContact O-CE1 3.27Å; G49-H61 VanDerWaalsContact CA-CE1 3.42Å; G49-H61 WeakPolarHBondContact CA-CE1 3.37Å; G49-H61 VanDerWaalsContact CA-NE2 3.32Å; G49-H61 WeakPolarHBondContact CA-NE2 3.35Å; G49-H61 PolarHBondContact N-CE1 3.14Å; G49-H61 VanDerWaalsContact N-CE1 3.28Å; L52-H61 HydrophobicContact CD1-CB 4.37Å; L52-H61 HydrophobicContact CD2-CB 3.87Å; D57-H61 PolarHBondContact O-N 3.24Å; A58-H61 WeakPolarHBondContact O-CB 3.39Å; A58-H61 PolarHBondContact O-N 3.34Å; K59-H61 VanDerWaalsContact C-N 3.34Å; H61-R63 PolarHBondContact O-N 3.16Å; H61-L64 WeakPolarHBondContact O-CB 3.12Å; H61-L64 PolarHBondContact O-N 3.5Å; H61-V65 WeakPolarHBondContact O-CG2 3.25Å; H61-V65 PolarHBondContact O-N 3.21Å
62	V	96.7	Very high	90	Very high	6 Å²	6	72.4 Å²	72.4	4%	0.036	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-45.5	175.9	173.3	0	0	0	0	111.7	A58 K59 L64 V65 I66 P80 Y83 L84	A58-V62 VanDerWaalsContact O-CG2 3.29Å; A58-V62 WeakPolarHBondContact O-CG2 3.48Å; A58-V62 PolarHBondContact O-N 3.25Å; K59-V62 WeakPolarHBondContact O-CB 3.15Å; K59-V62 PolarHBondContact O-N 3.12Å; V62-L64 VanDerWaalsContact C-N 3.32Å; V62-L64 PolarHBondContact O-N 2.74Å; V62-V65 PolarHBondContact O-N 2.87Å; V62-I66 HydrophobicContact CG1-CD1 3.74Å; V62-I66 HydrophobicContact CG1-CG1 4.42Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.23Å; V62-P80 HydrophobicContact CG1-CB 4.05Å; V62-Y83 HydrophobicContact CB-CD1 4.24Å; V62-Y83 HydrophobicContact CG1-CD1 4.17Å; V62-Y83 HydrophobicContact CG2-CD1 3.66Å; V62-Y83 HydrophobicContact CG2-CE1 4.18Å; V62-L84 HydrophobicContact CG2-CB 3.9Å; V62-L84 HydrophobicContact CG2-CD1 4.06Å
63	R	96.5	Very high	90.3	Very high	171 Å²	171	74.8 Å²	74.8	65%	0.645	40%	0.4	S	S	*	.	H	α-helix	trans	-60.1	-42.2	176.5	-68.4	173.9	-171.1	155.3	0.4	112.1	K59 S60 H61 V65 I66 S67	K59-R63 WeakPolarHBondContact O-CG 3.35Å; K59-R63 PolarHBondContact O-N 3.19Å; S60-R63 PolarHBondContact O-N 2.97Å; H61-R63 PolarHBondContact O-N 3.16Å; R63-V65 VanDerWaalsContact C-N 3.34Å; R63-V65 PolarHBondContact O-N 3.46Å; R63-I66 PolarHBondContact O-N 3.12Å; R63-S67 PolarHBondContact O-N 3.08Å; R63-S67 VanDerWaalsContact O-N 3.09Å
64	L	95	Very high	91.1	Very high	66 Å²	66	79.8 Å²	79.8	35%	0.346	42%	0.417	S	S	.	.	H	α-helix	trans	-58.8	-47	175.8	-175.9	155.5	0	0	0	110.9	I46 S60 H61 V62 S67 A68	I46-L64 HydrophobicContact CG1-CD2 4.18Å; S60-L64 PolarHBondContact O-N 3.02Å; S60-L64 VanDerWaalsContact O-N 3.12Å; H61-L64 WeakPolarHBondContact O-CB 3.12Å; H61-L64 PolarHBondContact O-N 3.5Å; V62-L64 VanDerWaalsContact C-N 3.32Å; V62-L64 PolarHBondContact O-N 2.74Å; L64-S67 PolarHBondContact O-N 2.91Å; L64-A68 HydrophobicContact CD2-CB 4.36Å; L64-A68 VanDerWaalsContact O-CB 3.22Å; L64-A68 WeakPolarHBondContact O-CB 3.42Å; L64-A68 PolarHBondContact O-N 3.19Å
65	V	95.7	Very high	91.9	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-64.9	-43.3	-179.2	173.3	0	0	0	0	111.6	L17 I46 H61 V62 R63 S67 A68 K69 I71 F79 Y83	L17-V65 HydrophobicContact CD1-CG1 3.59Å; I46-V65 HydrophobicContact CG1-CG2 4.14Å; I46-V65 HydrophobicContact CG2-CG2 4.43Å; H61-V65 WeakPolarHBondContact O-CG2 3.25Å; H61-V65 PolarHBondContact O-N 3.21Å; V62-V65 PolarHBondContact O-N 2.87Å; R63-V65 VanDerWaalsContact C-N 3.34Å; R63-V65 PolarHBondContact O-N 3.46Å; V65-S67 VanDerWaalsContact C-N 3.31Å; V65-S67 PolarHBondContact O-N 2.89Å; V65-A68 PolarHBondContact O-N 3.49Å; V65-K69 HydrophobicContact CG1-CG 4.36Å; V65-K69 VanDerWaalsContact O-CB 3.28Å; V65-K69 WeakPolarHBondContact O-CB 3.28Å; V65-K69 PolarHBondContact O-N 2.95Å; V65-I71 HydrophobicContact CG1-CD1 4.42Å; V65-F79 HydrophobicContact CG1-CZ 4.5Å; V65-Y83 HydrophobicContact CB-CE1 4.01Å; V65-Y83 HydrophobicContact CG1-CE1 4.05Å; V65-Y83 HydrophobicContact CG2-CE1 3.88Å; V65-Y83 WeakPolarHBondContact CG2-OH 3.24Å
66	I	96	Very high	93	Very high	29 Å²	29	67.7 Å²	67.7	15%	0.149	35%	0.353	C	S	.	.	H	α-helix	trans	-56.5	-48.2	176.9	-70.4	163.1	0	0	0	110.4	V62 R63 H70 I71 L73 F79 P80	V62-I66 HydrophobicContact CG1-CD1 3.74Å; V62-I66 HydrophobicContact CG1-CG1 4.42Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.23Å; R63-I66 PolarHBondContact O-N 3.12Å; I66-H70 PolarHBondContact O-N 2.62Å; I66-H70 VanDerWaalsContact O-N 3.08Å; I66-I71 HydrophobicContact CG2-CB 4.36Å; I66-I71 PolarHBondContact O-N 2.96Å; I66-L73 HydrophobicContact CD1-CD1 4.47Å; I66-L73 HydrophobicContact CD1-CD2 4.13Å; I66-L73 HydrophobicContact CG1-CD2 4.37Å; I66-L73 HydrophobicContact CG2-CD1 4.33Å; I66-L73 HydrophobicContact CG2-CD2 4.22Å; I66-L73 HydrophobicContact CG2-CG 4.27Å; I66-F79 HydrophobicContact CD1-CD1 4.3Å; I66-F79 HydrophobicContact CG1-CD1 3.86Å; I66-F79 HydrophobicContact CG1-CE1 3.83Å; I66-P80 HydrophobicContact CD1-CB 4.15Å; I66-P80 HydrophobicContact CD1-CG 3.86Å
67	S	95	Very high	93.9	Very high	86 Å²	86	68.5 Å²	68.5	60%	0.601	36%	0.36	S	S	*	.	H	α-helix	trans	-65.2	-52.8	178.2	-179.8	0	0	0	0	112	R63 L64 V65 K69 H70	R63-S67 PolarHBondContact O-N 3.08Å; R63-S67 VanDerWaalsContact O-N 3.09Å; L64-S67 PolarHBondContact O-N 2.91Å; V65-S67 VanDerWaalsContact C-N 3.31Å; V65-S67 PolarHBondContact O-N 2.89Å; S67-K69 PolarHBondContact O-N 3.2Å; S67-K69 VanDerWaalsContact O-N 3.17Å; S67-H70 PolarHBondContact O-N 3.43Å; S67-H70 VanDerWaalsContact O-N 3.17Å
68	A	92.9	Very high	94.3	Very high	42 Å²	42	70 Å²	70	35%	0.347	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-19.3	-175.5	0	0	0	0	0	114.2	I46 L64 V65	I46-A68 HydrophobicContact CD1-CB 4.16Å; L64-A68 HydrophobicContact CD2-CB 4.36Å; L64-A68 VanDerWaalsContact O-CB 3.22Å; L64-A68 WeakPolarHBondContact O-CB 3.42Å; L64-A68 PolarHBondContact O-N 3.19Å; V65-A68 PolarHBondContact O-N 3.49Å
69	K	92.3	Very high	94.5	Very high	84 Å²	84	69.5 Å²	69.5	37%	0.365	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	6.5	178.3	-65.3	-68	179.5	177.3	0	113.4	C15 I46 V65 S67 I71	C15-K69 HydrophobicContact CB-CB 4.31Å; C15-K69 HydrophobicContact CB-CD 4.32Å; I46-K69 HydrophobicContact CD1-CD 4.07Å; I46-K69 HydrophobicContact CD1-CG 3.85Å; V65-K69 HydrophobicContact CG1-CG 4.36Å; V65-K69 VanDerWaalsContact O-CB 3.28Å; V65-K69 WeakPolarHBondContact O-CB 3.28Å; V65-K69 PolarHBondContact O-N 2.95Å; S67-K69 PolarHBondContact O-N 3.2Å; S67-K69 VanDerWaalsContact O-N 3.17Å; K69-I71 VanDerWaalsContact C-N 3.27Å; K69-I71 HydrophobicContact CB-CD1 4.11Å; K69-I71 HydrophobicContact CB-CG1 3.86Å; K69-I71 PolarHBondContact O-N 2.88Å
70	H	92.3	Very high	94.7	Very high	172 Å²	172	65.5 Å²	65.5	80%	0.796	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	49.1	-179.5	-55.6	-69.5	0	0	0	112.4	I66 S67 D72	I66-H70 PolarHBondContact O-N 2.62Å; I66-H70 VanDerWaalsContact O-N 3.08Å; S67-H70 PolarHBondContact O-N 3.43Å; S67-H70 VanDerWaalsContact O-N 3.17Å; H70-D72 PolarHBondContact O-N 3.25Å
71	I	92.3	Very high	94.8	Very high	14 Å²	14	67.6 Å²	67.6	7%	0.072	36%	0.36	C	S	.	.			trans	-78.2	118.9	-178.3	-58.6	-179.8	0	0	0	108.6	V65 I66 K69 L73 F79	V65-I71 HydrophobicContact CG1-CD1 4.42Å; I66-I71 HydrophobicContact CG2-CB 4.36Å; I66-I71 PolarHBondContact O-N 2.96Å; K69-I71 VanDerWaalsContact C-N 3.27Å; K69-I71 HydrophobicContact CB-CD1 4.11Å; K69-I71 HydrophobicContact CB-CG1 3.86Å; K69-I71 PolarHBondContact O-N 2.88Å; I71-L73 HydrophobicContact CG2-CD2 4.39Å; I71-L73 PolarHBondContact O-N 3.42Å; I71-F79 HydrophobicContact CD1-CD1 3.95Å; I71-F79 HydrophobicContact CD1-CD2 4.2Å; I71-F79 HydrophobicContact CD1-CE1 3.35Å; I71-F79 HydrophobicContact CD1-CE2 3.62Å; I71-F79 HydrophobicContact CD1-CG 4.36Å; I71-F79 HydrophobicContact CD1-CZ 3.17Å; I71-F79 HydrophobicContact CG2-CB 4.37Å; I71-F79 HydrophobicContact CG2-CD1 4.06Å; I71-F79 HydrophobicContact CG2-CD2 4.24Å; I71-F79 HydrophobicContact CG2-CG 3.94Å
72	D	93.2	Very high	94.9	Very high	86 Å²	86	69.2 Å²	69.2	46%	0.46	37%	0.369	S	S	.	.			trans	-76.5	112.5	175.9	-173.7	-3.7	0	0	0	110.6	H70 N74 D75 Q76	H70-D72 PolarHBondContact O-N 3.25Å; D72-N74 VanDerWaalsContact C-N 3.31Å; D72-N74 WeakPolarHBondContact OD1-CB 3.37Å; D72-N74 PolarHBondContact OD1-N 3.35Å; D72-D75 HydrophobicContact CB-CB 4.12Å; D72-D75 PolarHBondContact O-N 3.14Å; D72-Q76 PolarHBondContact O-N 3.46Å
73	L	94.8	Very high	95	Very high	69 Å²	69	68.9 Å²	68.9	36%	0.361	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-14.9	179.9	-59.7	-175.6	0	0	0	113.1	I66 I71 Q76 P77 F79 P80	I66-L73 HydrophobicContact CD1-CD1 4.47Å; I66-L73 HydrophobicContact CD1-CD2 4.13Å; I66-L73 HydrophobicContact CG1-CD2 4.37Å; I66-L73 HydrophobicContact CG2-CD1 4.33Å; I66-L73 HydrophobicContact CG2-CD2 4.22Å; I66-L73 HydrophobicContact CG2-CG 4.27Å; I71-L73 HydrophobicContact CG2-CD2 4.39Å; I71-L73 PolarHBondContact O-N 3.42Å; L73-Q76 CarbonylContact O-C 3.53Å; L73-P77 WeakPolarHBondContact O-CA 3.09Å; L73-P77 VanDerWaalsContact O-N 3.14Å; L73-F79 HydrophobicContact CD2-CB 4.5Å; L73-P80 HydrophobicContact CD1-CG 4.35Å; L73-P80 HydrophobicContact CD2-CG 3.78Å
74	N	94	Very high	95	Very high	152 Å²	152	62.4 Å²	62.4	81%	0.813	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-39	170.8	-61.2	-44.3	0	0	0	110.4	D72	D72-N74 VanDerWaalsContact C-N 3.31Å; D72-N74 WeakPolarHBondContact OD1-CB 3.37Å; D72-N74 PolarHBondContact OD1-N 3.35Å
75	D	92.1	Very high	95.1	Very high	83 Å²	83	61.2 Å²	61.2	44%	0.444	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-35.3	174.7	177.8	57.2	0	0	0	112.3	R14 D72	R14-D75 IonicContact CZ-OD1 2.73Å; R14-D75 IonicContact CZ-OD2 3.85Å; R14-D75 IonicContact NE-OD2 3.75Å; R14-D75 PolarHBondContact NE-OD2 3.48Å; R14-D75 IonicContact NH2-OD1 3.22Å; R14-D75 PolarHBondContact NH2-OD1 2.93Å; R14-D75 IonicContact NH2-OD2 2.8Å; R14-D75 PolarHBondContact NH2-OD2 2.83Å; D72-D75 HydrophobicContact CB-CB 4.12Å; D72-D75 PolarHBondContact O-N 3.14Å
76	Q	92.9	Very high	95.2	Very high	15 Å²	15	61.2 Å²	61.2	7%	0.07	34%	0.336	C	S	.	.			trans	-130.4	71	-179.2	-59.8	-167.2	-51.8	0	0	113.4	S18 D72 L73 N78 F79	S18-Q76 PolarHBondContact O-NE2 3.25Å; S18-Q76 PolarHBondContact OG-NE2 3.04Å; S18-Q76 PolarHBondContact OG-OE1 3.38Å; D72-Q76 PolarHBondContact O-N 3.46Å; L73-Q76 CarbonylContact O-C 3.53Å; Q76-N78 PolarHBondContact O-N 3.26Å; Q76-F79 HydrophobicContact CB-CB 3.99Å; Q76-F79 VanDerWaalsContact O-CB 3.28Å; Q76-F79 WeakPolarHBondContact O-CB 3.31Å; Q76-F79 PolarHBondContact O-N 3Å
77	P	95.9	Very high	95.3	Very high	89 Å²	89	59.8 Å²	59.8	58%	0.578	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-29.7	-174.9	23.3	-34.3	0	0	0	113.7	L73 F79 P80	L73-P77 WeakPolarHBondContact O-CA 3.09Å; L73-P77 VanDerWaalsContact O-N 3.14Å; P77-F79 VanDerWaalsContact C-N 3.34Å; P77-P80 WeakPolarHBondContact O-CD 3.49Å
78	N	96.1	Very high	95.3	Very high	109 Å²	109	58.9 Å²	58.9	58%	0.583	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.6	179.6	-67.5	-28.1	0	0	0	113.8	Q76 P80 T81 D82	Q76-N78 PolarHBondContact O-N 3.26Å; N78-P80 VanDerWaalsContact C-CD 3.44Å; N78-T81 PolarHBondContact O-N 3.46Å; N78-D82 WeakPolarHBondContact O-CB 3.47Å; N78-D82 PolarHBondContact O-N 3.39Å
79	F	96.9	Very high	95.5	Very high	2 Å²	2	57 Å²	57	1%	0.009	30%	0.301	C	S	.	.	H	α-helix	trans	-51.3	-47.9	-176.8	180	-85.4	0	0	0	113.1	L17 I21 V65 I66 I71 L73 Q76 P77 T81 D82 Y83	L17-F79 HydrophobicContact CB-CE2 4.32Å; L17-F79 HydrophobicContact CB-CZ 4.39Å; I21-F79 HydrophobicContact CB-CD2 4.06Å; I21-F79 HydrophobicContact CB-CE2 4.34Å; I21-F79 HydrophobicContact CG1-CD2 3.83Å; I21-F79 HydrophobicContact CG1-CE2 3.7Å; I21-F79 HydrophobicContact CG2-CD2 4.21Å; V65-F79 HydrophobicContact CG1-CZ 4.5Å; I66-F79 HydrophobicContact CD1-CD1 4.3Å; I66-F79 HydrophobicContact CG1-CD1 3.86Å; I66-F79 HydrophobicContact CG1-CE1 3.83Å; I71-F79 HydrophobicContact CD1-CD1 3.95Å; I71-F79 HydrophobicContact CD1-CD2 4.2Å; I71-F79 HydrophobicContact CD1-CE1 3.35Å; I71-F79 HydrophobicContact CD1-CE2 3.62Å; I71-F79 HydrophobicContact CD1-CG 4.36Å; I71-F79 HydrophobicContact CD1-CZ 3.17Å; I71-F79 HydrophobicContact CG2-CB 4.37Å; I71-F79 HydrophobicContact CG2-CD1 4.06Å; I71-F79 HydrophobicContact CG2-CD2 4.24Å; I71-F79 HydrophobicContact CG2-CG 3.94Å; L73-F79 HydrophobicContact CD2-CB 4.5Å; Q76-F79 HydrophobicContact CB-CB 3.99Å; Q76-F79 VanDerWaalsContact O-CB 3.28Å; Q76-F79 WeakPolarHBondContact O-CB 3.31Å; Q76-F79 PolarHBondContact O-N 3Å; P77-F79 VanDerWaalsContact C-N 3.34Å; F79-T81 VanDerWaalsContact C-N 3.34Å; F79-T81 PolarHBondContact O-N 2.79Å; F79-D82 PolarHBondContact O-N 2.64Å; F79-Y83 HydrophobicContact CE1-CD1 4.18Å; F79-Y83 AromaticContact CE1-CG 3.96Å; F79-Y83 HydrophobicContact CE1-CG 3.96Å; F79-Y83 HydrophobicContact CE2-CD2 4.47Å; F79-Y83 HydrophobicContact CZ-CD1 4.26Å; F79-Y83 AromaticContact CZ-CD2 3.92Å; F79-Y83 HydrophobicContact CZ-CD2 3.92Å; F79-Y83 AromaticContact CZ-CG 3.74Å; F79-Y83 HydrophobicContact CZ-CG 3.74Å; F79-Y83 WeakPolarHBondContact O-CB 3.4Å; F79-Y83 PolarHBondContact O-N 3.17Å
80	P	97.8	Very high	95.8	Very high	38 Å²	38	53 Å²	53	25%	0.247	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-43.8	-177.1	-21.7	33.2	0	0	0	112.5	V62 I66 L73 P77 N78 L84	V62-P80 HydrophobicContact CG1-CB 4.05Å; I66-P80 HydrophobicContact CD1-CB 4.15Å; I66-P80 HydrophobicContact CD1-CG 3.86Å; L73-P80 HydrophobicContact CD1-CG 4.35Å; L73-P80 HydrophobicContact CD2-CG 3.78Å; P77-P80 WeakPolarHBondContact O-CD 3.49Å; N78-P80 VanDerWaalsContact C-CD 3.44Å; P80-L84 WeakPolarHBondContact O-CB 3.1Å; P80-L84 PolarHBondContact O-N 3.1Å
81	T	97.5	Very high	96	Very high	99 Å²	99	45.1 Å²	45.1	61%	0.607	25%	0.248	S	C	*	.	H	α-helix	trans	-70.8	-46.9	-178.3	-56.8	0	0	0	0	111.5	N78 F79 L84 Y85	N78-T81 PolarHBondContact O-N 3.46Å; F79-T81 VanDerWaalsContact C-N 3.34Å; F79-T81 PolarHBondContact O-N 2.79Å; T81-L84 PolarHBondContact O-N 2.94Å; T81-Y85 WeakPolarHBondContact O-CB 3.48Å; T81-Y85 PolarHBondContact O-N 3.23Å
82	D	97.9	Very high	96.1	Very high	41 Å²	41	44.7 Å²	44.7	22%	0.219	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-38.6	-178.9	-79.8	-35.4	0	0	0	112.3	I21 R30 N78 F79 Y85 C86	I21-D82 HydrophobicContact CD1-CB 4.17Å; I21-D82 HydrophobicContact CG2-CB 3.65Å; R30-D82 IonicContact NH1-OD1 3.73Å; R30-D82 PolarHBondContact NH1-OD1 3.41Å; R30-D82 IonicContact NH1-OD2 2.76Å; N78-D82 WeakPolarHBondContact O-CB 3.47Å; N78-D82 PolarHBondContact O-N 3.39Å; F79-D82 PolarHBondContact O-N 2.64Å; D82-Y85 WeakPolarHBondContact O-CB 3.36Å; D82-C86 PolarHBondContact O-N 3.48Å; D82-C86 PolarHBondContact O-SG 3.25Å
83	Y	97.8	Very high	96.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-43.8	176	-174.8	-108.8	0	0	0	111.2	L17 I21 I34 L38 V62 V65 F79 Y85 C86 I87	L17-Y83 HydrophobicContact CD1-CE2 4.02Å; L17-Y83 HydrophobicContact CD2-CE2 4.2Å; I21-Y83 HydrophobicContact CD1-CD2 4.48Å; I34-Y83 HydrophobicContact CD1-CD2 4.23Å; I34-Y83 HydrophobicContact CD1-CE2 4.36Å; I34-Y83 HydrophobicContact CG2-CD2 4.24Å; I34-Y83 HydrophobicContact CG2-CE2 3.8Å; L38-Y83 WeakPolarHBondContact CD2-OH 3.44Å; V62-Y83 HydrophobicContact CB-CD1 4.24Å; V62-Y83 HydrophobicContact CG1-CD1 4.17Å; V62-Y83 HydrophobicContact CG2-CD1 3.66Å; V62-Y83 HydrophobicContact CG2-CE1 4.18Å; V65-Y83 HydrophobicContact CB-CE1 4.01Å; V65-Y83 HydrophobicContact CG1-CE1 4.05Å; V65-Y83 HydrophobicContact CG2-CE1 3.88Å; V65-Y83 WeakPolarHBondContact CG2-OH 3.24Å; F79-Y83 HydrophobicContact CE1-CD1 4.18Å; F79-Y83 AromaticContact CE1-CG 3.96Å; F79-Y83 HydrophobicContact CE1-CG 3.96Å; F79-Y83 HydrophobicContact CE2-CD2 4.47Å; F79-Y83 HydrophobicContact CZ-CD1 4.26Å; F79-Y83 AromaticContact CZ-CD2 3.92Å; F79-Y83 HydrophobicContact CZ-CD2 3.92Å; F79-Y83 AromaticContact CZ-CG 3.74Å; F79-Y83 HydrophobicContact CZ-CG 3.74Å; F79-Y83 WeakPolarHBondContact O-CB 3.4Å; F79-Y83 PolarHBondContact O-N 3.17Å; Y83-Y85 VanDerWaalsContact C-N 3.26Å; Y83-Y85 PolarHBondContact O-N 3.28Å; Y83-C86 WeakPolarHBondContact O-CB 3.44Å; Y83-C86 PolarHBondContact O-N 3.5Å; Y83-C86 VanDerWaalsContact O-N 3.09Å; Y83-I87 HydrophobicContact CD1-CG1 4.04Å; Y83-I87 HydrophobicContact CE1-CD1 4.01Å; Y83-I87 HydrophobicContact CE1-CG1 3.71Å; Y83-I87 HydrophobicContact CE2-CD1 4.29Å; Y83-I87 HydrophobicContact CE2-CG1 4.4Å; Y83-I87 WeakPolarHBondContact O-CG1 3.37Å; Y83-I87 PolarHBondContact O-N 3.43Å
84	L	97	Very high	96.4	Very high	34 Å²	34	41.3 Å²	41.3	18%	0.178	22%	0.222	C	C	.	.	H	α-helix	trans	-56.2	-42.1	173.8	178	62.8	0	0	0	111.6	A58 K59 V62 P80 T81 C86 I87 N88	A58-L84 HydrophobicContact CB-CD1 3.51Å; K59-L84 HydrophobicContact CG-CD1 4.24Å; K59-L84 HydrophobicContact CG-CD2 3.93Å; V62-L84 HydrophobicContact CG2-CB 3.9Å; V62-L84 HydrophobicContact CG2-CD1 4.06Å; P80-L84 WeakPolarHBondContact O-CB 3.1Å; P80-L84 PolarHBondContact O-N 3.1Å; T81-L84 PolarHBondContact O-N 2.94Å; L84-C86 VanDerWaalsContact C-N 3.35Å; L84-C86 PolarHBondContact O-N 3.19Å; L84-I87 PolarHBondContact O-N 3.3Å; L84-N88 VanDerWaalsContact O-CG 3.29Å; L84-N88 PolarHBondContact O-N 3.42Å
85	Y	97.1	Very high	96.4	Very high	41 Å²	41	38.2 Å²	38.2	16%	0.161	20%	0.203	C	C	.	.	H	α-helix	trans	-57.1	-47.6	175.1	-178.6	-90.7	0	0	0	111.9	K26 T81 D82 Y83 I87 N88 Q89 S221	K26-Y85 HydrophobicContact CD-CE1 4.24Å; K26-Y85 WeakPolarHBondContact CE-OH 3.28Å; K26-Y85 HydrophobicContact CG-CD1 4.22Å; K26-Y85 HydrophobicContact CG-CE1 3.71Å; T81-Y85 WeakPolarHBondContact O-CB 3.48Å; T81-Y85 PolarHBondContact O-N 3.23Å; D82-Y85 WeakPolarHBondContact O-CB 3.36Å; Y83-Y85 VanDerWaalsContact C-N 3.26Å; Y83-Y85 PolarHBondContact O-N 3.28Å; Y85-I87 PolarHBondContact O-N 3.25Å; Y85-N88 PolarHBondContact O-N 3.32Å; Y85-Q89 HydrophobicContact CD1-CG 4.43Å; Y85-Q89 HydrophobicContact CE1-CG 4.05Å; Y85-Q89 VanDerWaalsContact CE1-OE1 3.25Å; Y85-Q89 WeakPolarHBondContact O-CG 3.32Å; Y85-Q89 PolarHBondContact O-N 2.98Å; Y85-Q89 VanDerWaalsContact O-N 3.1Å; Y85-Q89 PolarHBondContact OH-NE2 3.39Å; Y85-Q89 VanDerWaalsContact OH-NE2 3.12Å; Y85-S221 VanDerWaalsContact CE2-CB 3.41Å
86	C	98	Very high	96.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-42.5	177.6	-60.1	0	0	0	0	111.7	R30 T31 I34 D82 Y83 L84 Q89 I90	R30-C86 VanDerWaalsContact CD-SG 3.59Å; T31-C86 HydrophobicContact CG2-CB 4.32Å; I34-C86 HydrophobicContact CB-CB 4.19Å; I34-C86 HydrophobicContact CG1-CB 4.14Å; I34-C86 HydrophobicContact CG2-CB 4.03Å; D82-C86 PolarHBondContact O-N 3.48Å; D82-C86 PolarHBondContact O-SG 3.25Å; Y83-C86 WeakPolarHBondContact O-CB 3.44Å; Y83-C86 PolarHBondContact O-N 3.5Å; Y83-C86 VanDerWaalsContact O-N 3.09Å; L84-C86 VanDerWaalsContact C-N 3.35Å; L84-C86 PolarHBondContact O-N 3.19Å; C86-Q89 PolarHBondContact O-N 3.15Å; C86-I90 WeakPolarHBondContact O-CD1 3.42Å; C86-I90 VanDerWaalsContact O-CG1 3.24Å; C86-I90 WeakPolarHBondContact O-CG1 3.43Å; C86-I90 PolarHBondContact O-N 3.12Å
87	I	97.1	Very high	96.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-46.2	178.1	-68	-62.4	0	0	0	110.9	L38 L52 A58 Y83 L84 Y85 Q89 I90 N91	L38-I87 HydrophobicContact CD1-CD1 3.66Å; L52-I87 HydrophobicContact CD1-CG2 3.74Å; A58-I87 HydrophobicContact CB-CG2 4.01Å; Y83-I87 HydrophobicContact CD1-CG1 4.04Å; Y83-I87 HydrophobicContact CE1-CD1 4.01Å; Y83-I87 HydrophobicContact CE1-CG1 3.71Å; Y83-I87 HydrophobicContact CE2-CD1 4.29Å; Y83-I87 HydrophobicContact CE2-CG1 4.4Å; Y83-I87 WeakPolarHBondContact O-CG1 3.37Å; Y83-I87 PolarHBondContact O-N 3.43Å; L84-I87 PolarHBondContact O-N 3.3Å; Y85-I87 PolarHBondContact O-N 3.25Å; I87-Q89 VanDerWaalsContact C-N 3.34Å; I87-Q89 PolarHBondContact O-N 3.44Å; I87-I90 PolarHBondContact O-N 2.77Å; I87-N91 WeakPolarHBondContact CG2-ND2 3.2Å; I87-N91 WeakPolarHBondContact O-CB 3.42Å; I87-N91 PolarHBondContact O-N 3.09Å; I87-N91 PolarHBondContact O-ND2 2.85Å
88	N	96	Very high	96.9	Very high	66 Å²	66	35 Å²	35	35%	0.353	18%	0.181	S	C	.	.	H	α-helix	trans	-61.7	-42	178.4	-69.9	-14.5	0	0	0	111.8	A58 L84 Y85 S92	A58-N88 WeakPolarHBondContact CB-OD1 3.49Å; L84-N88 VanDerWaalsContact O-CG 3.29Å; L84-N88 PolarHBondContact O-N 3.42Å; Y85-N88 PolarHBondContact O-N 3.32Å; N88-S92 VanDerWaalsContact O-CB 3.26Å; N88-S92 WeakPolarHBondContact O-CB 3.29Å; N88-S92 PolarHBondContact O-N 3.27Å; N88-S92 PolarHBondContact O-OG 3.49Å
89	Q	97.2	Very high	97	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-45.1	174.8	-75	-171.2	-43.1	0	0	112.5	T31 Y85 C86 I87 S92 Y93 Y217 S220 S221	T31-Q89 HydrophobicContact CG2-CB 3.9Å; T31-Q89 PolarHBondContact OG1-OE1 3.17Å; Y85-Q89 HydrophobicContact CD1-CG 4.43Å; Y85-Q89 HydrophobicContact CE1-CG 4.05Å; Y85-Q89 VanDerWaalsContact CE1-OE1 3.25Å; Y85-Q89 WeakPolarHBondContact O-CG 3.32Å; Y85-Q89 PolarHBondContact O-N 2.98Å; Y85-Q89 VanDerWaalsContact O-N 3.1Å; Y85-Q89 PolarHBondContact OH-NE2 3.39Å; Y85-Q89 VanDerWaalsContact OH-NE2 3.12Å; C86-Q89 PolarHBondContact O-N 3.15Å; I87-Q89 VanDerWaalsContact C-N 3.34Å; I87-Q89 PolarHBondContact O-N 3.44Å; Q89-S92 PolarHBondContact O-OG 3Å; Q89-S92 VanDerWaalsContact O-OG 3.1Å; Q89-Y93 WeakPolarHBondContact O-CB 3.46Å; Q89-Y93 PolarHBondContact O-N 3.3Å; Q89-Y217 HydrophobicContact CB-CD1 3.81Å; Q89-Y217 HydrophobicContact CB-CE1 3.99Å; Q89-Y217 HydrophobicContact CG-CD1 4.48Å; Q89-Y217 PolarHBondContact NE2-O 3.39Å; Q89-Y217 WeakPolarHBondContact O-CE1 3.17Å; Q89-S220 PolarHBondContact NE2-O 2.79Å; Q89-S221 WeakPolarHBondContact CG-O 3.49Å
90	I	97.5	Very high	97.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-49.1	179.9	-67.6	162.2	0	0	0	110.5	T31 I34 E35 L38 L50 C86 I87 Y93 W94	T31-I90 HydrophobicContact CG2-CD1 4.21Å; T31-I90 HydrophobicContact CG2-CG1 3.75Å; I34-I90 HydrophobicContact CG2-CD1 4.01Å; E35-I90 HydrophobicContact CB-CD1 3.74Å; E35-I90 HydrophobicContact CB-CG1 4.04Å; E35-I90 HydrophobicContact CG-CD1 4.1Å; E35-I90 HydrophobicContact CG-CG1 4.11Å; E35-I90 HydrophobicContact CG-CG2 4.06Å; L38-I90 HydrophobicContact CD1-CD1 4.14Å; L50-I90 HydrophobicContact CD2-CG2 4.35Å; L50-I90 WeakPolarHBondContact O-CG2 3.32Å; C86-I90 WeakPolarHBondContact O-CD1 3.42Å; C86-I90 VanDerWaalsContact O-CG1 3.24Å; C86-I90 WeakPolarHBondContact O-CG1 3.43Å; C86-I90 PolarHBondContact O-N 3.12Å; I87-I90 PolarHBondContact O-N 2.77Å; I90-Y93 WeakPolarHBondContact O-CB 3.25Å; I90-Y93 PolarHBondContact O-N 3.45Å; I90-W94 PolarHBondContact O-N 3.1Å
91	N	96.4	Very high	97.1	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.043	18%	0.178	C	C	.	.	H	α-helix	trans	-65.7	-48.6	-176.4	-79	-91	0	0	0	111.9	G49 L51 L52 I87 Y93 W94 E95	G49-N91 PolarHBondContact O-ND2 3.42Å; L51-N91 WeakPolarHBondContact CA-OD1 3.46Å; L52-N91 WeakPolarHBondContact CB-OD1 3.41Å; L52-N91 WeakPolarHBondContact CG-OD1 3.1Å; L52-N91 PolarHBondContact N-OD1 3.36Å; I87-N91 WeakPolarHBondContact CG2-ND2 3.2Å; I87-N91 WeakPolarHBondContact O-CB 3.42Å; I87-N91 PolarHBondContact O-N 3.09Å; I87-N91 PolarHBondContact O-ND2 2.85Å; N91-Y93 PolarHBondContact O-N 2.96Å; N91-W94 PolarHBondContact O-N 3.17Å; N91-E95 WeakPolarHBondContact O-CG 3.47Å; N91-E95 PolarHBondContact O-N 3.33Å
92	S	95.9	Very high	97.1	Very high	4 Å²	4	33.8 Å²	33.8	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-31	178.3	58	0	0	0	0	113.4	N88 Q89 L96 S222 A223	N88-S92 VanDerWaalsContact O-CB 3.26Å; N88-S92 WeakPolarHBondContact O-CB 3.29Å; N88-S92 PolarHBondContact O-N 3.27Å; N88-S92 PolarHBondContact O-OG 3.49Å; Q89-S92 PolarHBondContact O-OG 3Å; Q89-S92 VanDerWaalsContact O-OG 3.1Å; S92-L96 WeakPolarHBondContact O-CB 3.49Å; S92-L96 PolarHBondContact O-N 3.41Å; S92-S222 WeakPolarHBondContact CB-OG 3.44Å; S92-S222 VanDerWaalsContact OG-CA 3.31Å; S92-S222 WeakPolarHBondContact OG-CA 3.3Å; S92-S222 PolarHBondContact OG-OG 3.07Å; S92-A223 PolarHBondContact OG-N 3.12Å
93	Y	97.3	Very high	97.1	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-62.6	-44.6	173.4	-172.1	-83.5	0	0	0	111.8	Q89 I90 N91 L96 I97 M207 G210 L212 K213 F216 Y217	Q89-Y93 WeakPolarHBondContact O-CB 3.46Å; Q89-Y93 PolarHBondContact O-N 3.3Å; I90-Y93 WeakPolarHBondContact O-CB 3.25Å; I90-Y93 PolarHBondContact O-N 3.45Å; N91-Y93 PolarHBondContact O-N 2.96Å; Y93-L96 PolarHBondContact O-N 3.26Å; Y93-I97 HydrophobicContact CD1-CD1 3.94Å; Y93-I97 HydrophobicContact CE1-CD1 3.6Å; Y93-I97 HydrophobicContact CE1-CG1 4.41Å; Y93-I97 PolarHBondContact O-N 3.18Å; Y93-M207 HydrophobicContact CD1-CE 3.85Å; Y93-M207 HydrophobicContact CD2-CE 3.57Å; Y93-M207 HydrophobicContact CD2-SD 4.24Å; Y93-M207 HydrophobicContact CE1-CE 3.79Å; Y93-M207 HydrophobicContact CE1-SD 4.21Å; Y93-M207 HydrophobicContact CE2-CE 3.51Å; Y93-M207 HydrophobicContact CE2-SD 3.56Å; Y93-M207 VanDerWaalsContact CE2-SD 3.56Å; Y93-M207 HydrophobicContact CG-CE 3.73Å; Y93-M207 VanDerWaalsContact CZ-SD 3.52Å; Y93-M207 WeakPolarHBondContact O-CE 3.32Å; Y93-M207 PolarHBondContact OH-O 3.49Å; Y93-G210 WeakPolarHBondContact OH-CA 3.4Å; Y93-L212 HydrophobicContact CE2-CB 4.24Å; Y93-K213 HydrophobicContact CD1-CG 4.43Å; Y93-K213 HydrophobicContact CD2-CG 4.19Å; Y93-K213 HydrophobicContact CE1-CG 3.96Å; Y93-K213 HydrophobicContact CE2-CB 4.39Å; Y93-K213 HydrophobicContact CE2-CG 3.69Å; Y93-F216 HydrophobicContact CD2-CB 4.26Å; Y93-F216 AromaticContact CD2-CD2 3.87Å; Y93-F216 HydrophobicContact CD2-CD2 3.87Å; Y93-F216 HydrophobicContact CD2-CG 4.49Å; Y93-F216 AromaticContact CE2-CD2 3.92Å; Y93-F216 HydrophobicContact CE2-CD2 3.92Å; Y93-F216 HydrophobicContact CE2-CG 4.49Å; Y93-Y217 HydrophobicContact CD2-CE1 4.34Å; Y93-Y217 HydrophobicContact CG-CE1 4.47Å
94	W	95.4	Very high	97.1	Very high	83 Å²	83	35.4 Å²	35.4	31%	0.314	18%	0.177	S	C	.	.	H	α-helix	trans	-71.5	-43.2	178.2	-67.1	114.3	0	0	0	112.2	L51 I90 N91 L96 I97 D98	L51-W94 HydrophobicContact CD1-CB 3.87Å; I90-W94 PolarHBondContact O-N 3.1Å; N91-W94 PolarHBondContact O-N 3.17Å; W94-L96 PolarHBondContact O-N 3.19Å; W94-I97 HydrophobicContact CE3-CD1 3.63Å; W94-I97 HydrophobicContact CZ3-CD1 3.79Å; W94-I97 WeakPolarHBondContact O-CB 3.48Å; W94-I97 PolarHBondContact O-N 3.02Å; W94-D98 PolarHBondContact O-N 2.88Å; W94-D98 VanDerWaalsContact O-N 3.15Å
95	E	95.3	Very high	97.1	Very high	88 Å²	88	37.5 Å²	37.5	41%	0.411	19%	0.193	S	C	.	.	H	α-helix	trans	-58.4	-35.9	174	-69.6	174.2	-163.9	0	0	112.2	N91 D98 K99	N91-E95 WeakPolarHBondContact O-CG 3.47Å; N91-E95 PolarHBondContact O-N 3.33Å; E95-D98 PolarHBondContact O-N 3.49Å; E95-K99 WeakPolarHBondContact O-CG 3.24Å; E95-K99 PolarHBondContact O-N 3.43Å
96	L	97.1	Very high	97.1	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-38.4	175.7	-179.7	58.8	0	0	0	111.7	S92 Y93 W94 D98 K99 L100 M207 F216 A223 S224 I225 F228	S92-L96 WeakPolarHBondContact O-CB 3.49Å; S92-L96 PolarHBondContact O-N 3.41Å; Y93-L96 PolarHBondContact O-N 3.26Å; W94-L96 PolarHBondContact O-N 3.19Å; L96-D98 VanDerWaalsContact C-N 3.3Å; L96-D98 PolarHBondContact O-N 3.48Å; L96-K99 PolarHBondContact O-N 3.32Å; L96-L100 HydrophobicContact CD1-CD1 4.12Å; L96-L100 HydrophobicContact CD1-CD2 4.38Å; L96-L100 HydrophobicContact CD1-CG 3.96Å; L96-L100 HydrophobicContact CG-CD1 3.92Å; L96-L100 HydrophobicContact CG-CG 4.25Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 WeakPolarHBondContact O-CG 3.2Å; L96-L100 PolarHBondContact O-N 3.42Å; L96-M207 HydrophobicContact CB-CE 3.93Å; L96-M207 HydrophobicContact CD2-CE 3.75Å; L96-M207 HydrophobicContact CG-CE 3.89Å; L96-F216 HydrophobicContact CD2-CD2 4.13Å; L96-F216 HydrophobicContact CD2-CE2 3.54Å; L96-F216 HydrophobicContact CD2-CZ 4.45Å; L96-A223 HydrophobicContact CD2-CB 3.78Å; L96-S224 VanDerWaalsContact CD2-O 3.3Å; L96-S224 WeakPolarHBondContact CD2-O 3.37Å; L96-I225 HydrophobicContact CD1-CG1 3.86Å; L96-F228 HydrophobicContact CD2-CB 4.38Å
97	I	97.7	Very high	97.1	Very high	15 Å²	15	41.8 Å²	41.8	8%	0.077	23%	0.231	C	C	.	.	H	α-helix	trans	-56.5	-47.4	172.4	-73.9	165	0	0	0	110.4	Y93 W94 K99 L100 D101 M207 L208	Y93-I97 HydrophobicContact CD1-CD1 3.94Å; Y93-I97 HydrophobicContact CE1-CD1 3.6Å; Y93-I97 HydrophobicContact CE1-CG1 4.41Å; Y93-I97 PolarHBondContact O-N 3.18Å; W94-I97 HydrophobicContact CE3-CD1 3.63Å; W94-I97 HydrophobicContact CZ3-CD1 3.79Å; W94-I97 WeakPolarHBondContact O-CB 3.48Å; W94-I97 PolarHBondContact O-N 3.02Å; I97-K99 PolarHBondContact O-N 3.36Å; I97-L100 PolarHBondContact O-N 3.11Å; I97-D101 WeakPolarHBondContact O-CB 3.44Å; I97-D101 PolarHBondContact O-N 3.36Å; I97-M207 HydrophobicContact CD1-CE 4.45Å; I97-M207 HydrophobicContact CD1-CG 4.35Å; I97-M207 HydrophobicContact CG1-CE 3.84Å; I97-M207 HydrophobicContact CG1-CG 3.57Å; I97-L208 HydrophobicContact CG2-CD1 4.33Å
98	D	96.6	Very high	97	Very high	103 Å²	103	42.6 Å²	42.6	55%	0.551	24%	0.235	S	C	*	.	H	α-helix	trans	-63.2	-42.2	-179	-67.7	-15	0	0	0	111.9	W94 E95 L96 D101 A102	W94-D98 PolarHBondContact O-N 2.88Å; W94-D98 VanDerWaalsContact O-N 3.15Å; E95-D98 PolarHBondContact O-N 3.49Å; L96-D98 VanDerWaalsContact C-N 3.3Å; L96-D98 PolarHBondContact O-N 3.48Å; D98-D101 PolarHBondContact O-N 3.32Å; D98-A102 PolarHBondContact O-N 3.18Å
99	K	97.6	Very high	96.9	Very high	111 Å²	111	42.8 Å²	42.8	48%	0.483	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-45.3	176.3	-72.1	170.7	-172.5	169.5	0	112	E95 L96 I97 D101 A102 S103 I225	E95-K99 WeakPolarHBondContact O-CG 3.24Å; E95-K99 PolarHBondContact O-N 3.43Å; L96-K99 PolarHBondContact O-N 3.32Å; I97-K99 PolarHBondContact O-N 3.36Å; K99-D101 VanDerWaalsContact C-N 3.32Å; K99-A102 PolarHBondContact O-N 3.35Å; K99-S103 PolarHBondContact O-N 3.46Å; K99-S103 VanDerWaalsContact O-N 3.15Å; K99-I225 HydrophobicContact CB-CD1 4.48Å; K99-I225 HydrophobicContact CD-CD1 4.45Å
100	L	98.5	Very high	96.5	Very high	3 Å²	3	46 Å²	46	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-38.7	177.6	-67	171.3	0	0	0	111	L96 I97 S103 R104 L160 Y204 M207 F228	L96-L100 HydrophobicContact CD1-CD1 4.12Å; L96-L100 HydrophobicContact CD1-CD2 4.38Å; L96-L100 HydrophobicContact CD1-CG 3.96Å; L96-L100 HydrophobicContact CG-CD1 3.92Å; L96-L100 HydrophobicContact CG-CG 4.25Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 WeakPolarHBondContact O-CG 3.2Å; L96-L100 PolarHBondContact O-N 3.42Å; I97-L100 PolarHBondContact O-N 3.11Å; L100-S103 PolarHBondContact O-N 2.89Å; L100-R104 VanDerWaalsContact O-CB 3.26Å; L100-R104 WeakPolarHBondContact O-CB 3.45Å; L100-R104 PolarHBondContact O-N 2.91Å; L100-L160 HydrophobicContact CB-CD2 4.24Å; L100-L160 HydrophobicContact CD2-CD1 3.68Å; L100-L160 HydrophobicContact CD2-CD2 4.24Å; L100-Y204 HydrophobicContact CB-CD2 4.21Å; L100-Y204 HydrophobicContact CB-CE2 4.43Å; L100-M207 HydrophobicContact CD1-CG 4Å; L100-F228 HydrophobicContact CD1-CB 4.4Å; L100-F228 HydrophobicContact CD1-CD1 4.19Å; L100-F228 HydrophobicContact CD1-CD2 3.54Å; L100-F228 HydrophobicContact CD1-CE1 4.36Å; L100-F228 HydrophobicContact CD1-CE2 3.74Å; L100-F228 HydrophobicContact CD1-CG 3.78Å; L100-F228 HydrophobicContact CD1-CZ 4.15Å; L100-F228 HydrophobicContact CD2-CB 4.39Å; L100-F228 HydrophobicContact CD2-CD1 3.53Å; L100-F228 HydrophobicContact CD2-CD2 4.41Å; L100-F228 HydrophobicContact CD2-CE1 3.81Å; L100-F228 HydrophobicContact CD2-CG 3.85Å; L100-F228 HydrophobicContact CD2-CZ 4.36Å; L100-F228 HydrophobicContact CG-CG 4.47Å
101	D	98	Very high	96.3	Very high	50 Å²	50	53 Å²	53	27%	0.267	30%	0.296	S	S	.	.	H	α-helix	trans	-67.8	-37.7	178.3	-162.4	60.2	0	0	0	112.6	I97 D98 K99 R104 C105 Y204	I97-D101 WeakPolarHBondContact O-CB 3.44Å; I97-D101 PolarHBondContact O-N 3.36Å; D98-D101 PolarHBondContact O-N 3.32Å; K99-D101 VanDerWaalsContact C-N 3.32Å; D101-R104 PolarHBondContact O-N 3.29Å; D101-R104 IonicContact OD1-CZ 2.88Å; D101-R104 VanDerWaalsContact OD1-CZ 3.22Å; D101-R104 IonicContact OD1-NE 2.7Å; D101-R104 PolarHBondContact OD1-NE 3.23Å; D101-R104 IonicContact OD1-NH2 3.68Å; D101-R104 PolarHBondContact OD1-NH2 3.1Å; D101-R104 IonicContact OD2-NH2 2.87Å; D101-C105 WeakPolarHBondContact O-CB 3.47Å; D101-C105 PolarHBondContact O-N 2.9Å; D101-C105 PolarHBondContact O-SG 2.98Å; D101-Y204 HydrophobicContact CB-CE2 4.34Å; D101-Y204 PolarHBondContact OD1-OH 2.89Å
102	A	98	Very high	96.3	Very high	58 Å²	58	55.4 Å²	55.4	48%	0.479	31%	0.309	S	S	.	.	H	α-helix	trans	-59.9	-49.7	172.5	0	0	0	0	0	111.4	D98 K99 R104 C105 T106	D98-A102 PolarHBondContact O-N 3.18Å; K99-A102 PolarHBondContact O-N 3.35Å; A102-R104 VanDerWaalsContact C-N 3.34Å; A102-R104 PolarHBondContact O-N 3.32Å; A102-C105 PolarHBondContact O-N 3.42Å; A102-T106 PolarHBondContact O-N 3.1Å; A102-T106 VanDerWaalsContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 2.7Å; A102-T106 VanDerWaalsContact O-OG1 3.09Å
103	S	98	Very high	96.3	Very high	14 Å²	14	62 Å²	62	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-39.7	176.2	175.9	0	0	0	0	112.1	K99 L100 C105 T106 I159 L160 E163	K99-S103 PolarHBondContact O-N 3.46Å; K99-S103 VanDerWaalsContact O-N 3.15Å; L100-S103 PolarHBondContact O-N 2.89Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-C105 PolarHBondContact O-N 2.97Å; S103-T106 PolarHBondContact O-N 3.4Å; S103-I159 WeakPolarHBondContact O-CG1 3.47Å; S103-I159 PolarHBondContact O-N 3.44Å; S103-L160 WeakPolarHBondContact OG-CA 3.2Å; S103-L160 WeakPolarHBondContact OG-CB 3.38Å; S103-L160 PolarHBondContact OG-N 3.32Å; S103-L160 VanDerWaalsContact OG-N 3.13Å; S103-E163 PolarHBondContact OG-OE2 2.85Å
104	R	97.7	Very high	96.3	Very high	61 Å²	61	66.4 Å²	66.4	23%	0.23	36%	0.356	C	S	.	.	H	α-helix	trans	-63.3	-35.7	175.8	-172.1	-164.9	63.2	67.3	-0.5	113.1	L100 D101 A102 M157 G158 L160 Y204	L100-R104 VanDerWaalsContact O-CB 3.26Å; L100-R104 WeakPolarHBondContact O-CB 3.45Å; L100-R104 PolarHBondContact O-N 2.91Å; D101-R104 PolarHBondContact O-N 3.29Å; D101-R104 IonicContact OD1-CZ 2.88Å; D101-R104 VanDerWaalsContact OD1-CZ 3.22Å; D101-R104 IonicContact OD1-NE 2.7Å; D101-R104 PolarHBondContact OD1-NE 3.23Å; D101-R104 IonicContact OD1-NH2 3.68Å; D101-R104 PolarHBondContact OD1-NH2 3.1Å; D101-R104 IonicContact OD2-NH2 2.87Å; A102-R104 VanDerWaalsContact C-N 3.34Å; A102-R104 PolarHBondContact O-N 3.32Å; R104-M157 WeakPolarHBondContact CA-O 3.26Å; R104-M157 HydrophobicContact CB-CE 4.5Å; R104-M157 HydrophobicContact CG-CE 3.8Å; R104-M157 HydrophobicContact CG-SD 3.82Å; R104-M157 CarbonylContact O-C 3.34Å; R104-G158 WeakPolarHBondContact O-CA 3.38Å; R104-G158 PolarHBondContact O-N 2.65Å; R104-L160 HydrophobicContact CB-CB 4.41Å; R104-L160 HydrophobicContact CB-CD2 4.15Å; R104-Y204 PolarHBondContact NE-OH 3.25Å
105	C	97.4	Very high	96.3	Very high	77 Å²	77	62.9 Å²	62.9	52%	0.52	34%	0.343	S	S	.	.	H	α-helix	trans	-82.5	-17.7	-178.8	-70.2	0	0	0	0	113.5	D101 A102 S103 A107	D101-C105 WeakPolarHBondContact O-CB 3.47Å; D101-C105 PolarHBondContact O-N 2.9Å; D101-C105 PolarHBondContact O-SG 2.98Å; A102-C105 PolarHBondContact O-N 3.42Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-C105 PolarHBondContact O-N 2.97Å; C105-A107 PolarHBondContact O-N 3.24Å
106	T	97.4	Very high	96.2	Very high	59 Å²	59	61 Å²	61	36%	0.362	34%	0.34	S	S	.	.	S	Bend	trans	-75.6	110.9	175	-61.4	0	0	0	0	109.5	A102 S103 G158 I159	A102-T106 PolarHBondContact O-N 3.1Å; A102-T106 VanDerWaalsContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 2.7Å; A102-T106 VanDerWaalsContact O-OG1 3.09Å; S103-T106 PolarHBondContact O-N 3.4Å; T106-G158 VanDerWaalsContact O-CA 3.23Å; T106-G158 WeakPolarHBondContact O-CA 3.41Å; T106-I159 HydrophobicContact CG2-CD1 3.67Å; T106-I159 HydrophobicContact CG2-CG1 4.02Å; T106-I159 HydrophobicContact CG2-CG2 4.29Å; T106-I159 PolarHBondContact O-N 2.72Å
107	A	96.3	Very high	96.1	Very high	72 Å²	72	64.8 Å²	64.8	60%	0.595	36%	0.357	S	S	*	.			trans	-66.2	144.8	174.4	0	0	0	0	0	110.3	C105 H115	C105-A107 PolarHBondContact O-N 3.24Å; A107-H115 PolarHBondContact O-CE1 3.06Å
108	F	95.2	Very high	96	Very high	18 Å²	18	64.2 Å²	64.2	8%	0.079	35%	0.354	C	S	.	.			trans	-60.1	143	169.5	-178.4	-88.8	0	0	0	109.7	H115 L119 E151 F154 L162	F108-H115 HydrophobicContact CD2-CB 3.93Å; F108-H115 HydrophobicContact CE2-CB 3.68Å; F108-H115 HydrophobicContact CZ-CB 4.28Å; F108-L119 HydrophobicContact CE1-CD1 4.29Å; F108-L119 HydrophobicContact CE2-CD1 3.7Å; F108-L119 HydrophobicContact CE2-CG 3.88Å; F108-L119 HydrophobicContact CZ-CD1 3.35Å; F108-L119 HydrophobicContact CZ-CG 4.06Å; F108-E151 HydrophobicContact CD1-CB 3.91Å; F108-E151 HydrophobicContact CD1-CG 3.79Å; F108-E151 HydrophobicContact CE1-CB 4.31Å; F108-F154 HydrophobicContact CB-CB 4.38Å; F108-F154 HydrophobicContact CB-CD2 3.95Å; F108-F154 AromaticContact CD2-CD2 3.99Å; F108-F154 HydrophobicContact CD2-CD2 3.99Å; F108-F154 HydrophobicContact CD2-CE2 4.13Å; F108-F154 AromaticContact CG-CD2 3.95Å; F108-F154 HydrophobicContact CG-CD2 3.95Å; F108-F154 HydrophobicContact CG-CE2 4.43Å; F108-L162 HydrophobicContact CD2-CD2 3.91Å; F108-L162 HydrophobicContact CE2-CD2 3.85Å
109	N	93.6	Very high	95.8	Very high	70 Å²	70	60.3 Å²	60.3	37%	0.374	33%	0.333	S	S	.	.			trans	-142.6	117.3	178.4	177.5	5.8	0	0	0	107.6	D111 D112 H115	N109-D111 PolarHBondContact O-N 3.45Å; N109-D111 PolarHBondContact OD1-N 3.26Å; N109-D112 HydrophobicContact CB-CB 4.03Å; N109-D112 WeakPolarHBondContact O-CB 3.48Å; N109-D112 PolarHBondContact O-N 3.16Å; N109-H115 PolarHBondContact N-ND1 3.21Å; N109-H115 VanDerWaalsContact O-CB 3.3Å; N109-H115 WeakPolarHBondContact O-CB 3.34Å; N109-H115 PolarHBondContact O-ND1 2.74Å
110	S	89.7	Confident	95.6	Very high	69 Å²	69	58 Å²	58	48%	0.483	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.2	-179.9	54.3	0	0	0	0	113.5	D112	S110-D112 VanDerWaalsContact C-N 3.28Å
111	D	93.2	Very high	95.3	Very high	147 Å²	147	61.2 Å²	61.2	79%	0.786	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.3	179.5	-59.1	-27.8	0	0	0	112.2	N109	N109-D111 PolarHBondContact O-N 3.45Å; N109-D111 PolarHBondContact OD1-N 3.26Å
112	D	96	Very high	95.2	Very high	59 Å²	59	58.9 Å²	58.9	32%	0.316	33%	0.33	S	S	.	.			trans	-81.9	125.4	173.7	-174.7	-72	0	0	0	110.3	N109 S110 Y114 H115 S116	N109-D112 HydrophobicContact CB-CB 4.03Å; N109-D112 WeakPolarHBondContact O-CB 3.48Å; N109-D112 PolarHBondContact O-N 3.16Å; S110-D112 VanDerWaalsContact C-N 3.28Å; D112-Y114 VanDerWaalsContact C-N 3.34Å; D112-Y114 PolarHBondContact O-N 2.87Å; D112-Y114 WeakPolarHBondContact OD1-CA 3.26Å; D112-Y114 VanDerWaalsContact OD1-CB 3.27Å; D112-Y114 WeakPolarHBondContact OD1-CB 3.49Å; D112-Y114 PolarHBondContact OD1-N 3.2Å; D112-H115 HydrophobicContact CB-CB 4.05Å; D112-H115 PolarHBondContact O-N 2.85Å; D112-H115 IonicContact OD1-CD2 2.79Å; D112-H115 IonicContact OD1-CG 2.89Å; D112-H115 PolarHBondContact OD1-N 3.44Å; D112-H115 IonicContact OD1-NE2 2.64Å; D112-S116 PolarHBondContact O-N 3.42Å; D112-S116 PolarHBondContact O-OG 3.23Å
113	H	96	Very high	94.9	Very high	143 Å²	143	56.5 Å²	56.5	66%	0.662	31%	0.309	S	S	*	.	H	α-helix	trans	-62	-41.1	-178.3	-179.1	-77.9	0	0	0	112.2	S116 E117	H113-S116 WeakPolarHBondContact CA-OG 3.4Å; H113-S116 PolarHBondContact O-OG 2.92Å; H113-S116 VanDerWaalsContact O-OG 3.04Å; H113-E117 IonicContact CE1-OE2 3.47Å; H113-E117 PolarHBondContact CE1-OE2 3.37Å; H113-E117 IonicContact ND1-OE2 3.6Å; H113-E117 WeakPolarHBondContact O-CB 3.27Å; H113-E117 PolarHBondContact O-N 2.94Å
114	Y	96.9	Very high	94.5	Very high	92 Å²	92	59.7 Å²	59.7	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-66	-41.6	-179.9	170.8	-115.8	0	0	0	110.9	D112 E117 L118 I159 E163	D112-Y114 VanDerWaalsContact C-N 3.34Å; D112-Y114 PolarHBondContact O-N 2.87Å; D112-Y114 WeakPolarHBondContact OD1-CA 3.26Å; D112-Y114 VanDerWaalsContact OD1-CB 3.27Å; D112-Y114 WeakPolarHBondContact OD1-CB 3.49Å; D112-Y114 PolarHBondContact OD1-N 3.2Å; Y114-E117 PolarHBondContact O-N 3.42Å; Y114-L118 HydrophobicContact CD1-CD1 4.28Å; Y114-L118 HydrophobicContact CD2-CG 4.45Å; Y114-L118 HydrophobicContact CE1-CD1 3.73Å; Y114-L118 HydrophobicContact CE1-CG 4.47Å; Y114-L118 HydrophobicContact CE2-CD1 4.17Å; Y114-L118 HydrophobicContact CE2-CD2 4.18Å; Y114-L118 HydrophobicContact CE2-CG 4.06Å; Y114-L118 WeakPolarHBondContact O-CG 3.47Å; Y114-L118 PolarHBondContact O-N 2.71Å; Y114-I159 HydrophobicContact CE1-CD1 4.25Å; Y114-E163 PolarHBondContact OH-OE1 3.37Å
115	H	95.8	Very high	94.3	Very high	10 Å²	10	57.7 Å²	57.7	5%	0.046	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-45.1	179.5	-61.9	172.4	0	0	0	112.5	A107 F108 N109 D112 E117 L118 L119	A107-H115 PolarHBondContact O-CE1 3.06Å; F108-H115 HydrophobicContact CD2-CB 3.93Å; F108-H115 HydrophobicContact CE2-CB 3.68Å; F108-H115 HydrophobicContact CZ-CB 4.28Å; N109-H115 PolarHBondContact N-ND1 3.21Å; N109-H115 VanDerWaalsContact O-CB 3.3Å; N109-H115 WeakPolarHBondContact O-CB 3.34Å; N109-H115 PolarHBondContact O-ND1 2.74Å; D112-H115 HydrophobicContact CB-CB 4.05Å; D112-H115 PolarHBondContact O-N 2.85Å; D112-H115 IonicContact OD1-CD2 2.79Å; D112-H115 IonicContact OD1-CG 2.89Å; D112-H115 PolarHBondContact OD1-N 3.44Å; D112-H115 IonicContact OD1-NE2 2.64Å; H115-E117 VanDerWaalsContact C-N 3.34Å; H115-L118 WeakPolarHBondContact O-CB 3.35Å; H115-L118 PolarHBondContact O-N 2.79Å; H115-L119 PolarHBondContact O-N 3.01Å
116	S	93.2	Very high	94	Very high	48 Å²	48	54.6 Å²	54.6	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-65.5	-37	176.1	53.2	0	0	0	0	112.1	D112 H113 L119 S120	D112-S116 PolarHBondContact O-N 3.42Å; D112-S116 PolarHBondContact O-OG 3.23Å; H113-S116 WeakPolarHBondContact CA-OG 3.4Å; H113-S116 PolarHBondContact O-OG 2.92Å; H113-S116 VanDerWaalsContact O-OG 3.04Å; S116-L119 PolarHBondContact O-N 2.95Å; S116-S120 PolarHBondContact O-N 3.34Å
117	E	95.4	Very high	93.3	Very high	82 Å²	82	53.1 Å²	53.1	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-42.1	172.8	-173.6	-174.7	165.8	0	0	112	H113 Y114 H115 L119 S120 R121	H113-E117 IonicContact CE1-OE2 3.47Å; H113-E117 PolarHBondContact CE1-OE2 3.37Å; H113-E117 IonicContact ND1-OE2 3.6Å; H113-E117 WeakPolarHBondContact O-CB 3.27Å; H113-E117 PolarHBondContact O-N 2.94Å; Y114-E117 PolarHBondContact O-N 3.42Å; H115-E117 VanDerWaalsContact C-N 3.34Å; E117-L119 VanDerWaalsContact C-N 3.35Å; E117-L119 PolarHBondContact O-N 3.02Å; E117-S120 WeakPolarHBondContact O-CB 3.43Å; E117-S120 PolarHBondContact O-N 3.39Å; E117-R121 HydrophobicContact CG-CG 4.41Å; E117-R121 WeakPolarHBondContact O-CB 3.44Å; E117-R121 VanDerWaalsContact O-CG 3.3Å; E117-R121 WeakPolarHBondContact O-CG 3.37Å; E117-R121 PolarHBondContact O-N 3.01Å
118	L	95.9	Very high	91.8	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-43.3	175.3	-75.7	173.7	0	0	0	112.1	Y114 H115 R121 L122 L162 E163 V166	Y114-L118 HydrophobicContact CD1-CD1 4.28Å; Y114-L118 HydrophobicContact CD2-CG 4.45Å; Y114-L118 HydrophobicContact CE1-CD1 3.73Å; Y114-L118 HydrophobicContact CE1-CG 4.47Å; Y114-L118 HydrophobicContact CE2-CD1 4.17Å; Y114-L118 HydrophobicContact CE2-CD2 4.18Å; Y114-L118 HydrophobicContact CE2-CG 4.06Å; Y114-L118 WeakPolarHBondContact O-CG 3.47Å; Y114-L118 PolarHBondContact O-N 2.71Å; H115-L118 WeakPolarHBondContact O-CB 3.35Å; H115-L118 PolarHBondContact O-N 2.79Å; L118-R121 PolarHBondContact O-N 3.09Å; L118-L122 WeakPolarHBondContact O-CB 3.38Å; L118-L122 PolarHBondContact O-N 2.89Å; L118-L162 HydrophobicContact CB-CD1 4.45Å; L118-L162 HydrophobicContact CB-CD2 3.6Å; L118-L162 HydrophobicContact CB-CG 3.81Å; L118-L162 HydrophobicContact CD1-CD2 4.1Å; L118-L162 HydrophobicContact CD1-CG 4.2Å; L118-E163 HydrophobicContact CD1-CG 3.88Å; L118-V166 HydrophobicContact CB-CG2 4.18Å; L118-V166 HydrophobicContact CD2-CB 4.24Å; L118-V166 HydrophobicContact CD2-CG1 4.13Å; L118-V166 HydrophobicContact CD2-CG2 4Å; L118-V166 WeakPolarHBondContact O-CG2 3.28Å
119	L	92.6	Very high	90.2	Very high	21 Å²	21	58.7 Å²	58.7	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-46	174.4	-78.7	-179.2	0	0	0	111.5	F108 H115 S116 E117 R121 L122 W123 W140 P150 F154 L162	F108-L119 HydrophobicContact CE1-CD1 4.29Å; F108-L119 HydrophobicContact CE2-CD1 3.7Å; F108-L119 HydrophobicContact CE2-CG 3.88Å; F108-L119 HydrophobicContact CZ-CD1 3.35Å; F108-L119 HydrophobicContact CZ-CG 4.06Å; H115-L119 PolarHBondContact O-N 3.01Å; S116-L119 PolarHBondContact O-N 2.95Å; E117-L119 VanDerWaalsContact C-N 3.35Å; E117-L119 PolarHBondContact O-N 3.02Å; L119-R121 VanDerWaalsContact C-N 3.31Å; L119-R121 PolarHBondContact O-N 2.89Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 2.66Å; L119-W123 WeakPolarHBondContact O-CB 3.47Å; L119-W123 PolarHBondContact O-N 3.01Å; L119-W140 HydrophobicContact CB-CH2 3.97Å; L119-W140 HydrophobicContact CB-CZ2 4.3Å; L119-W140 HydrophobicContact CD2-CH2 3.88Å; L119-W140 HydrophobicContact CD2-CZ2 4.41Å; L119-W140 HydrophobicContact CD2-CZ3 4.11Å; L119-W140 HydrophobicContact CG-CH2 4.43Å; L119-W140 WeakPolarHBondContact O-CH2 3.13Å; L119-P150 HydrophobicContact CD1-CG 3.89Å; L119-P150 HydrophobicContact CD2-CB 4.35Å; L119-P150 HydrophobicContact CD2-CG 3.82Å; L119-F154 HydrophobicContact CD2-CE2 4.13Å; L119-F154 HydrophobicContact CD2-CZ 4.08Å; L119-L162 HydrophobicContact CD2-CD1 3.88Å; L119-L162 HydrophobicContact CD2-CD2 4.18Å; L119-L162 HydrophobicContact CG-CD2 4.11Å
120	S	91.8	Very high	88.4	Confident	61 Å²	61	58.4 Å²	58.4	43%	0.427	30%	0.304	S	S	.	.	H	α-helix	trans	-57.9	-45.2	178.1	-174.4	0	0	0	0	111.6	S116 E117 W123 I124	S116-S120 PolarHBondContact O-N 3.34Å; E117-S120 WeakPolarHBondContact O-CB 3.43Å; E117-S120 PolarHBondContact O-N 3.39Å; S120-W123 WeakPolarHBondContact O-CB 3.33Å; S120-W123 PolarHBondContact O-N 3.47Å; S120-I124 VanDerWaalsContact O-CG1 3.27Å; S120-I124 WeakPolarHBondContact O-CG1 3.28Å; S120-I124 PolarHBondContact O-N 3.32Å
121	R	94.1	Very high	86.6	Confident	72 Å²	72	61.7 Å²	61.7	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.4	-72.6	164.2	59	-164.8	-3.1	112	E117 L118 L119 W123 I124 C125 V166 E170	E117-R121 HydrophobicContact CG-CG 4.41Å; E117-R121 WeakPolarHBondContact O-CB 3.44Å; E117-R121 VanDerWaalsContact O-CG 3.3Å; E117-R121 WeakPolarHBondContact O-CG 3.37Å; E117-R121 PolarHBondContact O-N 3.01Å; L118-R121 PolarHBondContact O-N 3.09Å; L119-R121 VanDerWaalsContact C-N 3.31Å; L119-R121 PolarHBondContact O-N 2.89Å; R121-W123 VanDerWaalsContact C-N 3.27Å; R121-W123 PolarHBondContact O-N 2.83Å; R121-I124 PolarHBondContact O-N 3.41Å; R121-C125 WeakPolarHBondContact O-CB 3.31Å; R121-C125 PolarHBondContact O-N 2.9Å; R121-C125 PolarHBondContact O-SG 3.46Å; R121-V166 HydrophobicContact CB-CG1 4.21Å; R121-E170 IonicContact CZ-OE1 3.02Å; R121-E170 VanDerWaalsContact CZ-OE1 3.26Å; R121-E170 IonicContact CZ-OE2 2.68Å; R121-E170 IonicContact NE-OE1 3.59Å; R121-E170 PolarHBondContact NE-OE1 2.75Å; R121-E170 IonicContact NE-OE2 3.26Å; R121-E170 IonicContact NH2-OE1 2.7Å; R121-E170 PolarHBondContact NH2-OE1 3.23Å; R121-E170 IonicContact NH2-OE2 3.89Å; R121-E170 PolarHBondContact NH2-OE2 3.21Å
122	L	95	Very high	84.4	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-55.7	-46.1	175.3	-176.9	60.5	0	0	0	111.1	L118 L119 C125 L126 W140 F145 L162 L165 V166 A169	L118-L122 WeakPolarHBondContact O-CB 3.38Å; L118-L122 PolarHBondContact O-N 2.89Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 2.66Å; L122-C125 PolarHBondContact O-N 2.75Å; L122-L126 HydrophobicContact CD1-CD1 3.56Å; L122-L126 HydrophobicContact CD1-CG 4.06Å; L122-L126 HydrophobicContact CG-CD1 4.05Å; L122-L126 WeakPolarHBondContact O-CB 3.36Å; L122-L126 WeakPolarHBondContact O-CG 3.19Å; L122-L126 PolarHBondContact O-N 2.94Å; L122-W140 HydrophobicContact CD2-CZ3 4.48Å; L122-F145 HydrophobicContact CD2-CE2 4.17Å; L122-F145 HydrophobicContact CD2-CZ 3.94Å; L122-L162 HydrophobicContact CD2-CD1 3.9Å; L122-L165 HydrophobicContact CD1-CB 3.96Å; L122-L165 HydrophobicContact CD2-CB 4.17Å; L122-L165 HydrophobicContact CD2-CD1 4.45Å; L122-V166 HydrophobicContact CB-CG2 3.83Å; L122-A169 HydrophobicContact CD1-CB 3.89Å
123	W	90.7	Very high	82.1	Confident	7 Å²	7	62 Å²	62	3%	0.027	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-55.4	179.3	-175.9	-90.1	0	0	0	111.7	L119 S120 R121 C125 L126 D127 K139 W140 L143	L119-W123 WeakPolarHBondContact O-CB 3.47Å; L119-W123 PolarHBondContact O-N 3.01Å; S120-W123 WeakPolarHBondContact O-CB 3.33Å; S120-W123 PolarHBondContact O-N 3.47Å; R121-W123 VanDerWaalsContact C-N 3.27Å; R121-W123 PolarHBondContact O-N 2.83Å; W123-C125 PolarHBondContact O-N 3.02Å; W123-L126 PolarHBondContact O-N 3.43Å; W123-L126 VanDerWaalsContact O-N 3.13Å; W123-D127 HydrophobicContact CH2-CB 4.24Å; W123-D127 WeakPolarHBondContact CH2-OD2 3.41Å; W123-D127 HydrophobicContact CZ2-CB 3.89Å; W123-D127 WeakPolarHBondContact CZ2-OD2 3.48Å; W123-D127 PolarHBondContact O-N 2.89Å; W123-K139 HydrophobicContact CH2-CB 3.36Å; W123-K139 HydrophobicContact CH2-CD 3.68Å; W123-K139 HydrophobicContact CH2-CG 3.77Å; W123-K139 HydrophobicContact CZ2-CB 4.18Å; W123-K139 HydrophobicContact CZ2-CD 3.64Å; W123-K139 HydrophobicContact CZ2-CG 4.24Å; W123-K139 HydrophobicContact CZ3-CB 3.78Å; W123-K139 WeakPolarHBondContact CZ3-O 3.07Å; W123-W140 HydrophobicContact CB-CH2 3.93Å; W123-W140 HydrophobicContact CB-CZ3 4.49Å; W123-W140 HydrophobicContact CD2-CH2 4.47Å; W123-W140 HydrophobicContact CE3-CD2 4.11Å; W123-W140 AromaticContact CE3-CE3 3.92Å; W123-W140 HydrophobicContact CE3-CE3 3.92Å; W123-W140 AromaticContact CE3-CH2 3.81Å; W123-W140 HydrophobicContact CE3-CH2 3.81Å; W123-W140 AromaticContact CE3-CZ2 3.98Å; W123-W140 HydrophobicContact CE3-CZ2 3.98Å; W123-W140 AromaticContact CE3-CZ3 3.78Å; W123-W140 HydrophobicContact CE3-CZ3 3.78Å; W123-W140 HydrophobicContact CZ3-CD2 4.28Å; W123-W140 HydrophobicContact CZ3-CE3 4.25Å; W123-L143 HydrophobicContact CE3-CD1 3.57Å; W123-L143 HydrophobicContact CE3-CG 4.43Å; W123-L143 HydrophobicContact CZ3-CD1 3.6Å; W123-L143 HydrophobicContact CZ3-CG 3.96Å
124	I	91.2	Very high	79.9	Confident	82 Å²	82	57.6 Å²	57.6	42%	0.421	30%	0.301	S	S	.	.	H	α-helix	trans	-57	-41	179.9	-67.8	164.1	0	0	0	110.7	S120 R121 R177	S120-I124 VanDerWaalsContact O-CG1 3.27Å; S120-I124 WeakPolarHBondContact O-CG1 3.28Å; S120-I124 PolarHBondContact O-N 3.32Å; R121-I124 PolarHBondContact O-N 3.41Å; I124-R177 PolarHBondContact O-NH2 3.09Å
125	C	93.4	Very high	77.8	Confident	18 Å²	18	61.3 Å²	61.3	12%	0.122	32%	0.321	C	S	.	.	H	α-helix	trans	-70.4	-35.5	179.5	-69.8	0	0	0	0	113.2	R121 L122 W123 A169 E170 R177	R121-C125 WeakPolarHBondContact O-CB 3.31Å; R121-C125 PolarHBondContact O-N 2.9Å; R121-C125 PolarHBondContact O-SG 3.46Å; L122-C125 PolarHBondContact O-N 2.75Å; W123-C125 PolarHBondContact O-N 3.02Å; C125-A169 HydrophobicContact CB-CB 3.61Å; C125-E170 WeakPolarHBondContact SG-CG 3.18Å; C125-R177 PolarHBondContact O-NE 3.42Å; C125-R177 PolarHBondContact O-NH2 3.45Å
126	L	91.4	Very high	75.7	Confident	13 Å²	13	66.3 Å²	66.3	7%	0.068	35%	0.348	C	S	.	.	H	α-helix	trans	-92.9	-34	-175.8	-66.6	-177.3	0	0	0	114.2	L122 W123 L143 A169 A176 L180 F192	L122-L126 HydrophobicContact CD1-CD1 3.56Å; L122-L126 HydrophobicContact CD1-CG 4.06Å; L122-L126 HydrophobicContact CG-CD1 4.05Å; L122-L126 WeakPolarHBondContact O-CB 3.36Å; L122-L126 WeakPolarHBondContact O-CG 3.19Å; L122-L126 PolarHBondContact O-N 2.94Å; W123-L126 PolarHBondContact O-N 3.43Å; W123-L126 VanDerWaalsContact O-N 3.13Å; L126-L143 HydrophobicContact CB-CD1 4.33Å; L126-L143 HydrophobicContact CB-CD2 3.87Å; L126-L143 HydrophobicContact CD1-CD1 4.34Å; L126-L143 HydrophobicContact CD1-CD2 4.4Å; L126-A169 HydrophobicContact CD2-CB 3.86Å; L126-A169 HydrophobicContact CG-CB 4.03Å; L126-A176 HydrophobicContact CD2-CB 4Å; L126-L180 HydrophobicContact CB-CD2 4Å; L126-L180 HydrophobicContact CD2-CD2 4.41Å; L126-F192 HydrophobicContact CD1-CD1 4.49Å; L126-F192 HydrophobicContact CD1-CE1 3.98Å; L126-F192 HydrophobicContact CD2-CE1 4.47Å
127	D	82.2	Confident	73.9	Confident	28 Å²	28	66.1 Å²	66.1	15%	0.15	35%	0.354	C	S	.	.			trans	-120.5	64.4	-176.2	-169.4	16.8	0	0	0	112.7	W123 Q129 N130	W123-D127 HydrophobicContact CH2-CB 4.24Å; W123-D127 WeakPolarHBondContact CH2-OD2 3.41Å; W123-D127 HydrophobicContact CZ2-CB 3.89Å; W123-D127 WeakPolarHBondContact CZ2-OD2 3.48Å; W123-D127 PolarHBondContact O-N 2.89Å; D127-Q129 PolarHBondContact O-N 2.9Å; D127-N130 PolarHBondContact O-N 3.21Å; D127-N130 PolarHBondContact OD1-ND2 2.98Å; D127-N130 VanDerWaalsContact OD1-ND2 3.11Å; D127-N130 VanDerWaalsContact OD2-CB 3.3Å; D127-N130 WeakPolarHBondContact OD2-CB 3.25Å; D127-N130 PolarHBondContact OD2-ND2 3.1Å
128	S	64	Low	72.2	Confident	37 Å²	37	69.9 Å²	69.9	26%	0.259	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-68.1	-15.4	-178.2	61.1	0	0	0	0	115	N130 R177	S128-N130 VanDerWaalsContact C-N 3.3Å; S128-R177 VanDerWaalsContact CB-NH2 3.34Å; S128-R177 PolarHBondContact OG-NH1 3.16Å
129	Q	61.5	Low	71.4	Confident	169 Å²	169	71 Å²	71	79%	0.79	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-81.1	-15.9	-178.3	-64.3	-65.6	-16.3	0	0	111.9	D127	D127-Q129 PolarHBondContact O-N 2.9Å
130	N	56.7	Low	71.2	Confident	65 Å²	65	71.5 Å²	71.5	35%	0.348	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-119.8	32.8	-176.5	-61.5	-50.5	0	0	0	113.7	D127 S128 L132 S133	D127-N130 PolarHBondContact O-N 3.21Å; D127-N130 PolarHBondContact OD1-ND2 2.98Å; D127-N130 VanDerWaalsContact OD1-ND2 3.11Å; D127-N130 VanDerWaalsContact OD2-CB 3.3Å; D127-N130 WeakPolarHBondContact OD2-CB 3.25Å; D127-N130 PolarHBondContact OD2-ND2 3.1Å; S128-N130 VanDerWaalsContact C-N 3.3Å; N130-L132 PolarHBondContact O-N 2.82Å; N130-S133 PolarHBondContact O-N 2.9Å; N130-S133 PolarHBondContact O-OG 3.29Å
131	E	50.8	Low	71.1	Confident	138 Å²	138	71.2 Å²	71.2	65%	0.645	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-27.7	178.7	-75.2	-177.1	173.1	0	0	113.7
132	L	47	Very low	70.9	Confident	176 Å²	176	72.3 Å²	72.3	92%	0.921	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-2	-176.6	-74.4	161.4	0	0	0	116.1	N130	N130-L132 PolarHBondContact O-N 2.82Å
133	S	48.4	Very low	70.8	Confident	37 Å²	37	72.5 Å²	72.5	26%	0.259	38%	0.384	S	S	.	.			trans	-142.8	46.2	-170.5	44.1	0	0	0	0	114.1	N130 H135 K139	N130-S133 PolarHBondContact O-N 2.9Å; N130-S133 PolarHBondContact O-OG 3.29Å; S133-H135 PolarHBondContact O-N 3.21Å; S133-K139 VanDerWaalsContact CB-NZ 3.29Å; S133-K139 WeakPolarHBondContact O-CD 3.31Å; S133-K139 WeakPolarHBondContact O-CE 3.48Å; S133-K139 PolarHBondContact O-NZ 2.94Å; S133-K139 PolarHBondContact OG-NZ 3.15Å
134	S	50.5	Low	70.9	Confident	50 Å²	50	72.4 Å²	72.4	35%	0.35	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-3.5	176.7	50.6	0	0	0	0	115.6
135	H	53	Low	71	Confident	169 Å²	169	69 Å²	69	78%	0.782	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	0.5	-172.6	-62.6	-44	0	0	0	116.4	S133 G137	S133-H135 PolarHBondContact O-N 3.21Å; H135-G137 PolarHBondContact O-N 3.46Å
136	N	51.4	Low	70.9	Confident	116 Å²	116	74.2 Å²	74.2	62%	0.62	39%	0.39	S	S	*	.			trans	-84.3	104.3	172	-75.5	8.4	0	0	0	108.5	E138 K139	N136-E138 PolarHBondContact O-N 3.19Å; N136-K139 VanDerWaalsContact O-CB 3.25Å; N136-K139 WeakPolarHBondContact O-CB 3.28Å; N136-K139 VanDerWaalsContact O-CD 3.25Å; N136-K139 WeakPolarHBondContact O-CD 3.42Å; N136-K139 WeakPolarHBondContact O-CG 3.31Å
137	G	55.1	Low	70.7	Confident	44 Å²	44	76.5 Å²	76.5	45%	0.454	40%	0.404	S	S	.	.	S	Bend	trans	-69.7	56.1	-178	0	0	0	0	0	114.7	H135 E148	H135-G137 PolarHBondContact O-N 3.46Å; G137-E148 WeakPolarHBondContact O-CB 3.48Å; G137-E148 WeakPolarHBondContact O-CG 3.34Å; G137-E148 VanDerWaalsContact O-OE2 3.05Å
138	E	59	Low	70.8	Confident	161 Å²	161	78 Å²	78	75%	0.752	41%	0.411	S	S	*	.	S	Bend	trans	-117.9	23.5	159.5	-76.2	-171.7	155.9	0	0	110.5	N136 E148	N136-E138 PolarHBondContact O-N 3.19Å; E138-E148 VanDerWaalsContact C-OE2 3.32Å; E138-E148 WeakPolarHBondContact CA-OE1 3.35Å; E138-E148 WeakPolarHBondContact CA-OE2 3.28Å; E138-E148 PolarHBondContact N-OE2 2.9Å
139	K	78.9	Confident	71.9	Confident	25 Å²	25	79.9 Å²	79.9	11%	0.109	42%	0.418	C	S	.	.	S	Bend	trans	-126.8	-35.5	-148.2	-90.4	-169.8	176.6	-147.4	0	113.3	W123 S133 N136 T141 L142 L143 E148	W123-K139 HydrophobicContact CH2-CB 3.36Å; W123-K139 HydrophobicContact CH2-CD 3.68Å; W123-K139 HydrophobicContact CH2-CG 3.77Å; W123-K139 HydrophobicContact CZ2-CB 4.18Å; W123-K139 HydrophobicContact CZ2-CD 3.64Å; W123-K139 HydrophobicContact CZ2-CG 4.24Å; W123-K139 HydrophobicContact CZ3-CB 3.78Å; W123-K139 WeakPolarHBondContact CZ3-O 3.07Å; S133-K139 VanDerWaalsContact CB-NZ 3.29Å; S133-K139 WeakPolarHBondContact O-CD 3.31Å; S133-K139 WeakPolarHBondContact O-CE 3.48Å; S133-K139 PolarHBondContact O-NZ 2.94Å; S133-K139 PolarHBondContact OG-NZ 3.15Å; N136-K139 VanDerWaalsContact O-CB 3.25Å; N136-K139 WeakPolarHBondContact O-CB 3.28Å; N136-K139 VanDerWaalsContact O-CD 3.25Å; N136-K139 WeakPolarHBondContact O-CD 3.42Å; N136-K139 WeakPolarHBondContact O-CG 3.31Å; K139-T141 VanDerWaalsContact C-N 3.28Å; K139-T141 PolarHBondContact O-N 3.48Å; K139-L142 WeakPolarHBondContact O-CB 3.45Å; K139-L142 PolarHBondContact O-N 3.43Å; K139-L143 PolarHBondContact O-N 3.37Å; K139-E148 PolarHBondContact N-OE1 2.93Å; K139-E148 PolarHBondContact N-OE2 3.15Å
140	W	89.4	Confident	73.2	Confident	33 Å²	33	72 Å²	72	13%	0.125	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-32.3	175	-68.1	108.1	0	0	0	111	L119 L122 W123 L142 L143 G144 F145 E148 P150	L119-W140 HydrophobicContact CB-CH2 3.97Å; L119-W140 HydrophobicContact CB-CZ2 4.3Å; L119-W140 HydrophobicContact CD2-CH2 3.88Å; L119-W140 HydrophobicContact CD2-CZ2 4.41Å; L119-W140 HydrophobicContact CD2-CZ3 4.11Å; L119-W140 HydrophobicContact CG-CH2 4.43Å; L119-W140 WeakPolarHBondContact O-CH2 3.13Å; L122-W140 HydrophobicContact CD2-CZ3 4.48Å; W123-W140 HydrophobicContact CB-CH2 3.93Å; W123-W140 HydrophobicContact CB-CZ3 4.49Å; W123-W140 HydrophobicContact CD2-CH2 4.47Å; W123-W140 HydrophobicContact CE3-CD2 4.11Å; W123-W140 AromaticContact CE3-CE3 3.92Å; W123-W140 HydrophobicContact CE3-CE3 3.92Å; W123-W140 AromaticContact CE3-CH2 3.81Å; W123-W140 HydrophobicContact CE3-CH2 3.81Å; W123-W140 AromaticContact CE3-CZ2 3.98Å; W123-W140 HydrophobicContact CE3-CZ2 3.98Å; W123-W140 AromaticContact CE3-CZ3 3.78Å; W123-W140 HydrophobicContact CE3-CZ3 3.78Å; W123-W140 HydrophobicContact CZ3-CD2 4.28Å; W123-W140 HydrophobicContact CZ3-CE3 4.25Å; W140-L142 PolarHBondContact O-N 3.11Å; W140-L143 HydrophobicContact CE3-CD1 3.88Å; W140-L143 HydrophobicContact CZ3-CD1 3.89Å; W140-L143 CarbonylContact O-C 3.58Å; W140-L143 WeakPolarHBondContact O-CA 3.34Å; W140-L143 PolarHBondContact O-N 3.12Å; W140-G144 PolarHBondContact O-N 2.98Å; W140-F145 HydrophobicContact CB-CB 4.13Å; W140-F145 HydrophobicContact CB-CD2 4.03Å; W140-F145 HydrophobicContact CB-CG 4.36Å; W140-F145 HydrophobicContact CD2-CD2 4.48Å; W140-F145 AromaticContact CE3-CD2 3.74Å; W140-F145 HydrophobicContact CE3-CD2 3.74Å; W140-F145 AromaticContact CE3-CE2 3.55Å; W140-F145 HydrophobicContact CE3-CE2 3.55Å; W140-F145 HydrophobicContact CE3-CZ 4.46Å; W140-F145 HydrophobicContact CZ3-CE2 4Å; W140-F145 WeakPolarHBondContact O-CB 3.4Å; W140-F145 WeakPolarHBondContact O-CD2 3.4Å; W140-F145 PolarHBondContact O-N 3.27Å; W140-F145 VanDerWaalsContact O-N 3.09Å; W140-E148 PolarHBondContact N-OE2 3.43Å; W140-P150 HydrophobicContact CD2-CG 4.1Å; W140-P150 HydrophobicContact CE3-CG 4.46Å; W140-P150 HydrophobicContact CG-CG 4.29Å
141	T	89.2	Confident	74.7	Confident	55 Å²	55	72.4 Å²	72.4	34%	0.337	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-62.9	-31.4	173.1	56.4	0	0	0	0	112.4	K139 L143 G144 E148	K139-T141 VanDerWaalsContact C-N 3.28Å; K139-T141 PolarHBondContact O-N 3.48Å; T141-L143 VanDerWaalsContact C-N 3.3Å; T141-L143 PolarHBondContact O-N 3.26Å; T141-G144 WeakPolarHBondContact O-CA 3.2Å; T141-G144 PolarHBondContact O-N 2.92Å; T141-E148 WeakPolarHBondContact CB-OE1 3.3Å; T141-E148 HydrophobicContact CG2-CG 4.28Å; T141-E148 WeakPolarHBondContact CG2-OE1 3.45Å; T141-E148 PolarHBondContact OG1-OE1 3.35Å
142	L	89.2	Confident	76.5	Confident	95 Å²	95	68.1 Å²	68.1	50%	0.497	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-66.5	-29.3	171.3	-61.6	175.3	0	0	0	112.5	K139 W140 G144 H184	K139-L142 WeakPolarHBondContact O-CB 3.45Å; K139-L142 PolarHBondContact O-N 3.43Å; W140-L142 PolarHBondContact O-N 3.11Å; L142-G144 PolarHBondContact O-N 3.02Å; L142-H184 PolarHBondContact O-CE1 3.44Å; L142-H184 PolarHBondContact O-NE2 2.99Å
143	L	92.8	Very high	78.7	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.026	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-80.7	0.6	171.1	-57.4	-173.4	0	0	0	112.5	W123 L126 K139 W140 T141 F145 L180 A193	W123-L143 HydrophobicContact CE3-CD1 3.57Å; W123-L143 HydrophobicContact CE3-CG 4.43Å; W123-L143 HydrophobicContact CZ3-CD1 3.6Å; W123-L143 HydrophobicContact CZ3-CG 3.96Å; L126-L143 HydrophobicContact CB-CD1 4.33Å; L126-L143 HydrophobicContact CB-CD2 3.87Å; L126-L143 HydrophobicContact CD1-CD1 4.34Å; L126-L143 HydrophobicContact CD1-CD2 4.4Å; K139-L143 PolarHBondContact O-N 3.37Å; W140-L143 HydrophobicContact CE3-CD1 3.88Å; W140-L143 HydrophobicContact CZ3-CD1 3.89Å; W140-L143 CarbonylContact O-C 3.58Å; W140-L143 WeakPolarHBondContact O-CA 3.34Å; W140-L143 PolarHBondContact O-N 3.12Å; T141-L143 VanDerWaalsContact C-N 3.3Å; T141-L143 PolarHBondContact O-N 3.26Å; L143-F145 HydrophobicContact CB-CD2 4.11Å; L143-F145 HydrophobicContact CB-CE2 4.26Å; L143-L180 HydrophobicContact CD2-CD2 3.63Å; L143-A193 WeakPolarHBondContact O-CB 3.23Å; L143-A193 PolarHBondContact O-N 3.46Å
144	G	93.2	Very high	80.8	Confident	5 Å²	5	58.9 Å²	58.9	5%	0.052	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	25	179.1	0	0	0	0	0	114.5	W140 T141 L142 P191 V194	W140-G144 PolarHBondContact O-N 2.98Å; T141-G144 WeakPolarHBondContact O-CA 3.2Å; T141-G144 PolarHBondContact O-N 2.92Å; L142-G144 PolarHBondContact O-N 3.02Å; G144-P191 WeakPolarHBondContact O-CB 3.45Å; G144-V194 VanDerWaalsContact O-CG2 3.23Å; G144-V194 WeakPolarHBondContact O-CG2 3.33Å; G144-V194 PolarHBondContact O-N 2.88Å; G144-V194 VanDerWaalsContact O-N 3.16Å
145	F	94	Very high	82.5	Confident	9 Å²	9	66 Å²	66	4%	0.039	33%	0.332	C	S	.	.			trans	-76.6	158.1	163.7	-71.2	-83.1	0	0	0	111.1	L122 W140 L143 P150 D153 F154 L165 A193 I197	L122-F145 HydrophobicContact CD2-CE2 4.17Å; L122-F145 HydrophobicContact CD2-CZ 3.94Å; W140-F145 HydrophobicContact CB-CB 4.13Å; W140-F145 HydrophobicContact CB-CD2 4.03Å; W140-F145 HydrophobicContact CB-CG 4.36Å; W140-F145 HydrophobicContact CD2-CD2 4.48Å; W140-F145 AromaticContact CE3-CD2 3.74Å; W140-F145 HydrophobicContact CE3-CD2 3.74Å; W140-F145 AromaticContact CE3-CE2 3.55Å; W140-F145 HydrophobicContact CE3-CE2 3.55Å; W140-F145 HydrophobicContact CE3-CZ 4.46Å; W140-F145 HydrophobicContact CZ3-CE2 4Å; W140-F145 WeakPolarHBondContact O-CB 3.4Å; W140-F145 WeakPolarHBondContact O-CD2 3.4Å; W140-F145 PolarHBondContact O-N 3.27Å; W140-F145 VanDerWaalsContact O-N 3.09Å; L143-F145 HydrophobicContact CB-CD2 4.11Å; L143-F145 HydrophobicContact CB-CE2 4.26Å; F145-P150 HydrophobicContact CD1-CB 3.49Å; F145-P150 VanDerWaalsContact CD1-CB 3.49Å; F145-P150 HydrophobicContact CD2-CB 4.3Å; F145-P150 HydrophobicContact CE1-CB 3.58Å; F145-P150 HydrophobicContact CE2-CB 4.38Å; F145-P150 HydrophobicContact CG-CB 3.87Å; F145-P150 HydrophobicContact CZ-CB 4.03Å; F145-D153 HydrophobicContact CD1-CB 4.15Å; F145-F154 AromaticContact CE1-CE1 3.75Å; F145-F154 HydrophobicContact CE1-CE1 3.75Å; F145-F154 AromaticContact CE1-CZ 3.59Å; F145-F154 HydrophobicContact CE1-CZ 3.59Å; F145-F154 HydrophobicContact CZ-CE1 4.32Å; F145-F154 AromaticContact CZ-CZ 3.99Å; F145-F154 HydrophobicContact CZ-CZ 3.99Å; F145-L165 HydrophobicContact CZ-CD1 4.39Å; F145-A193 HydrophobicContact CD1-CB 3.88Å; F145-A193 HydrophobicContact CD2-CB 3.62Å; F145-A193 HydrophobicContact CE1-CB 3.76Å; F145-A193 HydrophobicContact CE2-CB 3.49Å; F145-A193 VanDerWaalsContact CE2-CB 3.49Å; F145-A193 HydrophobicContact CG-CB 3.82Å; F145-A193 HydrophobicContact CZ-CB 3.58Å; F145-I197 HydrophobicContact CE1-CD1 4.27Å
146	Q	90.4	Very high	84.1	Confident	129 Å²	129	60.4 Å²	60.4	60%	0.603	32%	0.32	S	S	*	.	S	Bend	trans	-73.2	-33.7	-177	-74.1	179.5	-4.5	0	0	112.9	D153 V194	Q146-D153 WeakPolarHBondContact CB-OD1 3.38Å; Q146-D153 WeakPolarHBondContact CG-OD1 3.4Å; Q146-D153 PolarHBondContact N-OD2 3.46Å; Q146-D153 VanDerWaalsContact N-OD2 3.09Å; Q146-D153 PolarHBondContact OE1-OD1 3.09Å; Q146-V194 HydrophobicContact CG-CG2 3.74Å
147	T	88	Confident	86.3	Confident	60 Å²	60	55 Å²	55	37%	0.368	29%	0.291	S	S	.	.	S	Bend	trans	-136.6	175.7	-178.3	80.7	0	0	0	0	109.9	N149	T147-N149 PolarHBondContact O-N 3.33Å; T147-N149 PolarHBondContact OG1-N 3.41Å; T147-N149 VanDerWaalsContact OG1-N 3.13Å; T147-N149 PolarHBondContact OG1-O 3.33Å
148	E	84.5	Confident	88.3	Confident	61 Å²	61	53.1 Å²	53.1	29%	0.285	27%	0.271	S	S	.	.	S	Bend	trans	-75.4	-9.9	176.7	-60.2	-63.9	160.4	0	0	113	G137 E138 K139 W140 T141	G137-E148 WeakPolarHBondContact O-CB 3.48Å; G137-E148 WeakPolarHBondContact O-CG 3.34Å; G137-E148 VanDerWaalsContact O-OE2 3.05Å; E138-E148 VanDerWaalsContact C-OE2 3.32Å; E138-E148 WeakPolarHBondContact CA-OE1 3.35Å; E138-E148 WeakPolarHBondContact CA-OE2 3.28Å; E138-E148 PolarHBondContact N-OE2 2.9Å; K139-E148 PolarHBondContact N-OE1 2.93Å; K139-E148 PolarHBondContact N-OE2 3.15Å; W140-E148 PolarHBondContact N-OE2 3.43Å; T141-E148 WeakPolarHBondContact CB-OE1 3.3Å; T141-E148 HydrophobicContact CG2-CG 4.28Å; T141-E148 WeakPolarHBondContact CG2-OE1 3.45Å; T141-E148 PolarHBondContact OG1-OE1 3.35Å
149	N	86.7	Confident	90.1	Very high	76 Å²	76	46 Å²	46	41%	0.406	24%	0.238	S	C	.	.			trans	-107.9	104.8	165	-175.8	0.1	0	0	0	109.9	T147 E151	T147-N149 PolarHBondContact O-N 3.33Å; T147-N149 PolarHBondContact OG1-N 3.41Å; T147-N149 VanDerWaalsContact OG1-N 3.13Å; T147-N149 PolarHBondContact OG1-O 3.33Å; N149-E151 PolarHBondContact ND2-OE2 3.05Å; N149-E151 PolarHBondContact O-N 3.47Å; N149-E151 VanDerWaalsContact O-N 3.17Å; N149-E151 WeakPolarHBondContact OD1-CB 3.13Å; N149-E151 PolarHBondContact OD1-N 2.85Å; N149-E151 VanDerWaalsContact OD1-N 3.08Å
150	P	88.9	Confident	91	Very high	4 Å²	4	44.9 Å²	44.9	3%	0.026	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-67	-15.2	-178	28.6	-35.7	0	0	0	113.6	L119 W140 F145 T152 D153 F154	L119-P150 HydrophobicContact CD1-CG 3.89Å; L119-P150 HydrophobicContact CD2-CB 4.35Å; L119-P150 HydrophobicContact CD2-CG 3.82Å; W140-P150 HydrophobicContact CD2-CG 4.1Å; W140-P150 HydrophobicContact CE3-CG 4.46Å; W140-P150 HydrophobicContact CG-CG 4.29Å; F145-P150 HydrophobicContact CD1-CB 3.49Å; F145-P150 VanDerWaalsContact CD1-CB 3.49Å; F145-P150 HydrophobicContact CD2-CB 4.3Å; F145-P150 HydrophobicContact CE1-CB 3.58Å; F145-P150 HydrophobicContact CE2-CB 4.38Å; F145-P150 HydrophobicContact CG-CB 3.87Å; F145-P150 HydrophobicContact CZ-CB 4.03Å; P150-T152 PolarHBondContact O-N 3.27Å; P150-T152 VanDerWaalsContact O-N 3.14Å; P150-D153 WeakPolarHBondContact O-CB 3.3Å; P150-D153 PolarHBondContact O-N 3.36Å; P150-F154 HydrophobicContact CB-CE2 3.97Å; P150-F154 HydrophobicContact CB-CZ 4.08Å; P150-F154 HydrophobicContact CG-CE2 4.48Å; P150-F154 WeakPolarHBondContact O-CD2 3.36Å; P150-F154 WeakPolarHBondContact O-CE2 3.37Å
151	E	88.7	Confident	91.5	Very high	73 Å²	73	43.3 Å²	43.3	34%	0.341	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-51	-41.2	-178.8	176.4	177	-177.8	0	0	113	F108 N149 D153 F154	F108-E151 HydrophobicContact CD1-CB 3.91Å; F108-E151 HydrophobicContact CD1-CG 3.79Å; F108-E151 HydrophobicContact CE1-CB 4.31Å; N149-E151 PolarHBondContact ND2-OE2 3.05Å; N149-E151 PolarHBondContact O-N 3.47Å; N149-E151 VanDerWaalsContact O-N 3.17Å; N149-E151 WeakPolarHBondContact OD1-CB 3.13Å; N149-E151 PolarHBondContact OD1-N 2.85Å; N149-E151 VanDerWaalsContact OD1-N 3.08Å; E151-D153 PolarHBondContact O-N 2.89Å; E151-F154 PolarHBondContact O-N 3.43Å
152	T	88.3	Confident	91.9	Very high	47 Å²	47	40.7 Å²	40.7	29%	0.288	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-67.9	-22.1	-175.9	65.7	0	0	0	0	113.4	P150 R155	P150-T152 PolarHBondContact O-N 3.27Å; P150-T152 VanDerWaalsContact O-N 3.14Å; T152-R155 PolarHBondContact O-NE 3.06Å; T152-R155 PolarHBondContact O-NH2 2.62Å
153	D	92.3	Very high	92.3	Very high	17 Å²	17	38 Å²	38	9%	0.091	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-78.4	-27.4	179.2	-72.8	-70.6	0	0	0	111.9	F145 Q146 P150 E151 R155 I197	F145-D153 HydrophobicContact CD1-CB 4.15Å; Q146-D153 WeakPolarHBondContact CB-OD1 3.38Å; Q146-D153 WeakPolarHBondContact CG-OD1 3.4Å; Q146-D153 PolarHBondContact N-OD2 3.46Å; Q146-D153 VanDerWaalsContact N-OD2 3.09Å; Q146-D153 PolarHBondContact OE1-OD1 3.09Å; P150-D153 WeakPolarHBondContact O-CB 3.3Å; P150-D153 PolarHBondContact O-N 3.36Å; E151-D153 PolarHBondContact O-N 2.89Å; D153-R155 VanDerWaalsContact C-N 3.32Å; D153-R155 PolarHBondContact O-N 2.73Å; D153-I197 HydrophobicContact CB-CD1 3.58Å
154	F	92.7	Very high	92.6	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-79.1	-8.1	-176.2	-55.4	-49.5	0	0	0	114.4	F108 L119 F145 P150 E151 G156 M157 G158 S161 L162 I197	F108-F154 HydrophobicContact CB-CB 4.38Å; F108-F154 HydrophobicContact CB-CD2 3.95Å; F108-F154 AromaticContact CD2-CD2 3.99Å; F108-F154 HydrophobicContact CD2-CD2 3.99Å; F108-F154 HydrophobicContact CD2-CE2 4.13Å; F108-F154 AromaticContact CG-CD2 3.95Å; F108-F154 HydrophobicContact CG-CD2 3.95Å; F108-F154 HydrophobicContact CG-CE2 4.43Å; L119-F154 HydrophobicContact CD2-CE2 4.13Å; L119-F154 HydrophobicContact CD2-CZ 4.08Å; F145-F154 AromaticContact CE1-CE1 3.75Å; F145-F154 HydrophobicContact CE1-CE1 3.75Å; F145-F154 AromaticContact CE1-CZ 3.59Å; F145-F154 HydrophobicContact CE1-CZ 3.59Å; F145-F154 HydrophobicContact CZ-CE1 4.32Å; F145-F154 AromaticContact CZ-CZ 3.99Å; F145-F154 HydrophobicContact CZ-CZ 3.99Å; P150-F154 HydrophobicContact CB-CE2 3.97Å; P150-F154 HydrophobicContact CB-CZ 4.08Å; P150-F154 HydrophobicContact CG-CE2 4.48Å; P150-F154 WeakPolarHBondContact O-CD2 3.36Å; P150-F154 WeakPolarHBondContact O-CE2 3.37Å; E151-F154 PolarHBondContact O-N 3.43Å; F154-G156 PolarHBondContact O-N 3.16Å; F154-M157 PolarHBondContact O-N 3.46Å; F154-M157 VanDerWaalsContact O-N 3.09Å; F154-G158 WeakPolarHBondContact O-CA 3.4Å; F154-G158 PolarHBondContact O-N 2.7Å; F154-S161 WeakPolarHBondContact CD1-OG 3.36Å; F154-L162 HydrophobicContact CD1-CB 4.36Å; F154-L162 HydrophobicContact CE1-CB 3.96Å; F154-L162 HydrophobicContact CE1-CD1 4.36Å; F154-L162 HydrophobicContact CE2-CD2 4.32Å; F154-L162 HydrophobicContact CZ-CB 4.11Å; F154-L162 HydrophobicContact CZ-CD1 3.93Å; F154-L162 HydrophobicContact CZ-CD2 4.33Å; F154-L162 HydrophobicContact CZ-CG 4.34Å; F154-I197 HydrophobicContact CD1-CD1 3.85Å; F154-I197 HydrophobicContact CD1-CG1 4.33Å; F154-I197 HydrophobicContact CE1-CD1 3.9Å; F154-I197 HydrophobicContact CE1-CG1 4.4Å
155	R	85.8	Confident	92.9	Very high	201 Å²	201	37.7 Å²	37.7	76%	0.758	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-50.5	-36.1	-172.6	-73.4	-177.6	-79.2	-177.6	-7.6	115.1	T152 D153	T152-R155 PolarHBondContact O-NE 3.06Å; T152-R155 PolarHBondContact O-NH2 2.62Å; D153-R155 VanDerWaalsContact C-N 3.32Å; D153-R155 PolarHBondContact O-N 2.73Å
156	G	88.2	Confident	93.1	Very high	51 Å²	51	37.4 Å²	37.4	53%	0.526	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-83.7	-22.3	-176.3	0	0	0	0	0	115.5	F154	F154-G156 PolarHBondContact O-N 3.16Å
157	M	97	Very high	93.5	Very high	3 Å²	3	33 Å²	33	2%	0.015	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.6	5.1	-173.2	-76.9	-54.2	-65.8	0	0	114.3	R104 F154 L160 T200 K201 Y204	R104-M157 WeakPolarHBondContact CA-O 3.26Å; R104-M157 HydrophobicContact CB-CE 4.5Å; R104-M157 HydrophobicContact CG-CE 3.8Å; R104-M157 HydrophobicContact CG-SD 3.82Å; R104-M157 CarbonylContact O-C 3.34Å; F154-M157 PolarHBondContact O-N 3.46Å; F154-M157 VanDerWaalsContact O-N 3.09Å; M157-L160 HydrophobicContact CE-CD2 3.66Å; M157-L160 HydrophobicContact CE-CG 4.35Å; M157-L160 WeakPolarHBondContact O-CB 3.46Å; M157-L160 PolarHBondContact O-N 2.79Å; M157-T200 HydrophobicContact CB-CG2 4.35Å; M157-T200 HydrophobicContact CE-CG2 3.55Å; M157-T200 HydrophobicContact CG-CG2 4.34Å; M157-K201 HydrophobicContact CG-CB 3.79Å; M157-K201 HydrophobicContact CG-CD 4.01Å; M157-K201 HydrophobicContact SD-CB 3.88Å; M157-K201 HydrophobicContact SD-CD 3.22Å; M157-K201 WeakPolarHBondContact SD-CD 3.16Å; M157-K201 HydrophobicContact SD-CG 4.17Å; M157-Y204 HydrophobicContact CE-CD1 4.39Å; M157-Y204 HydrophobicContact CE-CD2 4.48Å; M157-Y204 HydrophobicContact CE-CG 3.91Å
158	G	96.4	Very high	94	Very high	4 Å²	4	30.2 Å²	30.2	4%	0.041	15%	0.153	C	C	.	.	H	α-helix	trans	53.8	-154.5	179.4	0	0	0	0	0	112.8	R104 T106 F154 L160 S161	R104-G158 WeakPolarHBondContact O-CA 3.38Å; R104-G158 PolarHBondContact O-N 2.65Å; T106-G158 VanDerWaalsContact O-CA 3.23Å; T106-G158 WeakPolarHBondContact O-CA 3.41Å; F154-G158 WeakPolarHBondContact O-CA 3.4Å; F154-G158 PolarHBondContact O-N 2.7Å; G158-L160 PolarHBondContact O-N 2.86Å; G158-S161 PolarHBondContact O-N 3.48Å; G158-S161 PolarHBondContact O-OG 3.36Å
159	I	97.5	Very high	94.6	Very high	11 Å²	11	27.4 Å²	27.4	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-65.2	-20.5	177.5	60	167.7	0	0	0	113.1	S103 T106 Y114 S161 L162 E163	S103-I159 WeakPolarHBondContact O-CG1 3.47Å; S103-I159 PolarHBondContact O-N 3.44Å; T106-I159 HydrophobicContact CG2-CD1 3.67Å; T106-I159 HydrophobicContact CG2-CG1 4.02Å; T106-I159 HydrophobicContact CG2-CG2 4.29Å; T106-I159 PolarHBondContact O-N 2.72Å; Y114-I159 HydrophobicContact CE1-CD1 4.25Å; I159-S161 PolarHBondContact O-N 2.92Å; I159-L162 CarbonylContact O-C 3.58Å; I159-L162 WeakPolarHBondContact O-CA 3.42Å; I159-L162 WeakPolarHBondContact O-CB 3.35Å; I159-L162 PolarHBondContact O-N 2.86Å; I159-E163 WeakPolarHBondContact O-CG 3.28Å; I159-E163 PolarHBondContact O-N 3.45Å
160	L	98.6	Very high	95.1	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-54.9	-40.2	176.9	177.6	58.8	0	0	0	112.1	L100 S103 R104 M157 G158 E163 N164 T200 Y204 F228	L100-L160 HydrophobicContact CB-CD2 4.24Å; L100-L160 HydrophobicContact CD2-CD1 3.68Å; L100-L160 HydrophobicContact CD2-CD2 4.24Å; S103-L160 WeakPolarHBondContact OG-CA 3.2Å; S103-L160 WeakPolarHBondContact OG-CB 3.38Å; S103-L160 PolarHBondContact OG-N 3.32Å; S103-L160 VanDerWaalsContact OG-N 3.13Å; R104-L160 HydrophobicContact CB-CB 4.41Å; R104-L160 HydrophobicContact CB-CD2 4.15Å; M157-L160 HydrophobicContact CE-CD2 3.66Å; M157-L160 HydrophobicContact CE-CG 4.35Å; M157-L160 WeakPolarHBondContact O-CB 3.46Å; M157-L160 PolarHBondContact O-N 2.79Å; G158-L160 PolarHBondContact O-N 2.86Å; L160-E163 PolarHBondContact O-N 3.09Å; L160-N164 WeakPolarHBondContact O-CB 3.33Å; L160-N164 VanDerWaalsContact O-CG 3.31Å; L160-N164 PolarHBondContact O-N 3.31Å; L160-T200 HydrophobicContact CD2-CG2 4.3Å; L160-T200 HydrophobicContact CG-CG2 3.9Å; L160-Y204 HydrophobicContact CD2-CD2 4.24Å; L160-F228 HydrophobicContact CD1-CE1 4.26Å
161	S	98.4	Very high	95.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.7	-34.2	177.5	59.8	0	0	0	0	113.7	F154 G158 I159 L165	F154-S161 WeakPolarHBondContact CD1-OG 3.36Å; G158-S161 PolarHBondContact O-N 3.48Å; G158-S161 PolarHBondContact O-OG 3.36Å; I159-S161 PolarHBondContact O-N 2.92Å; S161-L165 WeakPolarHBondContact O-CG 3.47Å; S161-L165 PolarHBondContact O-N 3.42Å; S161-L165 VanDerWaalsContact O-N 3.13Å
162	L	98	Very high	95.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.4	-44.4	173.5	178	56.5	0	0	0	111.1	F108 L118 L119 L122 F154 I159 N164 L165 V166	F108-L162 HydrophobicContact CD2-CD2 3.91Å; F108-L162 HydrophobicContact CE2-CD2 3.85Å; L118-L162 HydrophobicContact CB-CD1 4.45Å; L118-L162 HydrophobicContact CB-CD2 3.6Å; L118-L162 HydrophobicContact CB-CG 3.81Å; L118-L162 HydrophobicContact CD1-CD2 4.1Å; L118-L162 HydrophobicContact CD1-CG 4.2Å; L119-L162 HydrophobicContact CD2-CD1 3.88Å; L119-L162 HydrophobicContact CD2-CD2 4.18Å; L119-L162 HydrophobicContact CG-CD2 4.11Å; L122-L162 HydrophobicContact CD2-CD1 3.9Å; F154-L162 HydrophobicContact CD1-CB 4.36Å; F154-L162 HydrophobicContact CE1-CB 3.96Å; F154-L162 HydrophobicContact CE1-CD1 4.36Å; F154-L162 HydrophobicContact CE2-CD2 4.32Å; F154-L162 HydrophobicContact CZ-CB 4.11Å; F154-L162 HydrophobicContact CZ-CD1 3.93Å; F154-L162 HydrophobicContact CZ-CD2 4.33Å; F154-L162 HydrophobicContact CZ-CG 4.34Å; I159-L162 CarbonylContact O-C 3.58Å; I159-L162 WeakPolarHBondContact O-CA 3.42Å; I159-L162 WeakPolarHBondContact O-CB 3.35Å; I159-L162 PolarHBondContact O-N 2.86Å; L162-N164 VanDerWaalsContact C-N 3.31Å; L162-N164 PolarHBondContact O-N 2.85Å; L162-L165 PolarHBondContact O-N 3.1Å; L162-V166 HydrophobicContact CD1-CG2 4.07Å; L162-V166 HydrophobicContact CG-CG2 4.45Å; L162-V166 VanDerWaalsContact O-CG2 3.32Å; L162-V166 WeakPolarHBondContact O-CG2 3.46Å; L162-V166 PolarHBondContact O-N 2.88Å
163	E	98.6	Very high	96.2	Very high	39 Å²	39	26.8 Å²	26.8	18%	0.182	14%	0.14	C	C	.	.	H	α-helix	trans	-57.9	-42.6	175.1	-70.8	177.1	154.1	0	0	111.7	S103 Y114 L118 I159 L160 Y167	S103-E163 PolarHBondContact OG-OE2 2.85Å; Y114-E163 PolarHBondContact OH-OE1 3.37Å; L118-E163 HydrophobicContact CD1-CG 3.88Å; I159-E163 WeakPolarHBondContact O-CG 3.28Å; I159-E163 PolarHBondContact O-N 3.45Å; L160-E163 PolarHBondContact O-N 3.09Å; E163-Y167 VanDerWaalsContact O-CB 3.3Å; E163-Y167 WeakPolarHBondContact O-CB 3.16Å; E163-Y167 PolarHBondContact O-N 3.46Å
164	N	98.8	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-44.6	174.8	-78.9	171.3	0	0	0	112.3	L160 L162 Y167 F168 T200 F228 N229 Y232	L160-N164 WeakPolarHBondContact O-CB 3.33Å; L160-N164 VanDerWaalsContact O-CG 3.31Å; L160-N164 PolarHBondContact O-N 3.31Å; L162-N164 VanDerWaalsContact C-N 3.31Å; L162-N164 PolarHBondContact O-N 2.85Å; N164-Y167 PolarHBondContact O-N 3.21Å; N164-F168 PolarHBondContact O-N 3.04Å; N164-T200 HydrophobicContact CB-CG2 4.5Å; N164-T200 WeakPolarHBondContact OD1-CG2 3.4Å; N164-T200 PolarHBondContact OD1-OG1 2.92Å; N164-F228 WeakPolarHBondContact OD1-CE1 3.23Å; N164-N229 PolarHBondContact ND2-OD1 2.81Å; N164-Y232 VanDerWaalsContact C-CE1 3.49Å; N164-Y232 HydrophobicContact CB-CD1 3.72Å; N164-Y232 HydrophobicContact CB-CD2 3.99Å; N164-Y232 HydrophobicContact CB-CE1 3.7Å; N164-Y232 HydrophobicContact CB-CE2 3.98Å; N164-Y232 HydrophobicContact CB-CG 3.86Å; N164-Y232 WeakPolarHBondContact O-CE1 3.44Å
165	L	98.5	Very high	96.6	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-47.6	176.2	-79.4	165.9	0	0	0	112	L122 F145 S161 L162 F168 A169 F192 A193 I197	L122-L165 HydrophobicContact CD1-CB 3.96Å; L122-L165 HydrophobicContact CD2-CB 4.17Å; L122-L165 HydrophobicContact CD2-CD1 4.45Å; F145-L165 HydrophobicContact CZ-CD1 4.39Å; S161-L165 WeakPolarHBondContact O-CG 3.47Å; S161-L165 PolarHBondContact O-N 3.42Å; S161-L165 VanDerWaalsContact O-N 3.13Å; L162-L165 PolarHBondContact O-N 3.1Å; L165-F168 PolarHBondContact O-N 2.94Å; L165-A169 WeakPolarHBondContact O-CB 3.35Å; L165-A169 PolarHBondContact O-N 3.25Å; L165-F192 HydrophobicContact CD2-CE1 4.35Å; L165-A193 HydrophobicContact CD1-CB 4.46Å; L165-I197 HydrophobicContact CD1-CG1 4.12Å
166	V	98.3	Very high	97.1	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-48.8	177.5	171.6	0	0	0	0	110.4	L118 R121 L122 L162 F168 A169 E170	L118-V166 HydrophobicContact CB-CG2 4.18Å; L118-V166 HydrophobicContact CD2-CB 4.24Å; L118-V166 HydrophobicContact CD2-CG1 4.13Å; L118-V166 HydrophobicContact CD2-CG2 4Å; L118-V166 WeakPolarHBondContact O-CG2 3.28Å; R121-V166 HydrophobicContact CB-CG1 4.21Å; L122-V166 HydrophobicContact CB-CG2 3.83Å; L162-V166 HydrophobicContact CD1-CG2 4.07Å; L162-V166 HydrophobicContact CG-CG2 4.45Å; L162-V166 VanDerWaalsContact O-CG2 3.32Å; L162-V166 WeakPolarHBondContact O-CG2 3.46Å; L162-V166 PolarHBondContact O-N 2.88Å; V166-F168 VanDerWaalsContact C-N 3.29Å; V166-F168 PolarHBondContact O-N 3.22Å; V166-A169 PolarHBondContact O-N 3.24Å; V166-A169 VanDerWaalsContact O-N 3.12Å; V166-E170 HydrophobicContact CG1-CG 4.21Å; V166-E170 WeakPolarHBondContact O-CB 3.38Å; V166-E170 WeakPolarHBondContact O-CG 3.4Å; V166-E170 PolarHBondContact O-N 2.65Å
167	Y	98.7	Very high	97.5	Very high	38 Å²	38	28.8 Å²	28.8	15%	0.149	14%	0.138	C	C	.	.	H	α-helix	trans	-57	-44	179.2	-175	-81.2	0	0	0	111.9	E163 N164 E170 S171 Q226 N229 E230	E163-Y167 VanDerWaalsContact O-CB 3.3Å; E163-Y167 WeakPolarHBondContact O-CB 3.16Å; E163-Y167 PolarHBondContact O-N 3.46Å; N164-Y167 PolarHBondContact O-N 3.21Å; Y167-E170 PolarHBondContact O-N 2.83Å; Y167-S171 WeakPolarHBondContact CE1-OG 3.43Å; Y167-S171 WeakPolarHBondContact O-CB 3.47Å; Y167-S171 PolarHBondContact O-N 3.43Å; Y167-S171 PolarHBondContact O-OG 3.28Å; Y167-Q226 HydrophobicContact CE2-CG 4.44Å; Y167-Q226 WeakPolarHBondContact OH-CG 3.37Å; Y167-N229 HydrophobicContact CD1-CB 3.47Å; Y167-N229 VanDerWaalsContact CD1-CB 3.47Å; Y167-N229 HydrophobicContact CD2-CB 3.75Å; Y167-N229 WeakPolarHBondContact CD2-ND2 3.31Å; Y167-N229 HydrophobicContact CE1-CB 3.61Å; Y167-N229 HydrophobicContact CE2-CB 3.87Å; Y167-N229 HydrophobicContact CG-CB 3.53Å; Y167-E230 HydrophobicContact CE1-CG 4.47Å; Y167-E230 VanDerWaalsContact CE1-OE1 3.32Å; Y167-E230 WeakPolarHBondContact CE1-OE1 3.37Å; Y167-E230 PolarHBondContact OH-OE1 3.18Å
168	F	98.7	Very high	97.4	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-41.6	178.5	-179	-136	0	0	0	111.8	N164 L165 V166 E170 H172 L175 A176 M179 F192 Y232 C233 F236	N164-F168 PolarHBondContact O-N 3.04Å; L165-F168 PolarHBondContact O-N 2.94Å; V166-F168 VanDerWaalsContact C-N 3.29Å; V166-F168 PolarHBondContact O-N 3.22Å; F168-E170 PolarHBondContact O-N 3.35Å; F168-H172 HydrophobicContact CD2-CB 3.75Å; F168-H172 HydrophobicContact CE2-CB 3.74Å; F168-H172 CarbonylContact O-C 3.42Å; F168-H172 WeakPolarHBondContact O-CA 3.42Å; F168-H172 WeakPolarHBondContact O-CB 3.22Å; F168-H172 PolarHBondContact O-N 3.48Å; F168-H172 VanDerWaalsContact O-N 3.07Å; F168-L175 HydrophobicContact CE2-CD2 4.07Å; F168-L175 HydrophobicContact CE2-CG 4.22Å; F168-L175 HydrophobicContact CZ-CD2 4.32Å; F168-L175 HydrophobicContact CZ-CG 4.11Å; F168-A176 HydrophobicContact CD1-CB 3.99Å; F168-A176 HydrophobicContact CE1-CB 3.79Å; F168-A176 HydrophobicContact CE2-CB 4.43Å; F168-A176 HydrophobicContact CG-CB 4.39Å; F168-A176 HydrophobicContact CZ-CB 4.04Å; F168-M179 HydrophobicContact CE1-CE 4.21Å; F168-M179 HydrophobicContact CZ-CE 4.13Å; F168-M179 HydrophobicContact CZ-SD 3.97Å; F168-F192 HydrophobicContact CD1-CZ 4.35Å; F168-F192 HydrophobicContact CE1-CZ 4.12Å; F168-Y232 HydrophobicContact CB-CD1 4.42Å; F168-Y232 HydrophobicContact CB-CE1 3.95Å; F168-C233 HydrophobicContact CD2-CB 3.79Å; F168-C233 VanDerWaalsContact CD2-SG 3.52Å; F168-C233 HydrophobicContact CE2-CB 4.27Å; F168-F236 AromaticContact CD1-CD2 3.79Å; F168-F236 HydrophobicContact CD1-CD2 3.79Å; F168-F236 HydrophobicContact CD1-CE2 4.24Å; F168-F236 HydrophobicContact CD1-CG 4.35Å; F168-F236 AromaticContact CE1-CD2 3.23Å; F168-F236 HydrophobicContact CE1-CD2 3.23Å; F168-F236 AromaticContact CE1-CE2 3.67Å; F168-F236 HydrophobicContact CE1-CE2 3.67Å; F168-F236 HydrophobicContact CE1-CG 4.14Å; F168-F236 AromaticContact CZ-CD2 3.97Å; F168-F236 HydrophobicContact CZ-CD2 3.97Å
169	A	97.9	Very high	97.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-66.9	-34.4	178.8	0	0	0	0	0	112.7	L122 C125 L126 L165 V166 T173	L122-A169 HydrophobicContact CD1-CB 3.89Å; C125-A169 HydrophobicContact CB-CB 3.61Å; L126-A169 HydrophobicContact CD2-CB 3.86Å; L126-A169 HydrophobicContact CG-CB 4.03Å; L165-A169 WeakPolarHBondContact O-CB 3.35Å; L165-A169 PolarHBondContact O-N 3.25Å; V166-A169 PolarHBondContact O-N 3.24Å; V166-A169 VanDerWaalsContact O-N 3.12Å; A169-T173 WeakPolarHBondContact O-CA 3.26Å; A169-T173 WeakPolarHBondContact O-CB 3.4Å; A169-T173 PolarHBondContact O-N 3.37Å; A169-T173 PolarHBondContact O-OG1 2.88Å
170	E	97.3	Very high	97.3	Very high	71 Å²	71	32.4 Å²	32.4	33%	0.332	16%	0.163	S	C	.	.	H	α-helix	trans	-84.3	-48.3	179.2	-73.4	179.4	157.6	0	0	113.1	R121 C125 V166 Y167 F168 T173	R121-E170 IonicContact CZ-OE1 3.02Å; R121-E170 VanDerWaalsContact CZ-OE1 3.26Å; R121-E170 IonicContact CZ-OE2 2.68Å; R121-E170 IonicContact NE-OE1 3.59Å; R121-E170 PolarHBondContact NE-OE1 2.75Å; R121-E170 IonicContact NE-OE2 3.26Å; R121-E170 IonicContact NH2-OE1 2.7Å; R121-E170 PolarHBondContact NH2-OE1 3.23Å; R121-E170 IonicContact NH2-OE2 3.89Å; R121-E170 PolarHBondContact NH2-OE2 3.21Å; C125-E170 WeakPolarHBondContact SG-CG 3.18Å; V166-E170 HydrophobicContact CG1-CG 4.21Å; V166-E170 WeakPolarHBondContact O-CB 3.38Å; V166-E170 WeakPolarHBondContact O-CG 3.4Å; V166-E170 PolarHBondContact O-N 2.65Å; Y167-E170 PolarHBondContact O-N 2.83Å; F168-E170 PolarHBondContact O-N 3.35Å; E170-T173 PolarHBondContact O-OG1 2.94Å
171	S	97.3	Very high	97.1	Very high	57 Å²	57	36.5 Å²	36.5	40%	0.399	19%	0.191	S	C	.	.	H	α-helix	trans	-75.8	-30	-174.2	-50.3	0	0	0	0	112	Y167	Y167-S171 WeakPolarHBondContact CE1-OG 3.43Å; Y167-S171 WeakPolarHBondContact O-CB 3.47Å; Y167-S171 PolarHBondContact O-N 3.43Å; Y167-S171 PolarHBondContact O-OG 3.28Å
172	H	96.7	Very high	96.9	Very high	19 Å²	19	38.1 Å²	38.1	9%	0.088	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	39.8	-173.8	-60.3	-69.2	0	0	0	111.6	F168 K174 L175 A176 E230 L277 E279	F168-H172 HydrophobicContact CD2-CB 3.75Å; F168-H172 HydrophobicContact CE2-CB 3.74Å; F168-H172 CarbonylContact O-C 3.42Å; F168-H172 WeakPolarHBondContact O-CA 3.42Å; F168-H172 WeakPolarHBondContact O-CB 3.22Å; F168-H172 PolarHBondContact O-N 3.48Å; F168-H172 VanDerWaalsContact O-N 3.07Å; H172-K174 VanDerWaalsContact C-N 3.33Å; H172-K174 PolarHBondContact O-N 3.45Å; H172-K174 VanDerWaalsContact O-N 3.14Å; H172-L175 HydrophobicContact CB-CB 4.34Å; H172-L175 WeakPolarHBondContact O-CA 3.37Å; H172-L175 WeakPolarHBondContact O-CB 3.42Å; H172-L175 PolarHBondContact O-N 3.4Å; H172-A176 PolarHBondContact O-N 2.78Å; H172-E230 IonicContact CD2-OE2 3.36Å; H172-E230 IonicContact CE1-OE2 3.97Å; H172-E230 IonicContact NE2-OE1 3.54Å; H172-E230 IonicContact NE2-OE2 3.55Å; H172-E230 PolarHBondContact NE2-OE2 3.13Å; H172-L277 WeakPolarHBondContact CE1-CD1 3.25Å; H172-L277 WeakPolarHBondContact NE2-CD1 3.34Å; H172-E279 IonicContact CE1-OE1 3.99Å; H172-E279 IonicContact ND1-OE1 3.68Å; H172-E279 PolarHBondContact ND1-OE1 3.01Å
173	T	95.4	Very high	96.7	Very high	40 Å²	40	38.1 Å²	38.1	25%	0.245	21%	0.205	C	C	.	.	H	α-helix	trans	-48.8	-46.3	-169.8	-47	0	0	0	0	114.6	A169 E170 L175 A176 R177	A169-T173 WeakPolarHBondContact O-CA 3.26Å; A169-T173 WeakPolarHBondContact O-CB 3.4Å; A169-T173 PolarHBondContact O-N 3.37Å; A169-T173 PolarHBondContact O-OG1 2.88Å; E170-T173 PolarHBondContact O-OG1 2.94Å; T173-L175 VanDerWaalsContact C-N 3.32Å; T173-L175 PolarHBondContact O-N 3.29Å; T173-A176 PolarHBondContact O-N 3.41Å; T173-R177 HydrophobicContact CG2-CG 4.39Å; T173-R177 WeakPolarHBondContact O-CB 3.34Å; T173-R177 WeakPolarHBondContact O-CG 3.41Å; T173-R177 PolarHBondContact O-N 2.97Å
174	K	95.1	Very high	96.4	Very high	191 Å²	191	40 Å²	40	83%	0.83	21%	0.214	S	C	*	.	H	α-helix	trans	-62.1	-42.6	-179.7	-68.9	-178.4	-178.4	175.7	0	111.4	H172 S178	H172-K174 VanDerWaalsContact C-N 3.33Å; H172-K174 PolarHBondContact O-N 3.45Å; H172-K174 VanDerWaalsContact O-N 3.14Å; K174-S178 VanDerWaalsContact O-CB 3.26Å; K174-S178 WeakPolarHBondContact O-CB 3.43Å; K174-S178 PolarHBondContact O-N 3.32Å
175	L	96.6	Very high	96	Very high	37 Å²	37	42.9 Å²	42.9	19%	0.194	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-46.5	178.5	-177.9	59.1	0	0	0	110.9	F168 H172 T173 R177 S178 M179 Y237 L277	F168-L175 HydrophobicContact CE2-CD2 4.07Å; F168-L175 HydrophobicContact CE2-CG 4.22Å; F168-L175 HydrophobicContact CZ-CD2 4.32Å; F168-L175 HydrophobicContact CZ-CG 4.11Å; H172-L175 HydrophobicContact CB-CB 4.34Å; H172-L175 WeakPolarHBondContact O-CA 3.37Å; H172-L175 WeakPolarHBondContact O-CB 3.42Å; H172-L175 PolarHBondContact O-N 3.4Å; T173-L175 VanDerWaalsContact C-N 3.32Å; T173-L175 PolarHBondContact O-N 3.29Å; L175-R177 PolarHBondContact O-N 3.1Å; L175-S178 PolarHBondContact O-N 3Å; L175-M179 HydrophobicContact CD1-CG 4.18Å; L175-M179 HydrophobicContact CD1-SD 3.76Å; L175-M179 HydrophobicContact CD2-SD 4.49Å; L175-M179 HydrophobicContact CG-SD 3.81Å; L175-M179 WeakPolarHBondContact O-CB 3.46Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.26Å; L175-Y237 HydrophobicContact CD1-CD2 4.01Å; L175-Y237 HydrophobicContact CD1-CE2 4.3Å; L175-Y237 HydrophobicContact CD2-CD2 4.05Å; L175-L277 HydrophobicContact CD2-CD1 4.29Å; L175-L277 HydrophobicContact CD2-CD2 3.94Å
176	A	97.4	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-48.6	177.6	0	0	0	0	0	111.9	L126 F168 H172 T173 M179 L180	L126-A176 HydrophobicContact CD2-CB 4Å; F168-A176 HydrophobicContact CD1-CB 3.99Å; F168-A176 HydrophobicContact CE1-CB 3.79Å; F168-A176 HydrophobicContact CE2-CB 4.43Å; F168-A176 HydrophobicContact CG-CB 4.39Å; F168-A176 HydrophobicContact CZ-CB 4.04Å; H172-A176 PolarHBondContact O-N 2.78Å; T173-A176 PolarHBondContact O-N 3.41Å; A176-M179 PolarHBondContact O-N 3.48Å; A176-L180 WeakPolarHBondContact O-CB 3.38Å; A176-L180 PolarHBondContact O-N 2.93Å
177	R	95.6	Very high	94.9	Very high	86 Å²	86	53.9 Å²	53.9	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-42.8	176.2	-72.4	-178.2	-176.1	176.3	5.4	113	I124 C125 S128 T173 L175 M179 L180 S181	I124-R177 PolarHBondContact O-NH2 3.09Å; C125-R177 PolarHBondContact O-NE 3.42Å; C125-R177 PolarHBondContact O-NH2 3.45Å; S128-R177 VanDerWaalsContact CB-NH2 3.34Å; S128-R177 PolarHBondContact OG-NH1 3.16Å; T173-R177 HydrophobicContact CG2-CG 4.39Å; T173-R177 WeakPolarHBondContact O-CB 3.34Å; T173-R177 WeakPolarHBondContact O-CG 3.41Å; T173-R177 PolarHBondContact O-N 2.97Å; L175-R177 PolarHBondContact O-N 3.1Å; R177-M179 VanDerWaalsContact C-N 3.3Å; R177-M179 PolarHBondContact O-N 3.25Å; R177-L180 PolarHBondContact O-N 3.34Å; R177-S181 WeakPolarHBondContact O-CB 3.36Å; R177-S181 PolarHBondContact O-N 3.21Å
178	S	95.1	Very high	94.5	Very high	76 Å²	76	55.3 Å²	55.3	53%	0.531	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-42.8	177.2	176.5	0	0	0	0	111.2	K174 L175 A182	K174-S178 VanDerWaalsContact O-CB 3.26Å; K174-S178 WeakPolarHBondContact O-CB 3.43Å; K174-S178 PolarHBondContact O-N 3.32Å; L175-S178 PolarHBondContact O-N 3Å; S178-A182 WeakPolarHBondContact O-CB 3.42Å; S178-A182 PolarHBondContact O-N 2.83Å
179	M	96.9	Very high	94.3	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-71.1	-37.5	178.4	-73	175.5	42	0	0	112.6	F168 L175 A176 R177 A182 S183 F192 F236 Y237 H240	F168-M179 HydrophobicContact CE1-CE 4.21Å; F168-M179 HydrophobicContact CZ-CE 4.13Å; F168-M179 HydrophobicContact CZ-SD 3.97Å; L175-M179 HydrophobicContact CD1-CG 4.18Å; L175-M179 HydrophobicContact CD1-SD 3.76Å; L175-M179 HydrophobicContact CD2-SD 4.49Å; L175-M179 HydrophobicContact CG-SD 3.81Å; L175-M179 WeakPolarHBondContact O-CB 3.46Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.26Å; A176-M179 PolarHBondContact O-N 3.48Å; R177-M179 VanDerWaalsContact C-N 3.3Å; R177-M179 PolarHBondContact O-N 3.25Å; M179-A182 PolarHBondContact O-N 2.88Å; M179-S183 WeakPolarHBondContact O-CB 3.48Å; M179-S183 PolarHBondContact O-N 2.96Å; M179-F192 HydrophobicContact CB-CE2 4.04Å; M179-F236 HydrophobicContact CE-CD2 3.19Å; M179-F236 HydrophobicContact CE-CE2 3.4Å; M179-F236 VanDerWaalsContact CE-CE2 3.4Å; M179-F236 HydrophobicContact CE-CG 4.32Å; M179-Y237 HydrophobicContact SD-CD2 4.17Å; M179-H240 HydrophobicContact CE-CB 3.41Å; M179-H240 VanDerWaalsContact CE-CB 3.41Å; M179-H240 HydrophobicContact CG-CB 4.48Å; M179-H240 HydrophobicContact SD-CB 4.22Å
180	L	95.6	Very high	94.1	Very high	13 Å²	13	60.6 Å²	60.6	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-52.2	172.3	173.8	62.3	0	0	0	110.6	L126 L143 A176 R177 A182 S183 H184 F192	L126-L180 HydrophobicContact CB-CD2 4Å; L126-L180 HydrophobicContact CD2-CD2 4.41Å; L143-L180 HydrophobicContact CD2-CD2 3.63Å; A176-L180 WeakPolarHBondContact O-CB 3.38Å; A176-L180 PolarHBondContact O-N 2.93Å; R177-L180 PolarHBondContact O-N 3.34Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.36Å; L180-S183 WeakPolarHBondContact O-CB 3.32Å; L180-S183 PolarHBondContact O-N 3.15Å; L180-S183 PolarHBondContact O-OG 3.34Å; L180-H184 PolarHBondContact O-CD2 3.45Å; L180-H184 PolarHBondContact O-N 2.86Å; L180-F192 HydrophobicContact CB-CD2 3.85Å; L180-F192 HydrophobicContact CB-CE2 3.89Å; L180-F192 HydrophobicContact CB-CG 4.28Å; L180-F192 HydrophobicContact CB-CZ 4.39Å; L180-F192 HydrophobicContact CD1-CB 3.64Å; L180-F192 HydrophobicContact CD1-CD1 4.17Å; L180-F192 HydrophobicContact CD1-CD2 4.13Å; L180-F192 HydrophobicContact CD1-CG 3.74Å
181	S	94.1	Very high	94	Very high	88 Å²	88	58.1 Å²	58.1	62%	0.615	31%	0.311	S	S	*	.	H	α-helix	trans	-56.1	-45.2	176.4	178.2	0	0	0	0	111.8	R177 S183 H184	R177-S181 WeakPolarHBondContact O-CB 3.36Å; R177-S181 PolarHBondContact O-N 3.21Å; S181-S183 VanDerWaalsContact C-N 3.3Å; S181-S183 PolarHBondContact O-N 3.19Å; S181-H184 PolarHBondContact O-N 2.91Å
182	A	93.7	Very high	94	Very high	35 Å²	35	55.5 Å²	55.5	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-25.4	177.2	0	0	0	0	0	113.8	S178 M179 L180 H184 D185	S178-A182 WeakPolarHBondContact O-CB 3.42Å; S178-A182 PolarHBondContact O-N 2.83Å; M179-A182 PolarHBondContact O-N 2.88Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.36Å; A182-H184 PolarHBondContact O-N 3.42Å; A182-D185 WeakPolarHBondContact O-CB 3.45Å; A182-D185 PolarHBondContact O-N 3.42Å
183	S	94.3	Very high	94	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-14.6	175.2	78.9	0	0	0	0	113.1	M179 L180 S181 W189 Y190	M179-S183 WeakPolarHBondContact O-CB 3.48Å; M179-S183 PolarHBondContact O-N 2.96Å; L180-S183 WeakPolarHBondContact O-CB 3.32Å; L180-S183 PolarHBondContact O-N 3.15Å; L180-S183 PolarHBondContact O-OG 3.34Å; S181-S183 VanDerWaalsContact C-N 3.3Å; S181-S183 PolarHBondContact O-N 3.19Å; S183-W189 VanDerWaalsContact O-CA 3.27Å; S183-W189 WeakPolarHBondContact O-CA 3.34Å; S183-Y190 WeakPolarHBondContact CB-O 3.46Å; S183-Y190 PolarHBondContact O-N 3Å; S183-Y190 VanDerWaalsContact O-N 3.16Å
184	H	92	Very high	94	Very high	79 Å²	79	54 Å²	54	37%	0.366	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-3.8	174.1	-66.3	-65.3	0	0	0	114.4	L142 L180 S181 A182 P186	L142-H184 PolarHBondContact O-CE1 3.44Å; L142-H184 PolarHBondContact O-NE2 2.99Å; L180-H184 PolarHBondContact O-CD2 3.45Å; L180-H184 PolarHBondContact O-N 2.86Å; S181-H184 PolarHBondContact O-N 2.91Å; A182-H184 PolarHBondContact O-N 3.42Å; H184-P186 WeakPolarHBondContact O-CD 3.36Å
185	D	90.1	Very high	94.1	Very high	60 Å²	60	45 Å²	45	32%	0.321	25%	0.245	S	C	.	.			trans	-58.9	119.8	175.4	178.9	-20.8	0	0	0	109.7	A182 N187 K188 W189	A182-D185 WeakPolarHBondContact O-CB 3.45Å; A182-D185 PolarHBondContact O-N 3.42Å; D185-N187 PolarHBondContact O-N 2.7Å; D185-N187 PolarHBondContact OD1-N 2.89Å; D185-K188 HydrophobicContact CB-CB 4.33Å; D185-K188 CarbonylContact O-C 3.23Å; D185-K188 PolarHBondContact O-N 2.73Å; D185-W189 VanDerWaalsContact O-CA 3.28Å; D185-W189 WeakPolarHBondContact O-CA 3.36Å; D185-W189 WeakPolarHBondContact O-CB 3.48Å; D185-W189 PolarHBondContact O-N 3.16Å
186	P	86.8	Confident	94.2	Very high	117 Å²	117	43.2 Å²	43.2	76%	0.76	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.9	-177.6	-27.9	35.6	0	0	0	114.7	H184	H184-P186 WeakPolarHBondContact O-CD 3.36Å
187	N	88.2	Confident	94.2	Very high	119 Å²	119	44 Å²	44	64%	0.636	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.6	-178.8	-62.7	-59	0	0	0	113.5	D185	D185-N187 PolarHBondContact O-N 2.7Å; D185-N187 PolarHBondContact OD1-N 2.89Å
188	K	89.4	Confident	94.3	Very high	68 Å²	68	42.5 Å²	42.5	30%	0.296	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.1	21.5	-173.1	-61.5	177.5	-176.5	-172.5	0	111.6	D185 W243 T244	D185-K188 HydrophobicContact CB-CB 4.33Å; D185-K188 CarbonylContact O-C 3.23Å; D185-K188 PolarHBondContact O-N 2.73Å; K188-W243 PolarHBondContact O-NE1 3.02Å; K188-T244 HydrophobicContact CD-CG2 4.32Å; K188-T244 WeakPolarHBondContact CE-O 3.49Å; K188-T244 PolarHBondContact NZ-O 3.39Å
189	W	93.8	Very high	94.4	Very high	112 Å²	112	38.9 Å²	38.9	42%	0.424	21%	0.212	S	C	.	.			trans	-60.9	138.4	-171.3	-179.1	84.5	0	0	0	111.3	S183 D185 P191 W243 I250	S183-W189 VanDerWaalsContact O-CA 3.27Å; S183-W189 WeakPolarHBondContact O-CA 3.34Å; D185-W189 VanDerWaalsContact O-CA 3.28Å; D185-W189 WeakPolarHBondContact O-CA 3.36Å; D185-W189 WeakPolarHBondContact O-CB 3.48Å; D185-W189 PolarHBondContact O-N 3.16Å; W189-P191 HydrophobicContact CH2-CB 4.24Å; W189-P191 HydrophobicContact CH2-CG 4.45Å; W189-P191 HydrophobicContact CZ2-CB 4.35Å; W189-W243 WeakPolarHBondContact O-CZ2 3.15Å; W189-I250 HydrophobicContact CE3-CB 4.41Å; W189-I250 HydrophobicContact CE3-CD1 4Å; W189-I250 HydrophobicContact CE3-CG1 4.06Å; W189-I250 HydrophobicContact CZ3-CB 4.46Å; W189-I250 HydrophobicContact CZ3-CD1 3.85Å; W189-I250 HydrophobicContact CZ3-CG1 3.74Å
190	Y	95.5	Very high	94.5	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	21%	0.211	C	C	.	.			trans	-151.6	150.1	166.7	69.7	-92.4	0	0	0	110.4	S183 F192 T195 H240 W243	S183-Y190 WeakPolarHBondContact CB-O 3.46Å; S183-Y190 PolarHBondContact O-N 3Å; S183-Y190 VanDerWaalsContact O-N 3.16Å; Y190-F192 PolarHBondContact O-N 3.47Å; Y190-F192 VanDerWaalsContact O-N 3.13Å; Y190-T195 HydrophobicContact CD2-CG2 4.17Å; Y190-T195 VanDerWaalsContact CD2-OG1 3.27Å; Y190-T195 WeakPolarHBondContact CD2-OG1 3.27Å; Y190-T195 HydrophobicContact CE2-CG2 4.12Å; Y190-H240 AromaticContact CE1-ND1 3.6Å; Y190-H240 AromaticContact CZ-ND1 3.65Å; Y190-H240 PolarHBondContact OH-ND1 3.37Å; Y190-W243 AromaticContact CD1-CD1 3.39Å; Y190-W243 HydrophobicContact CD1-CD2 4.42Å; Y190-W243 AromaticContact CD1-CG 3.98Å; Y190-W243 HydrophobicContact CD1-CG 3.98Å; Y190-W243 AromaticContact CD1-NE1 3.52Å; Y190-W243 HydrophobicContact CE1-CG 4.48Å
191	P	94.9	Very high	94.6	Very high	19 Å²	19	41.8 Å²	41.8	12%	0.123	22%	0.224	C	C	.	.			trans	-74.2	107.3	179.1	30.7	-35.1	0	0	0	109.9	G144 W189 V194 T195	G144-P191 WeakPolarHBondContact O-CB 3.45Å; W189-P191 HydrophobicContact CH2-CB 4.24Å; W189-P191 HydrophobicContact CH2-CG 4.45Å; W189-P191 HydrophobicContact CZ2-CB 4.35Å; P191-V194 HydrophobicContact CB-CB 3.98Å; P191-V194 HydrophobicContact CB-CG2 4.34Å; P191-V194 HydrophobicContact CG-CB 3.98Å; P191-V194 HydrophobicContact CG-CG1 4.22Å; P191-T195 VanDerWaalsContact O-CB 3.23Å; P191-T195 WeakPolarHBondContact O-CB 3.22Å; P191-T195 PolarHBondContact O-N 2.85Å; P191-T195 PolarHBondContact O-OG1 3.46Å
192	F	96.4	Very high	94.8	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-55.7	-56.4	-173	179.3	-83.8	0	0	0	113.1	L126 L165 F168 M179 L180 Y190 T195 G196 F236	L126-F192 HydrophobicContact CD1-CD1 4.49Å; L126-F192 HydrophobicContact CD1-CE1 3.98Å; L126-F192 HydrophobicContact CD2-CE1 4.47Å; L165-F192 HydrophobicContact CD2-CE1 4.35Å; F168-F192 HydrophobicContact CD1-CZ 4.35Å; F168-F192 HydrophobicContact CE1-CZ 4.12Å; M179-F192 HydrophobicContact CB-CE2 4.04Å; L180-F192 HydrophobicContact CB-CD2 3.85Å; L180-F192 HydrophobicContact CB-CE2 3.89Å; L180-F192 HydrophobicContact CB-CG 4.28Å; L180-F192 HydrophobicContact CB-CZ 4.39Å; L180-F192 HydrophobicContact CD1-CB 3.64Å; L180-F192 HydrophobicContact CD1-CD1 4.17Å; L180-F192 HydrophobicContact CD1-CD2 4.13Å; L180-F192 HydrophobicContact CD1-CG 3.74Å; Y190-F192 PolarHBondContact O-N 3.47Å; Y190-F192 VanDerWaalsContact O-N 3.13Å; F192-T195 WeakPolarHBondContact O-CB 3.38Å; F192-T195 PolarHBondContact O-N 3.37Å; F192-G196 PolarHBondContact O-N 3.24Å; F192-F236 HydrophobicContact CD1-CZ 4.32Å; F192-F236 AromaticContact CD2-CE2 3.84Å; F192-F236 HydrophobicContact CD2-CE2 3.84Å; F192-F236 AromaticContact CD2-CZ 3.79Å; F192-F236 HydrophobicContact CD2-CZ 3.79Å; F192-F236 HydrophobicContact CE1-CE2 4.33Å; F192-F236 HydrophobicContact CE1-CZ 4.22Å; F192-F236 AromaticContact CE2-CE2 3.35Å; F192-F236 HydrophobicContact CE2-CE2 3.35Å; F192-F236 AromaticContact CE2-CZ 3.74Å; F192-F236 HydrophobicContact CE2-CZ 3.74Å; F192-F236 HydrophobicContact CG-CZ 4.1Å; F192-F236 AromaticContact CZ-CE2 3.61Å; F192-F236 HydrophobicContact CZ-CE2 3.61Å; F192-F236 AromaticContact CZ-CZ 3.94Å; F192-F236 HydrophobicContact CZ-CZ 3.94Å
193	A	96.7	Very high	95.1	Very high	2 Å²	2	37 Å²	37	2%	0.017	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-46.5	-177.2	0	0	0	0	0	112.7	L143 F145 L165 T195 G196 I197	L143-A193 WeakPolarHBondContact O-CB 3.23Å; L143-A193 PolarHBondContact O-N 3.46Å; F145-A193 HydrophobicContact CD1-CB 3.88Å; F145-A193 HydrophobicContact CD2-CB 3.62Å; F145-A193 HydrophobicContact CE1-CB 3.76Å; F145-A193 HydrophobicContact CE2-CB 3.49Å; F145-A193 VanDerWaalsContact CE2-CB 3.49Å; F145-A193 HydrophobicContact CG-CB 3.82Å; F145-A193 HydrophobicContact CZ-CB 3.58Å; L165-A193 HydrophobicContact CD1-CB 4.46Å; A193-T195 VanDerWaalsContact C-N 3.26Å; A193-T195 PolarHBondContact O-N 2.96Å; A193-G196 WeakPolarHBondContact O-CA 3.3Å; A193-G196 PolarHBondContact O-N 3.12Å; A193-I197 WeakPolarHBondContact O-CG1 3.47Å; A193-I197 PolarHBondContact O-N 3.18Å
194	V	95.9	Very high	95.3	Very high	26 Å²	26	37.8 Å²	37.8	16%	0.158	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-39.9	176.2	169.4	0	0	0	0	111.5	G144 Q146 P191 G196 I197 H198	G144-V194 VanDerWaalsContact O-CG2 3.23Å; G144-V194 WeakPolarHBondContact O-CG2 3.33Å; G144-V194 PolarHBondContact O-N 2.88Å; G144-V194 VanDerWaalsContact O-N 3.16Å; Q146-V194 HydrophobicContact CG-CG2 3.74Å; P191-V194 HydrophobicContact CB-CB 3.98Å; P191-V194 HydrophobicContact CB-CG2 4.34Å; P191-V194 HydrophobicContact CG-CB 3.98Å; P191-V194 HydrophobicContact CG-CG1 4.22Å; V194-G196 VanDerWaalsContact C-N 3.27Å; V194-G196 PolarHBondContact O-N 2.92Å; V194-I197 PolarHBondContact O-N 2.56Å; V194-H198 PolarHBondContact O-N 2.93Å
195	T	97.1	Very high	95.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-39.7	173.3	-60.9	0	0	0	0	110.9	Y190 P191 F192 A193 H198 L199 F236 F239 F253	Y190-T195 HydrophobicContact CD2-CG2 4.17Å; Y190-T195 VanDerWaalsContact CD2-OG1 3.27Å; Y190-T195 WeakPolarHBondContact CD2-OG1 3.27Å; Y190-T195 HydrophobicContact CE2-CG2 4.12Å; P191-T195 VanDerWaalsContact O-CB 3.23Å; P191-T195 WeakPolarHBondContact O-CB 3.22Å; P191-T195 PolarHBondContact O-N 2.85Å; P191-T195 PolarHBondContact O-OG1 3.46Å; F192-T195 WeakPolarHBondContact O-CB 3.38Å; F192-T195 PolarHBondContact O-N 3.37Å; A193-T195 VanDerWaalsContact C-N 3.26Å; A193-T195 PolarHBondContact O-N 2.96Å; T195-H198 WeakPolarHBondContact O-CB 3.31Å; T195-H198 PolarHBondContact O-N 2.92Å; T195-L199 HydrophobicContact CG2-CD1 4.24Å; T195-L199 HydrophobicContact CG2-CG 4.35Å; T195-L199 WeakPolarHBondContact O-CG 3.49Å; T195-L199 PolarHBondContact O-N 3.46Å; T195-F236 HydrophobicContact CG2-CE1 3.99Å; T195-F239 HydrophobicContact CG2-CD1 3.53Å; T195-F239 HydrophobicContact CG2-CE1 3.32Å; T195-F239 HydrophobicContact CG2-CG 4.4Å; T195-F239 HydrophobicContact CG2-CZ 4.04Å; T195-F253 HydrophobicContact CG2-CE2 4.4Å; T195-F253 HydrophobicContact CG2-CZ 4.24Å; T195-F253 VanDerWaalsContact OG1-CE2 3.32Å; T195-F253 WeakPolarHBondContact OG1-CE2 3.3Å; T195-F253 VanDerWaalsContact OG1-CZ 3.31Å; T195-F253 WeakPolarHBondContact OG1-CZ 3.27Å
196	G	98.2	Very high	96	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-40.7	179.7	0	0	0	0	0	112.1	F192 A193 V194 H198 L199 T200 Y232	F192-G196 PolarHBondContact O-N 3.24Å; A193-G196 WeakPolarHBondContact O-CA 3.3Å; A193-G196 PolarHBondContact O-N 3.12Å; V194-G196 VanDerWaalsContact C-N 3.27Å; V194-G196 PolarHBondContact O-N 2.92Å; G196-H198 VanDerWaalsContact C-N 3.33Å; G196-H198 PolarHBondContact O-N 2.85Å; G196-L199 PolarHBondContact O-N 2.76Å; G196-T200 WeakPolarHBondContact O-CB 3.14Å; G196-T200 PolarHBondContact O-N 2.71Å; G196-T200 PolarHBondContact O-OG1 2.88Å; G196-Y232 WeakPolarHBondContact CA-OH 3.34Å; G196-Y232 WeakPolarHBondContact O-CE2 3.48Å; G196-Y232 PolarHBondContact O-OH 3.24Å
197	I	97.7	Very high	96.5	Very high	17 Å²	17	28.3 Å²	28.3	9%	0.087	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-43.1	173.6	-62.1	167.9	0	0	0	110.5	F145 D153 F154 L165 A193 V194 L199 T200 K201	F145-I197 HydrophobicContact CE1-CD1 4.27Å; D153-I197 HydrophobicContact CB-CD1 3.58Å; F154-I197 HydrophobicContact CD1-CD1 3.85Å; F154-I197 HydrophobicContact CD1-CG1 4.33Å; F154-I197 HydrophobicContact CE1-CD1 3.9Å; F154-I197 HydrophobicContact CE1-CG1 4.4Å; L165-I197 HydrophobicContact CD1-CG1 4.12Å; A193-I197 WeakPolarHBondContact O-CG1 3.47Å; A193-I197 PolarHBondContact O-N 3.18Å; V194-I197 PolarHBondContact O-N 2.56Å; I197-L199 PolarHBondContact O-N 2.89Å; I197-T200 WeakPolarHBondContact O-CB 3.38Å; I197-T200 PolarHBondContact O-N 3.22Å; I197-K201 PolarHBondContact O-N 2.97Å; I197-K201 VanDerWaalsContact O-N 3.09Å
198	H	97.1	Very high	97	Very high	55 Å²	55	27 Å²	27	26%	0.255	13%	0.127	S	C	.	.	H	α-helix	trans	-60.5	-45.8	174.9	-168.6	115.8	0	0	0	111.7	V194 T195 G196 T200 K201 L202 C257	V194-H198 PolarHBondContact O-N 2.93Å; T195-H198 WeakPolarHBondContact O-CB 3.31Å; T195-H198 PolarHBondContact O-N 2.92Å; G196-H198 VanDerWaalsContact C-N 3.33Å; G196-H198 PolarHBondContact O-N 2.85Å; H198-T200 VanDerWaalsContact C-N 3.31Å; H198-T200 PolarHBondContact O-N 3.31Å; H198-K201 WeakPolarHBondContact O-CB 3.32Å; H198-K201 PolarHBondContact O-N 3.37Å; H198-K201 VanDerWaalsContact O-N 3.16Å; H198-L202 PolarHBondContact O-N 2.84Å; H198-C257 VanDerWaalsContact NE2-CB 3.31Å; H198-C257 WeakPolarHBondContact NE2-CB 3.38Å
199	L	98.5	Very high	97.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-71.6	-26.3	-179.8	-64	-173.3	0	0	0	113.1	T195 G196 I197 L202 S203 Y232 T235 F236 F239 F260	T195-L199 HydrophobicContact CG2-CD1 4.24Å; T195-L199 HydrophobicContact CG2-CG 4.35Å; T195-L199 WeakPolarHBondContact O-CG 3.49Å; T195-L199 PolarHBondContact O-N 3.46Å; G196-L199 PolarHBondContact O-N 2.76Å; I197-L199 PolarHBondContact O-N 2.89Å; L199-L202 HydrophobicContact CD2-CD2 3.96Å; L199-L202 PolarHBondContact O-N 3.42Å; L199-S203 WeakPolarHBondContact O-CB 3.44Å; L199-S203 PolarHBondContact O-N 3.38Å; L199-S203 PolarHBondContact O-OG 2.91Å; L199-Y232 HydrophobicContact CB-CE2 4.24Å; L199-T235 HydrophobicContact CB-CG2 4.23Å; L199-T235 HydrophobicContact CD1-CG2 4.29Å; L199-T235 HydrophobicContact CD2-CG2 4.28Å; L199-F236 HydrophobicContact CB-CD1 4.49Å; L199-F236 HydrophobicContact CD1-CB 4.16Å; L199-F236 HydrophobicContact CD1-CD1 3.57Å; L199-F236 HydrophobicContact CD1-CE1 4.28Å; L199-F236 HydrophobicContact CD1-CG 4.18Å; L199-F236 HydrophobicContact CG-CD1 4.43Å; L199-F239 HydrophobicContact CD1-CB 3.44Å; L199-F239 VanDerWaalsContact CD1-CB 3.44Å; L199-F239 HydrophobicContact CD1-CD1 4.22Å; L199-F239 HydrophobicContact CD1-CD2 4.45Å; L199-F239 HydrophobicContact CD1-CG 3.79Å; L199-F239 HydrophobicContact CD2-CB 4.31Å; L199-F239 HydrophobicContact CD2-CD2 4.09Å; L199-F239 HydrophobicContact CD2-CG 4.24Å; L199-F260 HydrophobicContact CD2-CD1 4.17Å; L199-F260 HydrophobicContact CD2-CE1 3.99Å
200	T	98.7	Very high	97.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-48.4	167.6	-58.4	0	0	0	0	109.6	M157 L160 N164 G196 I197 H198 L202 S203 Y204 Y232	M157-T200 HydrophobicContact CB-CG2 4.35Å; M157-T200 HydrophobicContact CE-CG2 3.55Å; M157-T200 HydrophobicContact CG-CG2 4.34Å; L160-T200 HydrophobicContact CD2-CG2 4.3Å; L160-T200 HydrophobicContact CG-CG2 3.9Å; N164-T200 HydrophobicContact CB-CG2 4.5Å; N164-T200 WeakPolarHBondContact OD1-CG2 3.4Å; N164-T200 PolarHBondContact OD1-OG1 2.92Å; G196-T200 WeakPolarHBondContact O-CB 3.14Å; G196-T200 PolarHBondContact O-N 2.71Å; G196-T200 PolarHBondContact O-OG1 2.88Å; I197-T200 WeakPolarHBondContact O-CB 3.38Å; I197-T200 PolarHBondContact O-N 3.22Å; H198-T200 VanDerWaalsContact C-N 3.31Å; H198-T200 PolarHBondContact O-N 3.31Å; T200-L202 VanDerWaalsContact C-N 3.34Å; T200-L202 PolarHBondContact O-N 3.38Å; T200-S203 PolarHBondContact O-N 3.19Å; T200-Y204 WeakPolarHBondContact O-CB 3.42Å; T200-Y204 PolarHBondContact O-N 3.36Å; T200-Y232 VanDerWaalsContact OG1-CE2 3.3Å; T200-Y232 WeakPolarHBondContact OG1-CE2 3.39Å
201	K	98.3	Very high	97.7	Very high	77 Å²	77	27.7 Å²	27.7	34%	0.335	14%	0.139	S	C	.	.	H	α-helix	trans	-59.1	-44.9	175.6	-177	65.7	178.4	-173	0	111.9	M157 I197 H198 N205	M157-K201 HydrophobicContact CG-CB 3.79Å; M157-K201 HydrophobicContact CG-CD 4.01Å; M157-K201 HydrophobicContact SD-CB 3.88Å; M157-K201 HydrophobicContact SD-CD 3.22Å; M157-K201 WeakPolarHBondContact SD-CD 3.16Å; M157-K201 HydrophobicContact SD-CG 4.17Å; I197-K201 PolarHBondContact O-N 2.97Å; I197-K201 VanDerWaalsContact O-N 3.09Å; H198-K201 WeakPolarHBondContact O-CB 3.32Å; H198-K201 PolarHBondContact O-N 3.37Å; H198-K201 VanDerWaalsContact O-N 3.16Å; K201-N205 WeakPolarHBondContact O-CB 3.1Å; K201-N205 PolarHBondContact O-N 3.46Å; K201-N205 PolarHBondContact O-ND2 2.97Å
202	L	98.4	Very high	97.9	Very high	24 Å²	24	26.8 Å²	26.8	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-49.3	177.4	-178.5	66.8	0	0	0	111.4	H198 L199 T200 N205 F206 T235 F260	H198-L202 PolarHBondContact O-N 2.84Å; L199-L202 HydrophobicContact CD2-CD2 3.96Å; L199-L202 PolarHBondContact O-N 3.42Å; T200-L202 VanDerWaalsContact C-N 3.34Å; T200-L202 PolarHBondContact O-N 3.38Å; L202-N205 PolarHBondContact O-N 2.94Å; L202-F206 HydrophobicContact CD1-CE1 3.9Å; L202-F206 HydrophobicContact CD1-CE2 3.98Å; L202-F206 HydrophobicContact CD1-CZ 3.56Å; L202-F206 HydrophobicContact CD2-CE2 4.17Å; L202-F206 HydrophobicContact CD2-CZ 4.38Å; L202-F206 HydrophobicContact CG-CD2 4.32Å; L202-F206 HydrophobicContact CG-CE2 3.78Å; L202-F206 HydrophobicContact CG-CZ 3.91Å; L202-F206 WeakPolarHBondContact O-CG 3.46Å; L202-F206 PolarHBondContact O-N 3.39Å; L202-T235 HydrophobicContact CD2-CG2 4.38Å; L202-F260 HydrophobicContact CD2-CD1 3.97Å; L202-F260 HydrophobicContact CD2-CE1 3.95Å
203	S	98.7	Very high	98	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-45	-178.7	-57	0	0	0	0	111.7	L199 T200 N205 F206 M207	L199-S203 WeakPolarHBondContact O-CB 3.44Å; L199-S203 PolarHBondContact O-N 3.38Å; L199-S203 PolarHBondContact O-OG 2.91Å; T200-S203 PolarHBondContact O-N 3.19Å; S203-N205 PolarHBondContact O-N 3.48Å; S203-F206 WeakPolarHBondContact O-CB 3.23Å; S203-F206 PolarHBondContact O-N 2.6Å; S203-M207 PolarHBondContact O-N 3.43Å
204	Y	98.7	Very high	98.1	Very high	15 Å²	15	28.2 Å²	28.2	6%	0.059	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-44.3	174	170.8	-90.6	0	0	0	111.7	L100 D101 R104 M157 L160 T200 F206 M207 L208	L100-Y204 HydrophobicContact CB-CD2 4.21Å; L100-Y204 HydrophobicContact CB-CE2 4.43Å; D101-Y204 HydrophobicContact CB-CE2 4.34Å; D101-Y204 PolarHBondContact OD1-OH 2.89Å; R104-Y204 PolarHBondContact NE-OH 3.25Å; M157-Y204 HydrophobicContact CE-CD1 4.39Å; M157-Y204 HydrophobicContact CE-CD2 4.48Å; M157-Y204 HydrophobicContact CE-CG 3.91Å; L160-Y204 HydrophobicContact CD2-CD2 4.24Å; T200-Y204 WeakPolarHBondContact O-CB 3.42Å; T200-Y204 PolarHBondContact O-N 3.36Å; Y204-F206 VanDerWaalsContact C-N 3.28Å; Y204-F206 PolarHBondContact O-N 2.76Å; Y204-M207 WeakPolarHBondContact O-CB 3.42Å; Y204-M207 PolarHBondContact O-N 3.09Å; Y204-M207 VanDerWaalsContact O-N 3.1Å; Y204-L208 HydrophobicContact CE1-CB 4.49Å; Y204-L208 HydrophobicContact CE1-CD2 4.16Å; Y204-L208 PolarHBondContact O-N 3.13Å
205	N	98.4	Very high	98.2	Very high	46 Å²	46	27.4 Å²	27.4	25%	0.246	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-35.9	177.2	-74.6	-20	0	0	0	112.2	K201 L202 S203 K209	K201-N205 WeakPolarHBondContact O-CB 3.1Å; K201-N205 PolarHBondContact O-N 3.46Å; K201-N205 PolarHBondContact O-ND2 2.97Å; L202-N205 PolarHBondContact O-N 2.94Å; S203-N205 PolarHBondContact O-N 3.48Å; N205-K209 VanDerWaalsContact O-CB 3.31Å; N205-K209 WeakPolarHBondContact O-CB 3.18Å; N205-K209 VanDerWaalsContact O-CG 3.28Å; N205-K209 WeakPolarHBondContact O-CG 3.32Å; N205-K209 PolarHBondContact O-N 3.47Å
206	F	98.7	Very high	98.2	Very high	11 Å²	11	27.6 Å²	27.6	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-39	172.8	-70.2	-19.1	0	0	0	112.4	L202 S203 Y204 G210 H211 L212 F231 G261 L264 K265 L268	L202-F206 HydrophobicContact CD1-CE1 3.9Å; L202-F206 HydrophobicContact CD1-CE2 3.98Å; L202-F206 HydrophobicContact CD1-CZ 3.56Å; L202-F206 HydrophobicContact CD2-CE2 4.17Å; L202-F206 HydrophobicContact CD2-CZ 4.38Å; L202-F206 HydrophobicContact CG-CD2 4.32Å; L202-F206 HydrophobicContact CG-CE2 3.78Å; L202-F206 HydrophobicContact CG-CZ 3.91Å; L202-F206 WeakPolarHBondContact O-CG 3.46Å; L202-F206 PolarHBondContact O-N 3.39Å; S203-F206 WeakPolarHBondContact O-CB 3.23Å; S203-F206 PolarHBondContact O-N 2.6Å; Y204-F206 VanDerWaalsContact C-N 3.28Å; Y204-F206 PolarHBondContact O-N 2.76Å; F206-G210 PolarHBondContact O-N 3.41Å; F206-H211 HydrophobicContact CB-CB 4.06Å; F206-H211 HydrophobicContact CD1-CB 4.29Å; F206-H211 AromaticContact CD1-ND1 3.27Å; F206-H211 VanDerWaalsContact CD1-ND1 3.27Å; F206-H211 WeakPolarHBondContact CD1-ND1 3.42Å; F206-H211 AromaticContact CE1-ND1 3.81Å; F206-H211 HydrophobicContact CG-CB 4.33Å; F206-H211 PolarHBondContact O-N 3.14Å; F206-L212 HydrophobicContact CB-CD1 4.31Å; F206-L212 HydrophobicContact CB-CD2 4.1Å; F206-L212 HydrophobicContact CB-CG 3.85Å; F206-F231 HydrophobicContact CD2-CE1 4.47Å; F206-F231 HydrophobicContact CD2-CZ 4.4Å; F206-G261 WeakPolarHBondContact CZ-O 3.39Å; F206-L264 HydrophobicContact CE2-CB 4.27Å; F206-L264 HydrophobicContact CE2-CD2 3.87Å; F206-L264 HydrophobicContact CE2-CG 3.88Å; F206-K265 HydrophobicContact CE1-CB 4.06Å; F206-K265 HydrophobicContact CZ-CB 4.05Å; F206-L268 HydrophobicContact CB-CD1 4.32Å; F206-L268 HydrophobicContact CD2-CD1 3.34Å; F206-L268 HydrophobicContact CE2-CD1 3.64Å; F206-L268 HydrophobicContact CG-CD1 3.9Å; F206-L268 HydrophobicContact CZ-CD1 4.4Å
207	M	98.1	Very high	98.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-54.3	173.7	-168.3	68	-174.9	0	0	110.8	Y93 L96 I97 L100 S203 Y204 K209 G210 L212 F216 F228	Y93-M207 HydrophobicContact CD1-CE 3.85Å; Y93-M207 HydrophobicContact CD2-CE 3.57Å; Y93-M207 HydrophobicContact CD2-SD 4.24Å; Y93-M207 HydrophobicContact CE1-CE 3.79Å; Y93-M207 HydrophobicContact CE1-SD 4.21Å; Y93-M207 HydrophobicContact CE2-CE 3.51Å; Y93-M207 HydrophobicContact CE2-SD 3.56Å; Y93-M207 VanDerWaalsContact CE2-SD 3.56Å; Y93-M207 HydrophobicContact CG-CE 3.73Å; Y93-M207 VanDerWaalsContact CZ-SD 3.52Å; Y93-M207 WeakPolarHBondContact O-CE 3.32Å; Y93-M207 PolarHBondContact OH-O 3.49Å; L96-M207 HydrophobicContact CB-CE 3.93Å; L96-M207 HydrophobicContact CD2-CE 3.75Å; L96-M207 HydrophobicContact CG-CE 3.89Å; I97-M207 HydrophobicContact CD1-CE 4.45Å; I97-M207 HydrophobicContact CD1-CG 4.35Å; I97-M207 HydrophobicContact CG1-CE 3.84Å; I97-M207 HydrophobicContact CG1-CG 3.57Å; L100-M207 HydrophobicContact CD1-CG 4Å; S203-M207 PolarHBondContact O-N 3.43Å; Y204-M207 WeakPolarHBondContact O-CB 3.42Å; Y204-M207 PolarHBondContact O-N 3.09Å; Y204-M207 VanDerWaalsContact O-N 3.1Å; M207-K209 VanDerWaalsContact C-N 3.32Å; M207-K209 PolarHBondContact O-N 3.03Å; M207-G210 PolarHBondContact O-N 3.35Å; M207-L212 HydrophobicContact CB-CD1 4.05Å; M207-L212 HydrophobicContact SD-CB 4.19Å; M207-L212 HydrophobicContact SD-CD1 4.05Å; M207-F216 HydrophobicContact CE-CD2 4Å; M207-F216 HydrophobicContact CE-CE2 3.79Å; M207-F216 HydrophobicContact SD-CD2 3.94Å; M207-F216 HydrophobicContact SD-CE2 3.4Å; M207-F216 WeakPolarHBondContact SD-CE2 3.42Å; M207-F216 HydrophobicContact SD-CZ 4.24Å; M207-F228 HydrophobicContact CB-CE2 4.28Å
208	L	97.8	Very high	98.2	Very high	91 Å²	91	27.5 Å²	27.5	48%	0.476	14%	0.136	S	C	.	.	H	α-helix	trans	-59.2	-40.5	-178.4	-176.6	66	0	0	0	112.5	I97 Y204 G210	I97-L208 HydrophobicContact CG2-CD1 4.33Å; Y204-L208 HydrophobicContact CE1-CB 4.49Å; Y204-L208 HydrophobicContact CE1-CD2 4.16Å; Y204-L208 PolarHBondContact O-N 3.13Å; L208-G210 PolarHBondContact O-N 3.4Å
209	K	98	Very high	98.1	Very high	146 Å²	146	29 Å²	29	64%	0.635	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.8	178.6	-68.1	177.6	-179.4	178.3	0	113.7	N205 M207 H211	N205-K209 VanDerWaalsContact O-CB 3.31Å; N205-K209 WeakPolarHBondContact O-CB 3.18Å; N205-K209 VanDerWaalsContact O-CG 3.28Å; N205-K209 WeakPolarHBondContact O-CG 3.32Å; N205-K209 PolarHBondContact O-N 3.47Å; M207-K209 VanDerWaalsContact C-N 3.32Å; M207-K209 PolarHBondContact O-N 3.03Å; K209-H211 VanDerWaalsContact C-N 3.3Å; K209-H211 PolarHBondContact O-N 3.24Å
210	G	97.8	Very high	97.9	Very high	20 Å²	20	30 Å²	30	21%	0.206	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	10	-179.4	0	0	0	0	0	114.8	Y93 F206 M207 L208 L212 K213	Y93-G210 WeakPolarHBondContact OH-CA 3.4Å; F206-G210 PolarHBondContact O-N 3.41Å; M207-G210 PolarHBondContact O-N 3.35Å; L208-G210 PolarHBondContact O-N 3.4Å; G210-L212 PolarHBondContact O-N 3.09Å; G210-K213 WeakPolarHBondContact O-CB 3.47Å; G210-K213 WeakPolarHBondContact O-CG 3.42Å; G210-K213 PolarHBondContact O-N 3.29Å
211	H	98.5	Very high	97.6	Very high	29 Å²	29	33.4 Å²	33.4	13%	0.134	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.9	179.6	-57.8	159.3	0	0	0	112.2	F206 K209 K213 L268	F206-H211 HydrophobicContact CB-CB 4.06Å; F206-H211 HydrophobicContact CD1-CB 4.29Å; F206-H211 AromaticContact CD1-ND1 3.27Å; F206-H211 VanDerWaalsContact CD1-ND1 3.27Å; F206-H211 WeakPolarHBondContact CD1-ND1 3.42Å; F206-H211 AromaticContact CE1-ND1 3.81Å; F206-H211 HydrophobicContact CG-CB 4.33Å; F206-H211 PolarHBondContact O-N 3.14Å; K209-H211 VanDerWaalsContact C-N 3.3Å; K209-H211 PolarHBondContact O-N 3.24Å; H211-K213 VanDerWaalsContact C-N 3.31Å; H211-K213 PolarHBondContact O-N 3.01Å; H211-L268 HydrophobicContact CB-CD1 4.47Å
212	L	98.4	Very high	97.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	1.9	177.4	-62.4	-177.4	0	0	0	114.1	Y93 F206 M207 G210 C214 Q215 F216 F228 F231 L268	Y93-L212 HydrophobicContact CE2-CB 4.24Å; F206-L212 HydrophobicContact CB-CD1 4.31Å; F206-L212 HydrophobicContact CB-CD2 4.1Å; F206-L212 HydrophobicContact CB-CG 3.85Å; M207-L212 HydrophobicContact CB-CD1 4.05Å; M207-L212 HydrophobicContact SD-CB 4.19Å; M207-L212 HydrophobicContact SD-CD1 4.05Å; G210-L212 PolarHBondContact O-N 3.09Å; L212-C214 PolarHBondContact O-N 2.9Å; L212-Q215 WeakPolarHBondContact O-CB 3.48Å; L212-Q215 PolarHBondContact O-N 3.05Å; L212-F216 HydrophobicContact CB-CE1 4.47Å; L212-F216 HydrophobicContact CB-CZ 4.44Å; L212-F216 HydrophobicContact CD1-CE1 4.4Å; L212-F216 HydrophobicContact CD1-CE2 4.46Å; L212-F216 HydrophobicContact CD1-CZ 3.96Å; L212-F216 PolarHBondContact O-N 3.28Å; L212-F228 HydrophobicContact CD1-CD2 4.37Å; L212-F228 HydrophobicContact CD1-CE2 4.4Å; L212-F231 HydrophobicContact CD1-CD1 3.86Å; L212-F231 HydrophobicContact CD1-CE1 3.98Å; L212-F231 HydrophobicContact CD1-CG 4.49Å; L212-F231 HydrophobicContact CD2-CD1 3.92Å; L212-F231 HydrophobicContact CD2-CD2 4.14Å; L212-F231 HydrophobicContact CD2-CE1 3.5Å; L212-F231 VanDerWaalsContact CD2-CE1 3.5Å; L212-F231 HydrophobicContact CD2-CE2 3.75Å; L212-F231 HydrophobicContact CD2-CG 4.23Å; L212-F231 HydrophobicContact CD2-CZ 3.41Å; L212-F231 VanDerWaalsContact CD2-CZ 3.41Å; L212-F231 HydrophobicContact CG-CE1 4.38Å; L212-L268 HydrophobicContact CD2-CD1 3.63Å; L212-L268 HydrophobicContact CD2-CD2 3.54Å; L212-L268 HydrophobicContact CD2-CG 4.2Å
213	K	98.2	Very high	97.4	Very high	20 Å²	20	31.9 Å²	31.9	9%	0.087	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-46.9	-177.7	-73.8	-178.3	173.9	-171.9	0	113	L32 E35 Y93 G210 H211 Q215 F216 Y217	L32-K213 HydrophobicContact CD2-CB 3.92Å; L32-K213 HydrophobicContact CD2-CD 4.11Å; E35-K213 IonicContact OE1-NZ 3.51Å; E35-K213 PolarHBondContact OE1-NZ 2.95Å; E35-K213 WeakPolarHBondContact OE2-CE 3.44Å; E35-K213 IonicContact OE2-NZ 2.79Å; E35-K213 PolarHBondContact OE2-NZ 3.14Å; Y93-K213 HydrophobicContact CD1-CG 4.43Å; Y93-K213 HydrophobicContact CD2-CG 4.19Å; Y93-K213 HydrophobicContact CE1-CG 3.96Å; Y93-K213 HydrophobicContact CE2-CB 4.39Å; Y93-K213 HydrophobicContact CE2-CG 3.69Å; G210-K213 WeakPolarHBondContact O-CB 3.47Å; G210-K213 WeakPolarHBondContact O-CG 3.42Å; G210-K213 PolarHBondContact O-N 3.29Å; H211-K213 VanDerWaalsContact C-N 3.31Å; H211-K213 PolarHBondContact O-N 3.01Å; K213-Q215 VanDerWaalsContact C-N 3.35Å; K213-Q215 PolarHBondContact O-N 2.95Å; K213-F216 PolarHBondContact O-N 2.91Å; K213-Y217 HydrophobicContact CB-CD2 4.27Å; K213-Y217 HydrophobicContact CB-CE2 4Å; K213-Y217 HydrophobicContact CD-CE2 4.42Å; K213-Y217 HydrophobicContact CG-CE2 4.3Å; K213-Y217 VanDerWaalsContact O-CB 3.24Å; K213-Y217 WeakPolarHBondContact O-CB 3.28Å; K213-Y217 WeakPolarHBondContact O-CD2 3.4Å; K213-Y217 PolarHBondContact O-N 3.47Å
214	C	98.4	Very high	97.3	Very high	14 Å²	14	33.9 Å²	33.9	10%	0.095	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-51	177.3	-66.7	0	0	0	0	110.4	A28 L212 F216 N218 D270 C273	A28-C214 HydrophobicContact CB-CB 4.27Å; L212-C214 PolarHBondContact O-N 2.9Å; C214-F216 PolarHBondContact O-N 3.36Å; C214-N218 WeakPolarHBondContact O-CB 3.16Å; C214-N218 PolarHBondContact O-N 2.9Å; C214-N218 PolarHBondContact O-ND2 3.25Å; C214-N218 VanDerWaalsContact O-ND2 3.15Å; C214-D270 VanDerWaalsContact CB-O 3.25Å; C214-D270 WeakPolarHBondContact CB-O 2.88Å; C214-D270 PolarHBondContact SG-O 3.47Å; C214-C273 HydrophobicContact CB-CB 4.06Å
215	Q	98.1	Very high	97.3	Very high	9 Å²	9	37 Å²	37	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-51.2	-55.6	176.7	176.8	64.4	18.9	0	0	112	L212 K213 N218 M219 F231 L268 C273 L275	L212-Q215 WeakPolarHBondContact O-CB 3.48Å; L212-Q215 PolarHBondContact O-N 3.05Å; K213-Q215 VanDerWaalsContact C-N 3.35Å; K213-Q215 PolarHBondContact O-N 2.95Å; Q215-N218 PolarHBondContact O-N 3.01Å; Q215-M219 WeakPolarHBondContact O-CB 3.27Å; Q215-M219 WeakPolarHBondContact O-CG 3.49Å; Q215-M219 PolarHBondContact O-N 2.81Å; Q215-F231 HydrophobicContact CG-CD2 4.16Å; Q215-L268 HydrophobicContact CB-CD2 4.17Å; Q215-C273 PolarHBondContact OE1-SG 3.21Å; Q215-L275 PolarHBondContact NE2-O 2.86Å
216	F	98.2	Very high	97.2	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-74.7	-38.1	-173.9	-70.9	2	0	0	0	113.1	Y93 L96 M207 L212 K213 C214 N218 M219 S220 A223 D227 F228 F231	Y93-F216 HydrophobicContact CD2-CB 4.26Å; Y93-F216 AromaticContact CD2-CD2 3.87Å; Y93-F216 HydrophobicContact CD2-CD2 3.87Å; Y93-F216 HydrophobicContact CD2-CG 4.49Å; Y93-F216 AromaticContact CE2-CD2 3.92Å; Y93-F216 HydrophobicContact CE2-CD2 3.92Å; Y93-F216 HydrophobicContact CE2-CG 4.49Å; L96-F216 HydrophobicContact CD2-CD2 4.13Å; L96-F216 HydrophobicContact CD2-CE2 3.54Å; L96-F216 HydrophobicContact CD2-CZ 4.45Å; M207-F216 HydrophobicContact CE-CD2 4Å; M207-F216 HydrophobicContact CE-CE2 3.79Å; M207-F216 HydrophobicContact SD-CD2 3.94Å; M207-F216 HydrophobicContact SD-CE2 3.4Å; M207-F216 WeakPolarHBondContact SD-CE2 3.42Å; M207-F216 HydrophobicContact SD-CZ 4.24Å; L212-F216 HydrophobicContact CB-CE1 4.47Å; L212-F216 HydrophobicContact CB-CZ 4.44Å; L212-F216 HydrophobicContact CD1-CE1 4.4Å; L212-F216 HydrophobicContact CD1-CE2 4.46Å; L212-F216 HydrophobicContact CD1-CZ 3.96Å; L212-F216 PolarHBondContact O-N 3.28Å; K213-F216 PolarHBondContact O-N 2.91Å; C214-F216 PolarHBondContact O-N 3.36Å; F216-N218 PolarHBondContact O-N 3.31Å; F216-M219 PolarHBondContact O-N 3.41Å; F216-S220 PolarHBondContact O-N 3.45Å; F216-A223 HydrophobicContact CB-CB 4.43Å; F216-A223 HydrophobicContact CD2-CB 3.79Å; F216-A223 HydrophobicContact CE2-CB 4.49Å; F216-A223 HydrophobicContact CG-CB 4.43Å; F216-D227 HydrophobicContact CE1-CB 4.38Å; F216-F228 HydrophobicContact CZ-CB 4.26Å; F216-F228 HydrophobicContact CZ-CD2 4.33Å; F216-F231 HydrophobicContact CE1-CB 4.25Å
217	Y	98.2	Very high	97.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-24.2	176.1	-63.7	-14.8	0	0	0	112.6	G27 T31 L32 E35 Q89 Y93 K213	G27-Y217 VanDerWaalsContact CA-O 3.25Å; G27-Y217 WeakPolarHBondContact CA-O 3.43Å; T31-Y217 HydrophobicContact CG2-CD1 4Å; T31-Y217 HydrophobicContact CG2-CD2 3.55Å; T31-Y217 HydrophobicContact CG2-CE1 4.05Å; T31-Y217 HydrophobicContact CG2-CE2 3.58Å; T31-Y217 HydrophobicContact CG2-CG 3.76Å; L32-Y217 HydrophobicContact CD2-CD2 4.15Å; L32-Y217 HydrophobicContact CD2-CE2 3.92Å; L32-Y217 HydrophobicContact CG-CD2 4.09Å; L32-Y217 HydrophobicContact CG-CE2 4.28Å; E35-Y217 PolarHBondContact OE2-OH 3.05Å; Q89-Y217 HydrophobicContact CB-CD1 3.81Å; Q89-Y217 HydrophobicContact CB-CE1 3.99Å; Q89-Y217 HydrophobicContact CG-CD1 4.48Å; Q89-Y217 PolarHBondContact NE2-O 3.39Å; Q89-Y217 WeakPolarHBondContact O-CE1 3.17Å; Y93-Y217 HydrophobicContact CD2-CE1 4.34Å; Y93-Y217 HydrophobicContact CG-CE1 4.47Å; K213-Y217 HydrophobicContact CB-CD2 4.27Å; K213-Y217 HydrophobicContact CB-CE2 4Å; K213-Y217 HydrophobicContact CD-CE2 4.42Å; K213-Y217 HydrophobicContact CG-CE2 4.3Å; K213-Y217 VanDerWaalsContact O-CB 3.24Å; K213-Y217 WeakPolarHBondContact O-CB 3.28Å; K213-Y217 WeakPolarHBondContact O-CD2 3.4Å; K213-Y217 PolarHBondContact O-N 3.47Å
218	N	97.8	Very high	97.2	Very high	13 Å²	13	41.9 Å²	41.9	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-80.4	-43.3	174.5	-80.9	-19.9	0	0	0	111.5	A28 C214 Q215 F216 V271 C273 R274	A28-N218 VanDerWaalsContact CB-OD1 3.28Å; A28-N218 WeakPolarHBondContact CB-OD1 3.46Å; A28-N218 PolarHBondContact N-OD1 3.38Å; C214-N218 WeakPolarHBondContact O-CB 3.16Å; C214-N218 PolarHBondContact O-N 2.9Å; C214-N218 PolarHBondContact O-ND2 3.25Å; C214-N218 VanDerWaalsContact O-ND2 3.15Å; Q215-N218 PolarHBondContact O-N 3.01Å; F216-N218 PolarHBondContact O-N 3.31Å; N218-V271 PolarHBondContact ND2-O 2.76Å; N218-C273 WeakPolarHBondContact CB-O 3.39Å; N218-C273 PolarHBondContact ND2-N 3.04Å; N218-C273 PolarHBondContact ND2-O 2.9Å; N218-R274 HydrophobicContact CB-CG 3.98Å; N218-R274 VanDerWaalsContact CB-NH2 3.34Å; N218-R274 PolarHBondContact O-NH1 2.86Å; N218-R274 PolarHBondContact O-NH2 3.11Å; N218-R274 PolarHBondContact OD1-NH2 3.36Å
219	M	95.2	Very high	97.2	Very high	87 Å²	87	38.1 Å²	38.1	43%	0.429	21%	0.21	S	C	.	.	H	α-helix	trans	-86.7	-30.7	-169.2	-64.3	-64.4	-73.2	0	0	114.3	Q215 F216 R274	Q215-M219 WeakPolarHBondContact O-CB 3.27Å; Q215-M219 WeakPolarHBondContact O-CG 3.49Å; Q215-M219 PolarHBondContact O-N 2.81Å; F216-M219 PolarHBondContact O-N 3.41Å; M219-R274 HydrophobicContact SD-CB 3.82Å; M219-R274 HydrophobicContact SD-CG 3.87Å
220	S	92.9	Very high	97.2	Very high	19 Å²	19	33.6 Å²	33.6	13%	0.133	19%	0.191	C	C	.	.			trans	-137.9	142.5	-166	-46.5	0	0	0	0	111.8	Q89 F216 S222 D227	Q89-S220 PolarHBondContact NE2-O 2.79Å; F216-S220 PolarHBondContact O-N 3.45Å; S220-S222 WeakPolarHBondContact CB-O 3.4Å; S220-S222 PolarHBondContact O-N 3.34Å; S220-D227 VanDerWaalsContact OG-CG 3.25Å; S220-D227 PolarHBondContact OG-OD1 3.4Å
221	S	92.9	Very high	97.3	Very high	72 Å²	72	32.8 Å²	32.8	50%	0.503	18%	0.182	S	C	.	.	S	Bend	trans	-71.1	-22.4	173.4	55.4	0	0	0	0	113.2	Y85 Q89	Y85-S221 VanDerWaalsContact CE2-CB 3.41Å; Q89-S221 WeakPolarHBondContact CG-O 3.49Å
222	S	94.7	Very high	97.3	Very high	58 Å²	58	31.4 Å²	31.4	41%	0.406	18%	0.176	S	C	.	.	S	Bend	trans	-148	127.7	175.5	178.8	0	0	0	0	106.8	S92 S220	S92-S222 WeakPolarHBondContact CB-OG 3.44Å; S92-S222 VanDerWaalsContact OG-CA 3.31Å; S92-S222 WeakPolarHBondContact OG-CA 3.3Å; S92-S222 PolarHBondContact OG-OG 3.07Å; S220-S222 WeakPolarHBondContact CB-O 3.4Å; S220-S222 PolarHBondContact O-N 3.34Å
223	A	97	Very high	97.3	Very high	11 Å²	11	31.4 Å²	31.4	9%	0.091	18%	0.176	C	C	.	.			trans	-69.5	141.5	175.7	0	0	0	0	0	110.7	S92 L96 F216	S92-A223 PolarHBondContact OG-N 3.12Å; L96-A223 HydrophobicContact CD2-CB 3.78Å; F216-A223 HydrophobicContact CB-CB 4.43Å; F216-A223 HydrophobicContact CD2-CB 3.79Å; F216-A223 HydrophobicContact CE2-CB 4.49Å; F216-A223 HydrophobicContact CG-CB 4.43Å
224	S	97.2	Very high	97.3	Very high	42 Å²	42	32 Å²	32	29%	0.294	18%	0.177	S	C	.	.			trans	-138.2	167.9	-176.7	71.4	0	0	0	0	111.8	L96 Q226 D227 F228	L96-S224 VanDerWaalsContact CD2-O 3.3Å; L96-S224 WeakPolarHBondContact CD2-O 3.37Å; S224-Q226 PolarHBondContact O-N 2.97Å; S224-Q226 PolarHBondContact OG-N 3.5Å; S224-D227 WeakPolarHBondContact CB-OD2 3.32Å; S224-D227 PolarHBondContact N-OD2 3.13Å; S224-D227 PolarHBondContact O-N 3.49Å; S224-D227 VanDerWaalsContact OG-CG 3.27Å; S224-D227 PolarHBondContact OG-N 2.91Å; S224-D227 PolarHBondContact OG-OD2 3.04Å; S224-F228 PolarHBondContact O-N 3.34Å
225	I	98.1	Very high	97.3	Very high	80 Å²	80	31.3 Å²	31.3	41%	0.41	17%	0.173	S	C	.	.	H	α-helix	trans	-61.2	-35.8	174.5	-65.4	174.6	0	0	0	110.4	L96 K99 D227 F228 N229	L96-I225 HydrophobicContact CD1-CG1 3.86Å; K99-I225 HydrophobicContact CB-CD1 4.48Å; K99-I225 HydrophobicContact CD-CD1 4.45Å; I225-D227 PolarHBondContact O-N 3.16Å; I225-F228 PolarHBondContact O-N 3.34Å; I225-N229 WeakPolarHBondContact O-CB 3.38Å; I225-N229 VanDerWaalsContact O-CG 3.25Å; I225-N229 PolarHBondContact O-N 3.3Å
226	Q	97.4	Very high	97.4	Very high	122 Å²	122	30.9 Å²	30.9	57%	0.57	17%	0.171	S	C	*	.	H	α-helix	trans	-60.8	-44.4	175.8	-168.8	179.9	-11.7	0	0	111.6	Y167 S224 F228 N229 E230	Y167-Q226 HydrophobicContact CE2-CG 4.44Å; Y167-Q226 WeakPolarHBondContact OH-CG 3.37Å; S224-Q226 PolarHBondContact O-N 2.97Å; S224-Q226 PolarHBondContact OG-N 3.5Å; Q226-F228 VanDerWaalsContact C-N 3.29Å; Q226-F228 PolarHBondContact O-N 3.07Å; Q226-N229 PolarHBondContact O-N 2.84Å; Q226-E230 WeakPolarHBondContact O-CG 3.48Å; Q226-E230 PolarHBondContact O-N 3.48Å
227	D	97.8	Very high	97.4	Very high	39 Å²	39	33 Å²	33	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-60.5	-39.5	177.2	-58.6	-62.8	0	0	0	112.1	F216 S220 S224 I225 F231	F216-D227 HydrophobicContact CE1-CB 4.38Å; S220-D227 VanDerWaalsContact OG-CG 3.25Å; S220-D227 PolarHBondContact OG-OD1 3.4Å; S224-D227 WeakPolarHBondContact CB-OD2 3.32Å; S224-D227 PolarHBondContact N-OD2 3.13Å; S224-D227 PolarHBondContact O-N 3.49Å; S224-D227 VanDerWaalsContact OG-CG 3.27Å; S224-D227 PolarHBondContact OG-N 2.91Å; S224-D227 PolarHBondContact OG-OD2 3.04Å; I225-D227 PolarHBondContact O-N 3.16Å; D227-F231 WeakPolarHBondContact O-CB 3.1Å; D227-F231 PolarHBondContact O-N 3.16Å
228	F	98.7	Very high	97.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-42.5	175.8	-177.2	-95.1	0	0	0	111.9	L96 L100 L160 N164 M207 L212 F216 S224 I225 Q226 F231 Y232	L96-F228 HydrophobicContact CD2-CB 4.38Å; L100-F228 HydrophobicContact CD1-CB 4.4Å; L100-F228 HydrophobicContact CD1-CD1 4.19Å; L100-F228 HydrophobicContact CD1-CD2 3.54Å; L100-F228 HydrophobicContact CD1-CE1 4.36Å; L100-F228 HydrophobicContact CD1-CE2 3.74Å; L100-F228 HydrophobicContact CD1-CG 3.78Å; L100-F228 HydrophobicContact CD1-CZ 4.15Å; L100-F228 HydrophobicContact CD2-CB 4.39Å; L100-F228 HydrophobicContact CD2-CD1 3.53Å; L100-F228 HydrophobicContact CD2-CD2 4.41Å; L100-F228 HydrophobicContact CD2-CE1 3.81Å; L100-F228 HydrophobicContact CD2-CG 3.85Å; L100-F228 HydrophobicContact CD2-CZ 4.36Å; L100-F228 HydrophobicContact CG-CG 4.47Å; L160-F228 HydrophobicContact CD1-CE1 4.26Å; N164-F228 WeakPolarHBondContact OD1-CE1 3.23Å; M207-F228 HydrophobicContact CB-CE2 4.28Å; L212-F228 HydrophobicContact CD1-CD2 4.37Å; L212-F228 HydrophobicContact CD1-CE2 4.4Å; F216-F228 HydrophobicContact CZ-CB 4.26Å; F216-F228 HydrophobicContact CZ-CD2 4.33Å; S224-F228 PolarHBondContact O-N 3.34Å; I225-F228 PolarHBondContact O-N 3.34Å; Q226-F228 VanDerWaalsContact C-N 3.29Å; Q226-F228 PolarHBondContact O-N 3.07Å; F228-F231 PolarHBondContact O-N 3.04Å; F228-Y232 PolarHBondContact O-N 2.98Å
229	N	98.6	Very high	97.4	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-41.2	177.8	-72	-14.1	0	0	0	112.2	N164 Y167 I225 Q226 F231 Y232 C233	N164-N229 PolarHBondContact ND2-OD1 2.81Å; Y167-N229 HydrophobicContact CD1-CB 3.47Å; Y167-N229 VanDerWaalsContact CD1-CB 3.47Å; Y167-N229 HydrophobicContact CD2-CB 3.75Å; Y167-N229 WeakPolarHBondContact CD2-ND2 3.31Å; Y167-N229 HydrophobicContact CE1-CB 3.61Å; Y167-N229 HydrophobicContact CE2-CB 3.87Å; Y167-N229 HydrophobicContact CG-CB 3.53Å; I225-N229 WeakPolarHBondContact O-CB 3.38Å; I225-N229 VanDerWaalsContact O-CG 3.25Å; I225-N229 PolarHBondContact O-N 3.3Å; Q226-N229 PolarHBondContact O-N 2.84Å; N229-F231 VanDerWaalsContact C-N 3.34Å; N229-Y232 WeakPolarHBondContact O-CB 3.32Å; N229-Y232 PolarHBondContact O-N 2.64Å; N229-C233 PolarHBondContact O-N 3.25Å; N229-C233 PolarHBondContact O-SG 3.04Å
230	E	98.1	Very high	97.5	Very high	51 Å²	51	30 Å²	30	24%	0.238	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-40.2	173.6	-70.7	-56.2	156.1	0	0	111.9	Y167 H172 Q226 Y232 C233 Y234	Y167-E230 HydrophobicContact CE1-CG 4.47Å; Y167-E230 VanDerWaalsContact CE1-OE1 3.32Å; Y167-E230 WeakPolarHBondContact CE1-OE1 3.37Å; Y167-E230 PolarHBondContact OH-OE1 3.18Å; H172-E230 IonicContact CD2-OE2 3.36Å; H172-E230 IonicContact CE1-OE2 3.97Å; H172-E230 IonicContact NE2-OE1 3.54Å; H172-E230 IonicContact NE2-OE2 3.55Å; H172-E230 PolarHBondContact NE2-OE2 3.13Å; Q226-E230 WeakPolarHBondContact O-CG 3.48Å; Q226-E230 PolarHBondContact O-N 3.48Å; E230-Y232 VanDerWaalsContact C-N 3.32Å; E230-Y232 PolarHBondContact O-N 3.09Å; E230-C233 PolarHBondContact O-N 2.88Å; E230-Y234 PolarHBondContact O-N 2.87Å
231	F	98.5	Very high	97.7	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.013	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-39.3	172.8	177.9	-98.6	0	0	0	112.2	F206 L212 Q215 F216 D227 F228 N229 Y234 T235 L264 L268 L275	F206-F231 HydrophobicContact CD2-CE1 4.47Å; F206-F231 HydrophobicContact CD2-CZ 4.4Å; L212-F231 HydrophobicContact CD1-CD1 3.86Å; L212-F231 HydrophobicContact CD1-CE1 3.98Å; L212-F231 HydrophobicContact CD1-CG 4.49Å; L212-F231 HydrophobicContact CD2-CD1 3.92Å; L212-F231 HydrophobicContact CD2-CD2 4.14Å; L212-F231 HydrophobicContact CD2-CE1 3.5Å; L212-F231 VanDerWaalsContact CD2-CE1 3.5Å; L212-F231 HydrophobicContact CD2-CE2 3.75Å; L212-F231 HydrophobicContact CD2-CG 4.23Å; L212-F231 HydrophobicContact CD2-CZ 3.41Å; L212-F231 VanDerWaalsContact CD2-CZ 3.41Å; L212-F231 HydrophobicContact CG-CE1 4.38Å; Q215-F231 HydrophobicContact CG-CD2 4.16Å; F216-F231 HydrophobicContact CE1-CB 4.25Å; D227-F231 WeakPolarHBondContact O-CB 3.1Å; D227-F231 PolarHBondContact O-N 3.16Å; F228-F231 PolarHBondContact O-N 3.04Å; N229-F231 VanDerWaalsContact C-N 3.34Å; F231-Y234 HydrophobicContact CE2-CD1 4.31Å; F231-Y234 PolarHBondContact O-N 2.8Å; F231-T235 VanDerWaalsContact CE1-OG1 3.28Å; F231-T235 WeakPolarHBondContact CE1-OG1 3.43Å; F231-T235 VanDerWaalsContact CZ-OG1 3.28Å; F231-T235 WeakPolarHBondContact CZ-OG1 3.42Å; F231-T235 WeakPolarHBondContact O-CB 3.42Å; F231-T235 PolarHBondContact O-N 2.79Å; F231-T235 PolarHBondContact O-OG1 3.39Å; F231-L264 HydrophobicContact CZ-CD2 4.2Å; F231-L268 HydrophobicContact CE2-CD2 3.7Å; F231-L268 HydrophobicContact CZ-CD1 4Å; F231-L268 HydrophobicContact CZ-CD2 4Å; F231-L268 HydrophobicContact CZ-CG 4.49Å; F231-L275 HydrophobicContact CE2-CD1 4.41Å
232	Y	98.8	Very high	97.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-46	172.5	166.7	-96.4	0	0	0	111.2	N164 F168 G196 L199 T200 F228 N229 E230 Y234 T235 F236	N164-Y232 VanDerWaalsContact C-CE1 3.49Å; N164-Y232 HydrophobicContact CB-CD1 3.72Å; N164-Y232 HydrophobicContact CB-CD2 3.99Å; N164-Y232 HydrophobicContact CB-CE1 3.7Å; N164-Y232 HydrophobicContact CB-CE2 3.98Å; N164-Y232 HydrophobicContact CB-CG 3.86Å; N164-Y232 WeakPolarHBondContact O-CE1 3.44Å; F168-Y232 HydrophobicContact CB-CD1 4.42Å; F168-Y232 HydrophobicContact CB-CE1 3.95Å; G196-Y232 WeakPolarHBondContact CA-OH 3.34Å; G196-Y232 WeakPolarHBondContact O-CE2 3.48Å; G196-Y232 PolarHBondContact O-OH 3.24Å; L199-Y232 HydrophobicContact CB-CE2 4.24Å; T200-Y232 VanDerWaalsContact OG1-CE2 3.3Å; T200-Y232 WeakPolarHBondContact OG1-CE2 3.39Å; F228-Y232 PolarHBondContact O-N 2.98Å; N229-Y232 WeakPolarHBondContact O-CB 3.32Å; N229-Y232 PolarHBondContact O-N 2.64Å; E230-Y232 VanDerWaalsContact C-N 3.32Å; E230-Y232 PolarHBondContact O-N 3.09Å; Y232-Y234 PolarHBondContact O-N 3.41Å; Y232-T235 WeakPolarHBondContact O-CB 3.4Å; Y232-T235 PolarHBondContact O-N 3.35Å; Y232-T235 VanDerWaalsContact O-N 3.1Å; Y232-F236 WeakPolarHBondContact O-CB 3.39Å; Y232-F236 PolarHBondContact O-N 3.4Å
233	C	98.7	Very high	98	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-45.3	177.8	-61.6	0	0	0	0	111.7	F168 N229 E230 T235 F236 Y237 L277	F168-C233 HydrophobicContact CD2-CB 3.79Å; F168-C233 VanDerWaalsContact CD2-SG 3.52Å; F168-C233 HydrophobicContact CE2-CB 4.27Å; N229-C233 PolarHBondContact O-N 3.25Å; N229-C233 PolarHBondContact O-SG 3.04Å; E230-C233 PolarHBondContact O-N 2.88Å; C233-T235 VanDerWaalsContact C-N 3.31Å; C233-T235 PolarHBondContact O-N 3.14Å; C233-F236 PolarHBondContact O-N 3.07Å; C233-Y237 WeakPolarHBondContact O-CB 3.41Å; C233-Y237 PolarHBondContact O-N 2.98Å; C233-L277 HydrophobicContact CB-CD1 3.97Å
234	Y	98.6	Very high	97.8	Very high	31 Å²	31	31 Å²	31	12%	0.122	15%	0.151	C	C	.	.	H	α-helix	trans	-58.2	-43.5	172.3	169.1	-92.3	0	0	0	112.2	E230 F231 Y232 F236 S238 L264 L275 C276	E230-Y234 PolarHBondContact O-N 2.87Å; F231-Y234 HydrophobicContact CE2-CD1 4.31Å; F231-Y234 PolarHBondContact O-N 2.8Å; Y232-Y234 PolarHBondContact O-N 3.41Å; Y234-F236 VanDerWaalsContact C-N 3.34Å; Y234-S238 WeakPolarHBondContact CE1-OG 3.32Å; Y234-S238 WeakPolarHBondContact CE2-OG 3.07Å; Y234-S238 WeakPolarHBondContact O-CB 3.2Å; Y234-S238 PolarHBondContact O-N 3.42Å; Y234-S238 PolarHBondContact O-OG 2.9Å; Y234-L264 HydrophobicContact CE1-CD1 3.9Å; Y234-L275 HydrophobicContact CD1-CB 3.77Å; Y234-L275 HydrophobicContact CD1-CD1 4.3Å; Y234-L275 HydrophobicContact CD2-CB 4.28Å; Y234-L275 HydrophobicContact CE1-CB 3.56Å; Y234-L275 HydrophobicContact CE1-CD1 3.54Å; Y234-L275 HydrophobicContact CE1-CD2 4.35Å; Y234-L275 HydrophobicContact CE1-CG 3.97Å; Y234-L275 HydrophobicContact CE2-CB 4.04Å; Y234-L275 HydrophobicContact CG-CB 4.13Å; Y234-C276 VanDerWaalsContact CD2-C 3.44Å; Y234-C276 WeakPolarHBondContact CD2-O 3.26Å
235	T	98.7	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-44.3	179.6	-63.4	0	0	0	0	110.5	L199 L202 F231 Y232 C233 S238 F239 F260 L264	L199-T235 HydrophobicContact CB-CG2 4.23Å; L199-T235 HydrophobicContact CD1-CG2 4.29Å; L199-T235 HydrophobicContact CD2-CG2 4.28Å; L202-T235 HydrophobicContact CD2-CG2 4.38Å; F231-T235 VanDerWaalsContact CE1-OG1 3.28Å; F231-T235 WeakPolarHBondContact CE1-OG1 3.43Å; F231-T235 VanDerWaalsContact CZ-OG1 3.28Å; F231-T235 WeakPolarHBondContact CZ-OG1 3.42Å; F231-T235 WeakPolarHBondContact O-CB 3.42Å; F231-T235 PolarHBondContact O-N 2.79Å; F231-T235 PolarHBondContact O-OG1 3.39Å; Y232-T235 WeakPolarHBondContact O-CB 3.4Å; Y232-T235 PolarHBondContact O-N 3.35Å; Y232-T235 VanDerWaalsContact O-N 3.1Å; C233-T235 VanDerWaalsContact C-N 3.31Å; C233-T235 PolarHBondContact O-N 3.14Å; T235-S238 PolarHBondContact O-N 3.32Å; T235-F239 WeakPolarHBondContact O-CB 3.45Å; T235-F239 PolarHBondContact O-N 3.15Å; T235-F260 HydrophobicContact CG2-CE1 3.88Å; T235-F260 HydrophobicContact CG2-CZ 4.22Å; T235-F260 WeakPolarHBondContact O-CZ 3.47Å; T235-L264 HydrophobicContact CG2-CD2 3.69Å
236	F	98.7	Very high	97.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.9	-46.5	179	-160.1	84.6	0	0	0	112.2	F168 M179 F192 T195 L199 Y232 C233 Y234 S238 F239 H240	F168-F236 AromaticContact CD1-CD2 3.79Å; F168-F236 HydrophobicContact CD1-CD2 3.79Å; F168-F236 HydrophobicContact CD1-CE2 4.24Å; F168-F236 HydrophobicContact CD1-CG 4.35Å; F168-F236 AromaticContact CE1-CD2 3.23Å; F168-F236 HydrophobicContact CE1-CD2 3.23Å; F168-F236 AromaticContact CE1-CE2 3.67Å; F168-F236 HydrophobicContact CE1-CE2 3.67Å; F168-F236 HydrophobicContact CE1-CG 4.14Å; F168-F236 AromaticContact CZ-CD2 3.97Å; F168-F236 HydrophobicContact CZ-CD2 3.97Å; M179-F236 HydrophobicContact CE-CD2 3.19Å; M179-F236 HydrophobicContact CE-CE2 3.4Å; M179-F236 VanDerWaalsContact CE-CE2 3.4Å; M179-F236 HydrophobicContact CE-CG 4.32Å; F192-F236 HydrophobicContact CD1-CZ 4.32Å; F192-F236 AromaticContact CD2-CE2 3.84Å; F192-F236 HydrophobicContact CD2-CE2 3.84Å; F192-F236 AromaticContact CD2-CZ 3.79Å; F192-F236 HydrophobicContact CD2-CZ 3.79Å; F192-F236 HydrophobicContact CE1-CE2 4.33Å; F192-F236 HydrophobicContact CE1-CZ 4.22Å; F192-F236 AromaticContact CE2-CE2 3.35Å; F192-F236 HydrophobicContact CE2-CE2 3.35Å; F192-F236 AromaticContact CE2-CZ 3.74Å; F192-F236 HydrophobicContact CE2-CZ 3.74Å; F192-F236 HydrophobicContact CG-CZ 4.1Å; F192-F236 AromaticContact CZ-CE2 3.61Å; F192-F236 HydrophobicContact CZ-CE2 3.61Å; F192-F236 AromaticContact CZ-CZ 3.94Å; F192-F236 HydrophobicContact CZ-CZ 3.94Å; T195-F236 HydrophobicContact CG2-CE1 3.99Å; L199-F236 HydrophobicContact CB-CD1 4.49Å; L199-F236 HydrophobicContact CD1-CB 4.16Å; L199-F236 HydrophobicContact CD1-CD1 3.57Å; L199-F236 HydrophobicContact CD1-CE1 4.28Å; L199-F236 HydrophobicContact CD1-CG 4.18Å; L199-F236 HydrophobicContact CG-CD1 4.43Å; Y232-F236 WeakPolarHBondContact O-CB 3.39Å; Y232-F236 PolarHBondContact O-N 3.4Å; C233-F236 PolarHBondContact O-N 3.07Å; Y234-F236 VanDerWaalsContact C-N 3.34Å; F236-S238 PolarHBondContact O-N 3.21Å; F236-F239 PolarHBondContact O-N 3.5Å; F236-H240 PolarHBondContact O-N 2.64Å
237	Y	98.5	Very high	96.5	Very high	50 Å²	50	36.6 Å²	36.6	20%	0.196	18%	0.177	C	C	.	.	H	α-helix	trans	-57.2	-47.5	171.5	171.6	-100.4	0	0	0	112.5	L175 M179 C233 F239 H240 K241 L277 P278	L175-Y237 HydrophobicContact CD1-CD2 4.01Å; L175-Y237 HydrophobicContact CD1-CE2 4.3Å; L175-Y237 HydrophobicContact CD2-CD2 4.05Å; M179-Y237 HydrophobicContact SD-CD2 4.17Å; C233-Y237 WeakPolarHBondContact O-CB 3.41Å; C233-Y237 PolarHBondContact O-N 2.98Å; Y237-F239 VanDerWaalsContact C-N 3.34Å; Y237-F239 PolarHBondContact O-N 3Å; Y237-H240 PolarHBondContact O-N 3.44Å; Y237-K241 HydrophobicContact CD1-CG 4.5Å; Y237-K241 HydrophobicContact CD2-CG 4.49Å; Y237-K241 HydrophobicContact CE1-CG 4Å; Y237-K241 HydrophobicContact CE2-CD 4.27Å; Y237-K241 HydrophobicContact CE2-CG 4.03Å; Y237-K241 WeakPolarHBondContact O-CG 3.47Å; Y237-K241 PolarHBondContact O-N 2.86Å; Y237-K241 WeakPolarHBondContact OH-CE 3.47Å; Y237-L277 VanDerWaalsContact CB-CD2 3.44Å; Y237-L277 HydrophobicContact CD1-CD2 4.12Å; Y237-L277 HydrophobicContact CD2-CD2 4.45Å; Y237-L277 HydrophobicContact CG-CD2 3.75Å; Y237-P278 HydrophobicContact CD1-CG 4.37Å; Y237-P278 HydrophobicContact CE1-CG 3.54Å; Y237-P278 HydrophobicContact CE2-CG 4.44Å; Y237-P278 WeakPolarHBondContact OH-CG 3.35Å
238	S	98.3	Very high	96	Very high	20 Å²	20	36.4 Å²	36.4	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-65.5	-38.5	-178.6	-64.3	0	0	0	0	112	Y234 T235 F236 K241 F242	Y234-S238 WeakPolarHBondContact CE1-OG 3.32Å; Y234-S238 WeakPolarHBondContact CE2-OG 3.07Å; Y234-S238 WeakPolarHBondContact O-CB 3.2Å; Y234-S238 PolarHBondContact O-N 3.42Å; Y234-S238 PolarHBondContact O-OG 2.9Å; T235-S238 PolarHBondContact O-N 3.32Å; F236-S238 PolarHBondContact O-N 3.21Å; S238-K241 PolarHBondContact O-N 2.91Å; S238-F242 WeakPolarHBondContact O-CB 3.4Å; S238-F242 PolarHBondContact O-N 2.68Å
239	F	98.4	Very high	95.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-46.5	173.4	178.7	-92.2	0	0	0	110.7	T195 L199 T235 F236 Y237 K241 F242 W243 F253 F260	T195-F239 HydrophobicContact CG2-CD1 3.53Å; T195-F239 HydrophobicContact CG2-CE1 3.32Å; T195-F239 HydrophobicContact CG2-CG 4.4Å; T195-F239 HydrophobicContact CG2-CZ 4.04Å; L199-F239 HydrophobicContact CD1-CB 3.44Å; L199-F239 VanDerWaalsContact CD1-CB 3.44Å; L199-F239 HydrophobicContact CD1-CD1 4.22Å; L199-F239 HydrophobicContact CD1-CD2 4.45Å; L199-F239 HydrophobicContact CD1-CG 3.79Å; L199-F239 HydrophobicContact CD2-CB 4.31Å; L199-F239 HydrophobicContact CD2-CD2 4.09Å; L199-F239 HydrophobicContact CD2-CG 4.24Å; T235-F239 WeakPolarHBondContact O-CB 3.45Å; T235-F239 PolarHBondContact O-N 3.15Å; F236-F239 PolarHBondContact O-N 3.5Å; Y237-F239 VanDerWaalsContact C-N 3.34Å; Y237-F239 PolarHBondContact O-N 3Å; F239-K241 VanDerWaalsContact C-N 3.32Å; F239-K241 PolarHBondContact O-N 3.15Å; F239-F242 HydrophobicContact CD2-CD1 4.37Å; F239-F242 HydrophobicContact CE2-CD1 4.42Å; F239-F242 CarbonylContact O-C 3.55Å; F239-F242 WeakPolarHBondContact O-CA 3.43Å; F239-F242 WeakPolarHBondContact O-CB 3.38Å; F239-F242 PolarHBondContact O-N 2.85Å; F239-F242 VanDerWaalsContact O-N 3.09Å; F239-W243 HydrophobicContact CD1-CB 4.44Å; F239-W243 HydrophobicContact CE1-CB 4.09Å; F239-W243 HydrophobicContact CE1-CD2 4.34Å; F239-W243 HydrophobicContact CE1-CE3 4.05Å; F239-W243 HydrophobicContact CE1-CG 4.39Å; F239-W243 HydrophobicContact CE2-CE3 4.43Å; F239-W243 HydrophobicContact CZ-CD2 4.32Å; F239-W243 AromaticContact CZ-CE3 3.57Å; F239-W243 HydrophobicContact CZ-CE3 3.57Å; F239-W243 HydrophobicContact CZ-CZ3 4.23Å; F239-W243 WeakPolarHBondContact O-CB 3.45Å; F239-W243 PolarHBondContact O-N 2.96Å; F239-F253 HydrophobicContact CE1-CE2 4.45Å; F239-F253 HydrophobicContact CZ-CE2 4.01Å; F239-F260 HydrophobicContact CB-CD1 4.22Å; F239-F260 HydrophobicContact CB-CD2 4.42Å; F239-F260 HydrophobicContact CB-CE1 3.86Å; F239-F260 HydrophobicContact CB-CE2 4.1Å; F239-F260 HydrophobicContact CB-CG 4.47Å; F239-F260 HydrophobicContact CB-CZ 3.79Å; F239-F260 HydrophobicContact CD2-CB 4.02Å; F239-F260 AromaticContact CD2-CD1 3.65Å; F239-F260 HydrophobicContact CD2-CD1 3.65Å; F239-F260 HydrophobicContact CD2-CD2 4.27Å; F239-F260 HydrophobicContact CD2-CE1 4.16Å; F239-F260 AromaticContact CD2-CG 3.7Å; F239-F260 HydrophobicContact CD2-CG 3.7Å; F239-F260 HydrophobicContact CE2-CB 4.39Å; F239-F260 HydrophobicContact CG-CD1 4.43Å
240	H	97.5	Very high	95.3	Very high	20 Å²	20	42 Å²	42	9%	0.093	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-43.9	177.9	176.5	85.5	0	0	0	112.2	M179 Y190 F236 Y237 F242 W243 T244	M179-H240 HydrophobicContact CE-CB 3.41Å; M179-H240 VanDerWaalsContact CE-CB 3.41Å; M179-H240 HydrophobicContact CG-CB 4.48Å; M179-H240 HydrophobicContact SD-CB 4.22Å; Y190-H240 AromaticContact CE1-ND1 3.6Å; Y190-H240 AromaticContact CZ-ND1 3.65Å; Y190-H240 PolarHBondContact OH-ND1 3.37Å; F236-H240 PolarHBondContact O-N 2.64Å; Y237-H240 PolarHBondContact O-N 3.44Å; H240-F242 VanDerWaalsContact C-N 3.34Å; H240-F242 PolarHBondContact O-N 2.99Å; H240-W243 PolarHBondContact O-N 2.68Å; H240-T244 WeakPolarHBondContact O-CB 3.46Å; H240-T244 WeakPolarHBondContact O-CG2 3.37Å; H240-T244 PolarHBondContact O-N 2.7Å; H240-T244 PolarHBondContact O-OG1 3.22Å
241	K	96.9	Very high	94.9	Very high	118 Å²	118	47.6 Å²	47.6	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-37.3	175	-65.6	-68.4	-98.8	-173.7	0	112.4	Y237 S238 F239	Y237-K241 HydrophobicContact CD1-CG 4.5Å; Y237-K241 HydrophobicContact CD2-CG 4.49Å; Y237-K241 HydrophobicContact CE1-CG 4Å; Y237-K241 HydrophobicContact CE2-CD 4.27Å; Y237-K241 HydrophobicContact CE2-CG 4.03Å; Y237-K241 WeakPolarHBondContact O-CG 3.47Å; Y237-K241 PolarHBondContact O-N 2.86Å; Y237-K241 WeakPolarHBondContact OH-CE 3.47Å; S238-K241 PolarHBondContact O-N 2.91Å; F239-K241 VanDerWaalsContact C-N 3.32Å; F239-K241 PolarHBondContact O-N 3.15Å
242	F	96.8	Very high	94.6	Very high	38 Å²	38	50.6 Å²	50.6	17%	0.167	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-51.7	172.1	165.1	-98.3	0	0	0	110.6	S238 F239 H240 K245 R248 Y256 D259 F260	S238-F242 WeakPolarHBondContact O-CB 3.4Å; S238-F242 PolarHBondContact O-N 2.68Å; F239-F242 HydrophobicContact CD2-CD1 4.37Å; F239-F242 HydrophobicContact CE2-CD1 4.42Å; F239-F242 CarbonylContact O-C 3.55Å; F239-F242 WeakPolarHBondContact O-CA 3.43Å; F239-F242 WeakPolarHBondContact O-CB 3.38Å; F239-F242 PolarHBondContact O-N 2.85Å; F239-F242 VanDerWaalsContact O-N 3.09Å; H240-F242 VanDerWaalsContact C-N 3.34Å; H240-F242 PolarHBondContact O-N 2.99Å; F242-K245 PolarHBondContact O-N 3.35Å; F242-R248 VanDerWaalsContact CE1-CZ 3.45Å; F242-R248 VanDerWaalsContact CE1-NH2 3.3Å; F242-R248 VanDerWaalsContact CE2-NH2 3.25Å; F242-R248 PolarHBondContact O-NH2 2.99Å; F242-Y256 VanDerWaalsContact CE1-O 3.25Å; F242-Y256 WeakPolarHBondContact CE1-O 3.47Å; F242-D259 HydrophobicContact CZ-CB 4.09Å; F242-F260 HydrophobicContact CB-CD2 3.88Å; F242-F260 HydrophobicContact CB-CE2 4.4Å; F242-F260 HydrophobicContact CD1-CB 3.82Å; F242-F260 HydrophobicContact CD1-CD2 4.1Å; F242-F260 HydrophobicContact CD1-CG 4.29Å; F242-F260 HydrophobicContact CE1-CB 3.72Å; F242-F260 HydrophobicContact CG-CB 4.32Å; F242-F260 AromaticContact CG-CD2 3.94Å; F242-F260 HydrophobicContact CG-CD2 3.94Å; F242-F260 HydrophobicContact CZ-CB 4.14Å
243	W	96	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57.7	-54.5	-176.6	-174.3	-91.7	0	0	0	111.1	K188 W189 Y190 F239 H240 K245 H246 R248 I250 F253 Y256	K188-W243 PolarHBondContact O-NE1 3.02Å; W189-W243 WeakPolarHBondContact O-CZ2 3.15Å; Y190-W243 AromaticContact CD1-CD1 3.39Å; Y190-W243 HydrophobicContact CD1-CD2 4.42Å; Y190-W243 AromaticContact CD1-CG 3.98Å; Y190-W243 HydrophobicContact CD1-CG 3.98Å; Y190-W243 AromaticContact CD1-NE1 3.52Å; Y190-W243 HydrophobicContact CE1-CG 4.48Å; F239-W243 HydrophobicContact CD1-CB 4.44Å; F239-W243 HydrophobicContact CE1-CB 4.09Å; F239-W243 HydrophobicContact CE1-CD2 4.34Å; F239-W243 HydrophobicContact CE1-CE3 4.05Å; F239-W243 HydrophobicContact CE1-CG 4.39Å; F239-W243 HydrophobicContact CE2-CE3 4.43Å; F239-W243 HydrophobicContact CZ-CD2 4.32Å; F239-W243 AromaticContact CZ-CE3 3.57Å; F239-W243 HydrophobicContact CZ-CE3 3.57Å; F239-W243 HydrophobicContact CZ-CZ3 4.23Å; F239-W243 WeakPolarHBondContact O-CB 3.45Å; F239-W243 PolarHBondContact O-N 2.96Å; H240-W243 PolarHBondContact O-N 2.68Å; W243-K245 PolarHBondContact O-N 2.96Å; W243-K245 VanDerWaalsContact O-N 3.16Å; W243-H246 VanDerWaalsContact O-O 3.06Å; W243-R248 VanDerWaalsContact CA-NE 3.3Å; W243-R248 HydrophobicContact CD2-CB 4.28Å; W243-R248 VanDerWaalsContact CD2-CD 3.46Å; W243-R248 HydrophobicContact CD2-CG 4.45Å; W243-R248 VanDerWaalsContact CE3-CD 3.44Å; W243-R248 HydrophobicContact CH2-CB 3.95Å; W243-R248 HydrophobicContact CZ2-CB 3.67Å; W243-R248 HydrophobicContact CZ3-CB 4.37Å; W243-R248 VanDerWaalsContact O-CD 3.3Å; W243-R248 WeakPolarHBondContact O-CD 3.44Å; W243-R248 PolarHBondContact O-NE 3.29Å; W243-I250 HydrophobicContact CH2-CD1 4.22Å; W243-I250 HydrophobicContact CZ2-CD1 4.26Å; W243-F253 HydrophobicContact CH2-CB 4.42Å; W243-F253 AromaticContact CH2-CD2 3.74Å; W243-F253 HydrophobicContact CH2-CD2 3.74Å; W243-F253 AromaticContact CZ3-CD2 3.66Å; W243-F253 HydrophobicContact CZ3-CD2 3.66Å; W243-F253 HydrophobicContact CZ3-CE2 4.3Å; W243-Y256 HydrophobicContact CE3-CD2 4.46Å; W243-Y256 AromaticContact CH2-CD2 3.99Å; W243-Y256 HydrophobicContact CH2-CD2 3.99Å; W243-Y256 AromaticContact CZ3-CD2 3.64Å; W243-Y256 HydrophobicContact CZ3-CD2 3.64Å; W243-Y256 HydrophobicContact CZ3-CG 4.16Å
244	T	93.6	Very high	94.1	Very high	24 Å²	24	56.5 Å²	56.5	15%	0.147	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.2	-172.3	56.2	0	0	0	0	115.5	K188 H240 H246	K188-T244 HydrophobicContact CD-CG2 4.32Å; K188-T244 WeakPolarHBondContact CE-O 3.49Å; K188-T244 PolarHBondContact NZ-O 3.39Å; H240-T244 WeakPolarHBondContact O-CB 3.46Å; H240-T244 WeakPolarHBondContact O-CG2 3.37Å; H240-T244 PolarHBondContact O-N 2.7Å; H240-T244 PolarHBondContact O-OG1 3.22Å; T244-H246 VanDerWaalsContact C-N 3.3Å; T244-H246 PolarHBondContact O-N 3.45Å
245	K	92.1	Very high	93.9	Very high	153 Å²	153	60.4 Å²	60.4	67%	0.665	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.7	-179.9	-168.2	179.8	177.4	-176.6	0	112.8	F242 W243	F242-K245 PolarHBondContact O-N 3.35Å; W243-K245 PolarHBondContact O-N 2.96Å; W243-K245 VanDerWaalsContact O-N 3.16Å
246	H	87.6	Confident	93.8	Very high	106 Å²	106	62.2 Å²	62.2	49%	0.491	30%	0.301	S	S	.	.	S	Bend	trans	-137.1	154.7	179.2	-59.3	-65.4	0	0	0	108.8	W243 T244 R248	W243-H246 VanDerWaalsContact O-O 3.06Å; T244-H246 VanDerWaalsContact C-N 3.3Å; T244-H246 PolarHBondContact O-N 3.45Å; H246-R248 PolarHBondContact O-N 3.09Å
247	P	85.8	Confident	93.6	Very high	102 Å²	102	62.3 Å²	62.3	66%	0.662	30%	0.301	S	S	*	.			trans	-54.4	137.2	164.7	-21.3	33	0	0	0	109.4
248	R	87.9	Confident	93.5	Very high	35 Å²	35	64.7 Å²	64.7	13%	0.132	32%	0.317	C	S	.	.			trans	-130.6	137.9	-178	-72.7	-175.9	-170.5	-109.4	10.1	110.7	F242 W243 H246 Y256	F242-R248 VanDerWaalsContact CE1-CZ 3.45Å; F242-R248 VanDerWaalsContact CE1-NH2 3.3Å; F242-R248 VanDerWaalsContact CE2-NH2 3.25Å; F242-R248 PolarHBondContact O-NH2 2.99Å; W243-R248 VanDerWaalsContact CA-NE 3.3Å; W243-R248 HydrophobicContact CD2-CB 4.28Å; W243-R248 VanDerWaalsContact CD2-CD 3.46Å; W243-R248 HydrophobicContact CD2-CG 4.45Å; W243-R248 VanDerWaalsContact CE3-CD 3.44Å; W243-R248 HydrophobicContact CH2-CB 3.95Å; W243-R248 HydrophobicContact CZ2-CB 3.67Å; W243-R248 HydrophobicContact CZ3-CB 4.37Å; W243-R248 VanDerWaalsContact O-CD 3.3Å; W243-R248 WeakPolarHBondContact O-CD 3.44Å; W243-R248 PolarHBondContact O-NE 3.29Å; H246-R248 PolarHBondContact O-N 3.09Å; R248-Y256 HydrophobicContact CB-CD2 4.2Å; R248-Y256 HydrophobicContact CB-CE2 3.77Å; R248-Y256 HydrophobicContact CG-CD2 4.26Å; R248-Y256 HydrophobicContact CG-CE2 3.91Å; R248-Y256 VanDerWaalsContact NH1-CE1 3.34Å; R248-Y256 VanDerWaalsContact NH1-CG 3.28Å
249	D	89.8	Confident	93.5	Very high	66 Å²	66	67.1 Å²	67.1	35%	0.353	33%	0.329	S	S	.	.			trans	-79.6	117.8	172	173.5	14.2	0	0	0	109.6	M251 Q252 Y256	D249-M251 PolarHBondContact O-N 2.95Å; D249-M251 VanDerWaalsContact OD1-CB 3.28Å; D249-M251 WeakPolarHBondContact OD1-CB 3.49Å; D249-M251 WeakPolarHBondContact OD1-CG 3.06Å; D249-M251 PolarHBondContact OD1-N 3.45Å; D249-Q252 PolarHBondContact O-N 3.25Å; D249-Q252 PolarHBondContact OD2-NE2 3.23Å; D249-Q252 VanDerWaalsContact OD2-NE2 3.15Å; D249-Y256 WeakPolarHBondContact O-CE2 3.46Å
250	I	91.4	Very high	93.4	Very high	64 Å²	64	67.5 Å²	67.5	33%	0.328	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-61.7	-26.9	177.8	-169.2	74.8	0	0	0	112.4	W189 W243 Q252 F253	W189-I250 HydrophobicContact CE3-CB 4.41Å; W189-I250 HydrophobicContact CE3-CD1 4Å; W189-I250 HydrophobicContact CE3-CG1 4.06Å; W189-I250 HydrophobicContact CZ3-CB 4.46Å; W189-I250 HydrophobicContact CZ3-CD1 3.85Å; W189-I250 HydrophobicContact CZ3-CG1 3.74Å; W243-I250 HydrophobicContact CH2-CD1 4.22Å; W243-I250 HydrophobicContact CZ2-CD1 4.26Å; I250-Q252 PolarHBondContact O-N 3.44Å; I250-Q252 VanDerWaalsContact O-N 3.1Å; I250-F253 HydrophobicContact CD1-CB 4.16Å; I250-F253 HydrophobicContact CD1-CD2 4.03Å; I250-F253 HydrophobicContact CD1-CG 4.38Å; I250-F253 WeakPolarHBondContact O-CB 3.36Å; I250-F253 PolarHBondContact O-N 3.45Å
251	M	90.9	Very high	93.5	Very high	170 Å²	170	66.8 Å²	66.8	84%	0.837	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-63.2	-19.7	175.4	-57.7	-177	67	0	0	112	D249	D249-M251 PolarHBondContact O-N 2.95Å; D249-M251 VanDerWaalsContact OD1-CB 3.28Å; D249-M251 WeakPolarHBondContact OD1-CB 3.49Å; D249-M251 WeakPolarHBondContact OD1-CG 3.06Å; D249-M251 PolarHBondContact OD1-N 3.45Å
252	Q	92.6	Very high	93.6	Very high	65 Å²	65	66 Å²	66	30%	0.304	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-100.8	15.8	175	-68.2	179.6	74.3	0	0	113.3	D249 I250 N254 K255 Y256	D249-Q252 PolarHBondContact O-N 3.25Å; D249-Q252 PolarHBondContact OD2-NE2 3.23Å; D249-Q252 VanDerWaalsContact OD2-NE2 3.15Å; I250-Q252 PolarHBondContact O-N 3.44Å; I250-Q252 VanDerWaalsContact O-N 3.1Å; Q252-N254 PolarHBondContact O-N 3.34Å; Q252-K255 WeakPolarHBondContact O-CB 3.14Å; Q252-K255 PolarHBondContact O-N 3.31Å; Q252-K255 VanDerWaalsContact O-N 3.12Å; Q252-Y256 HydrophobicContact CB-CD2 4.04Å; Q252-Y256 HydrophobicContact CB-CE2 3.65Å; Q252-Y256 VanDerWaalsContact O-CD2 3.28Å; Q252-Y256 WeakPolarHBondContact O-CD2 3.39Å; Q252-Y256 PolarHBondContact O-N 3.36Å
253	F	92.8	Very high	93.6	Very high	21 Å²	21	70.3 Å²	70.3	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-49.7	-52.1	-176.9	177.9	-98.5	0	0	0	113.2	T195 F239 W243 I250 K255 Y256 C257	T195-F253 HydrophobicContact CG2-CE2 4.4Å; T195-F253 HydrophobicContact CG2-CZ 4.24Å; T195-F253 VanDerWaalsContact OG1-CE2 3.32Å; T195-F253 WeakPolarHBondContact OG1-CE2 3.3Å; T195-F253 VanDerWaalsContact OG1-CZ 3.31Å; T195-F253 WeakPolarHBondContact OG1-CZ 3.27Å; F239-F253 HydrophobicContact CE1-CE2 4.45Å; F239-F253 HydrophobicContact CZ-CE2 4.01Å; W243-F253 HydrophobicContact CH2-CB 4.42Å; W243-F253 AromaticContact CH2-CD2 3.74Å; W243-F253 HydrophobicContact CH2-CD2 3.74Å; W243-F253 AromaticContact CZ3-CD2 3.66Å; W243-F253 HydrophobicContact CZ3-CD2 3.66Å; W243-F253 HydrophobicContact CZ3-CE2 4.3Å; I250-F253 HydrophobicContact CD1-CB 4.16Å; I250-F253 HydrophobicContact CD1-CD2 4.03Å; I250-F253 HydrophobicContact CD1-CG 4.38Å; I250-F253 WeakPolarHBondContact O-CB 3.36Å; I250-F253 PolarHBondContact O-N 3.45Å; F253-K255 VanDerWaalsContact C-N 3.34Å; F253-K255 PolarHBondContact O-N 2.97Å; F253-Y256 PolarHBondContact O-N 3.03Å; F253-Y256 VanDerWaalsContact O-N 3.11Å; F253-C257 VanDerWaalsContact CE1-SG 3.52Å; F253-C257 WeakPolarHBondContact CZ-SG 3.48Å; F253-C257 PolarHBondContact O-N 3.03Å; F253-C257 PolarHBondContact O-SG 2.82Å; F253-C257 VanDerWaalsContact O-SG 3.41Å
254	N	92.9	Very high	93.7	Very high	103 Å²	103	70.5 Å²	70.5	55%	0.551	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-41.7	-178.9	-71.2	-34.3	0	0	0	112.5	Q252 Y256 C257 D258	Q252-N254 PolarHBondContact O-N 3.34Å; N254-Y256 VanDerWaalsContact C-N 3.32Å; N254-Y256 PolarHBondContact O-N 3.35Å; N254-C257 WeakPolarHBondContact O-CB 3.38Å; N254-C257 PolarHBondContact O-N 3.43Å; N254-D258 PolarHBondContact O-N 3.43Å
255	K	95.6	Very high	94	Very high	113 Å²	113	73 Å²	73	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-43.2	175.4	176.6	-175.2	170.8	-170.9	0	111.1	Q252 F253 D258 D259	Q252-K255 WeakPolarHBondContact O-CB 3.14Å; Q252-K255 PolarHBondContact O-N 3.31Å; Q252-K255 VanDerWaalsContact O-N 3.12Å; F253-K255 VanDerWaalsContact C-N 3.34Å; F253-K255 PolarHBondContact O-N 2.97Å; K255-D258 PolarHBondContact O-N 2.88Å; K255-D259 VanDerWaalsContact O-CG 3.3Å; K255-D259 PolarHBondContact O-N 3.08Å
256	Y	95.6	Very high	94.3	Very high	39 Å²	39	70.3 Å²	70.3	15%	0.153	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-35.3	177.1	-67.7	-44.6	0	0	0	113	F242 W243 R248 D249 Q252 F253 N254 D258 F260	F242-Y256 VanDerWaalsContact CE1-O 3.25Å; F242-Y256 WeakPolarHBondContact CE1-O 3.47Å; W243-Y256 HydrophobicContact CE3-CD2 4.46Å; W243-Y256 AromaticContact CH2-CD2 3.99Å; W243-Y256 HydrophobicContact CH2-CD2 3.99Å; W243-Y256 AromaticContact CZ3-CD2 3.64Å; W243-Y256 HydrophobicContact CZ3-CD2 3.64Å; W243-Y256 HydrophobicContact CZ3-CG 4.16Å; R248-Y256 HydrophobicContact CB-CD2 4.2Å; R248-Y256 HydrophobicContact CB-CE2 3.77Å; R248-Y256 HydrophobicContact CG-CD2 4.26Å; R248-Y256 HydrophobicContact CG-CE2 3.91Å; R248-Y256 VanDerWaalsContact NH1-CE1 3.34Å; R248-Y256 VanDerWaalsContact NH1-CG 3.28Å; D249-Y256 WeakPolarHBondContact O-CE2 3.46Å; Q252-Y256 HydrophobicContact CB-CD2 4.04Å; Q252-Y256 HydrophobicContact CB-CE2 3.65Å; Q252-Y256 VanDerWaalsContact O-CD2 3.28Å; Q252-Y256 WeakPolarHBondContact O-CD2 3.39Å; Q252-Y256 PolarHBondContact O-N 3.36Å; F253-Y256 PolarHBondContact O-N 3.03Å; F253-Y256 VanDerWaalsContact O-N 3.11Å; N254-Y256 VanDerWaalsContact C-N 3.32Å; N254-Y256 PolarHBondContact O-N 3.35Å; Y256-D258 VanDerWaalsContact C-N 3.35Å; Y256-F260 VanDerWaalsContact O-CB 3.31Å; Y256-F260 WeakPolarHBondContact O-CB 3.43Å; Y256-F260 PolarHBondContact O-N 3.17Å
257	C	95.2	Very high	94.8	Very high	2 Å²	2	69 Å²	69	1%	0.014	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-41.7	170.9	-69.2	0	0	0	0	111.9	H198 F253 N254 F260 G261	H198-C257 VanDerWaalsContact NE2-CB 3.31Å; H198-C257 WeakPolarHBondContact NE2-CB 3.38Å; F253-C257 VanDerWaalsContact CE1-SG 3.52Å; F253-C257 WeakPolarHBondContact CZ-SG 3.48Å; F253-C257 PolarHBondContact O-N 3.03Å; F253-C257 PolarHBondContact O-SG 2.82Å; F253-C257 VanDerWaalsContact O-SG 3.41Å; N254-C257 WeakPolarHBondContact O-CB 3.38Å; N254-C257 PolarHBondContact O-N 3.43Å; C257-F260 PolarHBondContact O-N 3.32Å; C257-G261 PolarHBondContact O-N 3.01Å
258	D	96.2	Very high	95.4	Very high	99 Å²	99	64.2 Å²	64.2	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-46	175.9	-71.3	-27	0	0	0	111.9	N254 K255 Y256 F260 G261 N262	N254-D258 PolarHBondContact O-N 3.43Å; K255-D258 PolarHBondContact O-N 2.88Å; Y256-D258 VanDerWaalsContact C-N 3.35Å; D258-F260 VanDerWaalsContact C-N 3.32Å; D258-F260 PolarHBondContact O-N 3.17Å; D258-G261 PolarHBondContact O-N 3.13Å; D258-N262 WeakPolarHBondContact O-CB 3.48Å; D258-N262 PolarHBondContact O-N 2.84Å; D258-N262 PolarHBondContact O-ND2 2.71Å; D258-N262 VanDerWaalsContact O-ND2 3.16Å
259	D	97.2	Very high	95.8	Very high	72 Å²	72	67.3 Å²	67.3	39%	0.385	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-45.3	175.6	-72.8	-19.6	0	0	0	111.2	F242 K255 K263	F242-D259 HydrophobicContact CZ-CB 4.09Å; K255-D259 VanDerWaalsContact O-CG 3.3Å; K255-D259 PolarHBondContact O-N 3.08Å; D259-K263 PolarHBondContact O-N 2.84Å; D259-K263 VanDerWaalsContact O-N 3.1Å
260	F	98.2	Very high	96.2	Very high	8 Å²	8	68.2 Å²	68.2	4%	0.035	35%	0.346	C	S	.	.	H	α-helix	trans	-62.3	-47.2	174.8	171.8	-103	0	0	0	111.7	L199 L202 T235 F239 F242 Y256 C257 D258 N262 K263 L264	L199-F260 HydrophobicContact CD2-CD1 4.17Å; L199-F260 HydrophobicContact CD2-CE1 3.99Å; L202-F260 HydrophobicContact CD2-CD1 3.97Å; L202-F260 HydrophobicContact CD2-CE1 3.95Å; T235-F260 HydrophobicContact CG2-CE1 3.88Å; T235-F260 HydrophobicContact CG2-CZ 4.22Å; T235-F260 WeakPolarHBondContact O-CZ 3.47Å; F239-F260 HydrophobicContact CB-CD1 4.22Å; F239-F260 HydrophobicContact CB-CD2 4.42Å; F239-F260 HydrophobicContact CB-CE1 3.86Å; F239-F260 HydrophobicContact CB-CE2 4.1Å; F239-F260 HydrophobicContact CB-CG 4.47Å; F239-F260 HydrophobicContact CB-CZ 3.79Å; F239-F260 HydrophobicContact CD2-CB 4.02Å; F239-F260 AromaticContact CD2-CD1 3.65Å; F239-F260 HydrophobicContact CD2-CD1 3.65Å; F239-F260 HydrophobicContact CD2-CD2 4.27Å; F239-F260 HydrophobicContact CD2-CE1 4.16Å; F239-F260 AromaticContact CD2-CG 3.7Å; F239-F260 HydrophobicContact CD2-CG 3.7Å; F239-F260 HydrophobicContact CE2-CB 4.39Å; F239-F260 HydrophobicContact CG-CD1 4.43Å; F242-F260 HydrophobicContact CB-CD2 3.88Å; F242-F260 HydrophobicContact CB-CE2 4.4Å; F242-F260 HydrophobicContact CD1-CB 3.82Å; F242-F260 HydrophobicContact CD1-CD2 4.1Å; F242-F260 HydrophobicContact CD1-CG 4.29Å; F242-F260 HydrophobicContact CE1-CB 3.72Å; F242-F260 HydrophobicContact CG-CB 4.32Å; F242-F260 AromaticContact CG-CD2 3.94Å; F242-F260 HydrophobicContact CG-CD2 3.94Å; F242-F260 HydrophobicContact CZ-CB 4.14Å; Y256-F260 VanDerWaalsContact O-CB 3.31Å; Y256-F260 WeakPolarHBondContact O-CB 3.43Å; Y256-F260 PolarHBondContact O-N 3.17Å; C257-F260 PolarHBondContact O-N 3.32Å; D258-F260 VanDerWaalsContact C-N 3.32Å; D258-F260 PolarHBondContact O-N 3.17Å; F260-N262 VanDerWaalsContact C-N 3.32Å; F260-N262 PolarHBondContact O-N 3.26Å; F260-K263 PolarHBondContact O-N 3.13Å; F260-L264 HydrophobicContact CE1-CD2 3.9Å; F260-L264 HydrophobicContact CZ-CB 4.44Å; F260-L264 HydrophobicContact CZ-CD2 3.86Å; F260-L264 WeakPolarHBondContact O-CB 3.25Å; F260-L264 PolarHBondContact O-N 3.3Å
261	G	98.5	Very high	96.5	Very high	5 Å²	5	67.8 Å²	67.8	5%	0.052	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-43.2	179	0	0	0	0	0	112.1	F206 C257 D258 K263 L264 K265	F206-G261 WeakPolarHBondContact CZ-O 3.39Å; C257-G261 PolarHBondContact O-N 3.01Å; D258-G261 PolarHBondContact O-N 3.13Å; G261-K263 PolarHBondContact O-N 2.99Å; G261-L264 PolarHBondContact O-N 2.96Å; G261-K265 WeakPolarHBondContact O-CB 3.42Å; G261-K265 PolarHBondContact O-N 3.38Å
262	N	98.4	Very high	96.7	Very high	100 Å²	100	64.7 Å²	64.7	54%	0.535	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-44.4	175.6	-74.1	-38.2	0	0	0	111.9	D258 F260 K265 C266	D258-N262 WeakPolarHBondContact O-CB 3.48Å; D258-N262 PolarHBondContact O-N 2.84Å; D258-N262 PolarHBondContact O-ND2 2.71Å; D258-N262 VanDerWaalsContact O-ND2 3.16Å; F260-N262 VanDerWaalsContact C-N 3.32Å; F260-N262 PolarHBondContact O-N 3.26Å; N262-K265 PolarHBondContact O-N 3.43Å; N262-C266 PolarHBondContact O-N 2.98Å; N262-C266 VanDerWaalsContact O-N 3.17Å; N262-C266 PolarHBondContact O-SG 3.35Å
263	K	98.1	Very high	97	Very high	130 Å²	130	61.9 Å²	61.9	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-62.6	-45.6	176	-178.1	177.3	179.5	-178.4	0	112.2	D259 F260 G261 K265 C266 L267	D259-K263 PolarHBondContact O-N 2.84Å; D259-K263 VanDerWaalsContact O-N 3.1Å; F260-K263 PolarHBondContact O-N 3.13Å; G261-K263 PolarHBondContact O-N 2.99Å; K263-K265 VanDerWaalsContact C-N 3.35Å; K263-C266 WeakPolarHBondContact O-CB 3.16Å; K263-C266 PolarHBondContact O-N 3.27Å; K263-L267 PolarHBondContact O-N 3.42Å
264	L	98.5	Very high	97.2	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-40.2	179.5	-179	53.9	0	0	0	111.2	F206 F231 Y234 T235 F260 G261 C266 L267 L268 L275	F206-L264 HydrophobicContact CE2-CB 4.27Å; F206-L264 HydrophobicContact CE2-CD2 3.87Å; F206-L264 HydrophobicContact CE2-CG 3.88Å; F231-L264 HydrophobicContact CZ-CD2 4.2Å; Y234-L264 HydrophobicContact CE1-CD1 3.9Å; T235-L264 HydrophobicContact CG2-CD2 3.69Å; F260-L264 HydrophobicContact CE1-CD2 3.9Å; F260-L264 HydrophobicContact CZ-CB 4.44Å; F260-L264 HydrophobicContact CZ-CD2 3.86Å; F260-L264 WeakPolarHBondContact O-CB 3.25Å; F260-L264 PolarHBondContact O-N 3.3Å; G261-L264 PolarHBondContact O-N 2.96Å; L264-C266 VanDerWaalsContact C-N 3.3Å; L264-C266 PolarHBondContact O-N 2.94Å; L264-L267 HydrophobicContact CD1-CD1 4.47Å; L264-L267 WeakPolarHBondContact O-CB 3.21Å; L264-L267 PolarHBondContact O-N 3.48Å; L264-L267 VanDerWaalsContact O-N 3.11Å; L264-L268 HydrophobicContact CD1-CG 4.39Å; L264-L268 HydrophobicContact CG-CD1 4.2Å; L264-L268 HydrophobicContact CG-CG 4.45Å; L264-L268 WeakPolarHBondContact O-CG 3.3Å; L264-L268 PolarHBondContact O-N 3.4Å; L264-L275 HydrophobicContact CD1-CD1 3.69Å
265	K	98.5	Very high	97.4	Very high	77 Å²	77	63.1 Å²	63.1	34%	0.335	32%	0.319	S	S	.	.	H	α-helix	trans	-55.9	-43.3	173.1	-179.3	-174.1	172.5	-171.7	0	111.9	F206 G261 N262 K263 L267 L268 L269	F206-K265 HydrophobicContact CE1-CB 4.06Å; F206-K265 HydrophobicContact CZ-CB 4.05Å; G261-K265 WeakPolarHBondContact O-CB 3.42Å; G261-K265 PolarHBondContact O-N 3.38Å; N262-K265 PolarHBondContact O-N 3.43Å; K263-K265 VanDerWaalsContact C-N 3.35Å; K265-L267 VanDerWaalsContact C-N 3.28Å; K265-L267 PolarHBondContact O-N 3.27Å; K265-L268 PolarHBondContact O-N 2.87Å; K265-L269 HydrophobicContact CG-CD1 4.16Å; K265-L269 HydrophobicContact CG-CG 4.43Å; K265-L269 WeakPolarHBondContact O-CG 3.37Å; K265-L269 PolarHBondContact O-N 3.02Å; K265-L269 VanDerWaalsContact O-N 3.14Å
266	C	98.3	Very high	97.5	Very high	96 Å²	96	59 Å²	59	65%	0.649	31%	0.305	S	S	*	.	H	α-helix	trans	-59.2	-38.6	177.5	-69.8	0	0	0	0	112.6	N262 K263 L264	N262-C266 PolarHBondContact O-N 2.98Å; N262-C266 VanDerWaalsContact O-N 3.17Å; N262-C266 PolarHBondContact O-SG 3.35Å; K263-C266 WeakPolarHBondContact O-CB 3.16Å; K263-C266 PolarHBondContact O-N 3.27Å; L264-C266 VanDerWaalsContact C-N 3.3Å; L264-C266 PolarHBondContact O-N 2.94Å
267	L	98.2	Very high	97.5	Very high	79 Å²	79	57.2 Å²	57.2	41%	0.414	30%	0.298	S	S	.	.	H	α-helix	trans	-67.9	-42.3	175.7	-59.8	175.8	0	0	0	111.7	K263 L264 K265 L269 D270 L275	K263-L267 PolarHBondContact O-N 3.42Å; L264-L267 HydrophobicContact CD1-CD1 4.47Å; L264-L267 WeakPolarHBondContact O-CB 3.21Å; L264-L267 PolarHBondContact O-N 3.48Å; L264-L267 VanDerWaalsContact O-N 3.11Å; K265-L267 VanDerWaalsContact C-N 3.28Å; K265-L267 PolarHBondContact O-N 3.27Å; L267-L269 VanDerWaalsContact C-N 3.26Å; L267-L269 PolarHBondContact O-N 2.91Å; L267-D270 WeakPolarHBondContact O-CB 3.43Å; L267-D270 PolarHBondContact O-N 3.22Å; L267-L275 HydrophobicContact CB-CD1 4.17Å
268	L	98.4	Very high	97.3	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-27.9	-178.2	-73.8	175.3	0	0	0	114.1	F206 H211 L212 Q215 F231 L264 K265 D270 L275	F206-L268 HydrophobicContact CB-CD1 4.32Å; F206-L268 HydrophobicContact CD2-CD1 3.34Å; F206-L268 HydrophobicContact CE2-CD1 3.64Å; F206-L268 HydrophobicContact CG-CD1 3.9Å; F206-L268 HydrophobicContact CZ-CD1 4.4Å; H211-L268 HydrophobicContact CB-CD1 4.47Å; L212-L268 HydrophobicContact CD2-CD1 3.63Å; L212-L268 HydrophobicContact CD2-CD2 3.54Å; L212-L268 HydrophobicContact CD2-CG 4.2Å; Q215-L268 HydrophobicContact CB-CD2 4.17Å; F231-L268 HydrophobicContact CE2-CD2 3.7Å; F231-L268 HydrophobicContact CZ-CD1 4Å; F231-L268 HydrophobicContact CZ-CD2 4Å; F231-L268 HydrophobicContact CZ-CG 4.49Å; L264-L268 HydrophobicContact CD1-CG 4.39Å; L264-L268 HydrophobicContact CG-CD1 4.2Å; L264-L268 HydrophobicContact CG-CG 4.45Å; L264-L268 WeakPolarHBondContact O-CG 3.3Å; L264-L268 PolarHBondContact O-N 3.4Å; K265-L268 PolarHBondContact O-N 2.87Å; L268-D270 VanDerWaalsContact C-N 3.29Å; L268-L275 HydrophobicContact CD2-CD1 3.86Å; L268-L275 HydrophobicContact CG-CD1 4.38Å
269	L	96.7	Very high	96.9	Very high	101 Å²	101	60.6 Å²	60.6	53%	0.529	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.8	179.3	-66.3	177.5	0	0	0	113.5	K265 L267 V271	K265-L269 HydrophobicContact CG-CD1 4.16Å; K265-L269 HydrophobicContact CG-CG 4.43Å; K265-L269 WeakPolarHBondContact O-CG 3.37Å; K265-L269 PolarHBondContact O-N 3.02Å; K265-L269 VanDerWaalsContact O-N 3.14Å; L267-L269 VanDerWaalsContact C-N 3.26Å; L267-L269 PolarHBondContact O-N 2.91Å; L269-V271 PolarHBondContact O-N 3.26Å
270	D	97.8	Very high	96.2	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	30%	0.303	S	S	.	.	S	Bend	trans	-65.8	130.9	171	-167.4	-57.6	0	0	0	110	C214 L267 L268 N272 C273	C214-D270 VanDerWaalsContact CB-O 3.25Å; C214-D270 WeakPolarHBondContact CB-O 2.88Å; C214-D270 PolarHBondContact SG-O 3.47Å; L267-D270 WeakPolarHBondContact O-CB 3.43Å; L267-D270 PolarHBondContact O-N 3.22Å; L268-D270 VanDerWaalsContact C-N 3.29Å; D270-N272 PolarHBondContact O-N 3.24Å; D270-N272 VanDerWaalsContact O-N 3.16Å; D270-N272 WeakPolarHBondContact OD1-CA 3.3Å; D270-N272 WeakPolarHBondContact OD1-CB 3.48Å; D270-N272 PolarHBondContact OD1-N 3.42Å; D270-C273 HydrophobicContact CB-CB 4.38Å; D270-C273 WeakPolarHBondContact O-CB 3.37Å; D270-C273 PolarHBondContact O-N 2.62Å
271	V	97.3	Very high	95.3	Very high	54 Å²	54	65.1 Å²	65.1	33%	0.327	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.1	-179.5	73	0	0	0	0	112.7	A28 P29 N218 L269	A28-V271 HydrophobicContact CB-CG2 4.44Å; A28-V271 WeakPolarHBondContact CB-O 3.02Å; P29-V271 HydrophobicContact CB-CG2 4.4Å; P29-V271 HydrophobicContact CG-CG2 3.93Å; N218-V271 PolarHBondContact ND2-O 2.76Å; L269-V271 PolarHBondContact O-N 3.26Å
272	N	96.3	Very high	93.5	Very high	105 Å²	105	72.5 Å²	72.5	56%	0.561	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	11.1	178.2	-56.1	-54.6	0	0	0	112.7	D270 R274	D270-N272 PolarHBondContact O-N 3.24Å; D270-N272 VanDerWaalsContact O-N 3.16Å; D270-N272 WeakPolarHBondContact OD1-CA 3.3Å; D270-N272 WeakPolarHBondContact OD1-CB 3.48Å; D270-N272 PolarHBondContact OD1-N 3.42Å; N272-R274 WeakPolarHBondContact O-CG 3.27Å; N272-R274 PolarHBondContact O-N 2.93Å
273	C	98	Very high	91.4	Very high	7 Å²	7	78.2 Å²	78.2	5%	0.047	39%	0.391	C	S	.	.			trans	-52.8	126.2	-178.9	179.6	0	0	0	0	112.4	C214 Q215 N218 D270	C214-C273 HydrophobicContact CB-CB 4.06Å; Q215-C273 PolarHBondContact OE1-SG 3.21Å; N218-C273 WeakPolarHBondContact CB-O 3.39Å; N218-C273 PolarHBondContact ND2-N 3.04Å; N218-C273 PolarHBondContact ND2-O 2.9Å; D270-C273 HydrophobicContact CB-CB 4.38Å; D270-C273 WeakPolarHBondContact O-CB 3.37Å; D270-C273 PolarHBondContact O-N 2.62Å
274	R	96.9	Very high	91.1	Very high	120 Å²	120	75.6 Å²	75.6	45%	0.453	38%	0.382	S	S	.	.			trans	-149.6	68.8	-178.6	-68.2	175.2	-174.8	-67.2	-8.2	110.2	N218 M219 N272	N218-R274 HydrophobicContact CB-CG 3.98Å; N218-R274 VanDerWaalsContact CB-NH2 3.34Å; N218-R274 PolarHBondContact O-NH1 2.86Å; N218-R274 PolarHBondContact O-NH2 3.11Å; N218-R274 PolarHBondContact OD1-NH2 3.36Å; M219-R274 HydrophobicContact SD-CB 3.82Å; M219-R274 HydrophobicContact SD-CG 3.87Å; N272-R274 WeakPolarHBondContact O-CG 3.27Å; N272-R274 PolarHBondContact O-N 2.93Å
275	L	97.7	Very high	90.7	Very high	29 Å²	29	79.4 Å²	79.4	15%	0.152	40%	0.401	C	S	.	.			trans	-83.9	127.6	-178.3	-55.8	-179.6	0	0	0	109.9	Q215 F231 Y234 L264 L267 L268	Q215-L275 PolarHBondContact NE2-O 2.86Å; F231-L275 HydrophobicContact CE2-CD1 4.41Å; Y234-L275 HydrophobicContact CD1-CB 3.77Å; Y234-L275 HydrophobicContact CD1-CD1 4.3Å; Y234-L275 HydrophobicContact CD2-CB 4.28Å; Y234-L275 HydrophobicContact CE1-CB 3.56Å; Y234-L275 HydrophobicContact CE1-CD1 3.54Å; Y234-L275 HydrophobicContact CE1-CD2 4.35Å; Y234-L275 HydrophobicContact CE1-CG 3.97Å; Y234-L275 HydrophobicContact CE2-CB 4.04Å; Y234-L275 HydrophobicContact CG-CB 4.13Å; L264-L275 HydrophobicContact CD1-CD1 3.69Å; L267-L275 HydrophobicContact CB-CD1 4.17Å; L268-L275 HydrophobicContact CD2-CD1 3.86Å; L268-L275 HydrophobicContact CG-CD1 4.38Å
276	C	96.6	Very high	90.2	Very high	28 Å²	28	79.5 Å²	79.5	19%	0.189	41%	0.405	C	S	.	.			trans	-149.8	163	176.1	59.8	0	0	0	0	109.4	Y234 D280	Y234-C276 VanDerWaalsContact CD2-C 3.44Å; Y234-C276 WeakPolarHBondContact CD2-O 3.26Å; C276-D280 HydrophobicContact CB-CB 4.17Å
277	L	96.8	Very high	89.8	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.005	39%	0.391	C	S	.	.			trans	-60.2	151.1	174.4	-72.1	171	0	0	0	110.4	H172 L175 C233 Y237 E279 D280	H172-L277 WeakPolarHBondContact CE1-CD1 3.25Å; H172-L277 WeakPolarHBondContact NE2-CD1 3.34Å; L175-L277 HydrophobicContact CD2-CD1 4.29Å; L175-L277 HydrophobicContact CD2-CD2 3.94Å; C233-L277 HydrophobicContact CB-CD1 3.97Å; Y237-L277 VanDerWaalsContact CB-CD2 3.44Å; Y237-L277 HydrophobicContact CD1-CD2 4.12Å; Y237-L277 HydrophobicContact CD2-CD2 4.45Å; Y237-L277 HydrophobicContact CG-CD2 3.75Å; L277-E279 HydrophobicContact CB-CG 4.3Å; L277-E279 PolarHBondContact O-N 2.85Å; L277-E279 VanDerWaalsContact O-N 3.16Å; L277-D280 PolarHBondContact O-N 3.46Å
278	P	91.1	Very high	89.2	Confident	60 Å²	60	78.5 Å²	78.5	39%	0.39	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-55.9	-33.9	-177.6	-25.2	33	0	0	0	114.3	Y237 D280 K281	Y237-P278 HydrophobicContact CD1-CG 4.37Å; Y237-P278 HydrophobicContact CE1-CG 3.54Å; Y237-P278 HydrophobicContact CE2-CG 4.44Å; Y237-P278 WeakPolarHBondContact OH-CG 3.35Å; P278-D280 VanDerWaalsContact C-N 3.26Å; P278-D280 PolarHBondContact O-N 2.67Å; P278-K281 PolarHBondContact O-N 3.01Å
279	E	87.4	Confident	88.6	Confident	112 Å²	112	83.7 Å²	83.7	52%	0.523	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-70.8	-20.9	179	66.5	-162.5	140.2	0	0	113.5	H172 L277	H172-E279 IonicContact CE1-OE1 3.99Å; H172-E279 IonicContact ND1-OE1 3.68Å; H172-E279 PolarHBondContact ND1-OE1 3.01Å; L277-E279 HydrophobicContact CB-CG 4.3Å; L277-E279 PolarHBondContact O-N 2.85Å; L277-E279 VanDerWaalsContact O-N 3.16Å
280	D	83.4	Confident	88	Confident	25 Å²	25	82.5 Å²	82.5	13%	0.134	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-92.1	-6	179.8	-62.2	-42.9	0	0	0	113.4	C276 L277 P278 N282 K283	C276-D280 HydrophobicContact CB-CB 4.17Å; L277-D280 PolarHBondContact O-N 3.46Å; P278-D280 VanDerWaalsContact C-N 3.26Å; P278-D280 PolarHBondContact O-N 2.67Å; D280-N282 PolarHBondContact O-N 2.81Å; D280-N282 VanDerWaalsContact O-N 3.09Å; D280-K283 PolarHBondContact O-N 3.27Å; D280-K283 WeakPolarHBondContact OD1-CE 3.21Å; D280-K283 IonicContact OD1-NZ 3.97Å; D280-K283 PolarHBondContact OD1-NZ 2.82Å
281	K	77.4	Confident	87.3	Confident	150 Å²	150	82.3 Å²	82.3	65%	0.652	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.8	-178.9	-74	-172.4	176.4	-174.5	0	114.5	P278	P278-K281 PolarHBondContact O-N 3.01Å
282	N	61	Low	86.5	Confident	160 Å²	160	84.7 Å²	84.7	86%	0.856	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	4.9	-177.5	-64.2	-26.3	0	0	0	113.3	D280	D280-N282 PolarHBondContact O-N 2.81Å; D280-N282 VanDerWaalsContact O-N 3.09Å
283	K	54.9	Low	85.6	Confident	219 Å²	219	82.8 Å²	82.8	95%	0.952	40%	0.396	S	S	*	.			trans	-87.2	0	172	-68.2	178.5	-177.5	163.6	0	109.8	D280	D280-K283 PolarHBondContact O-N 3.27Å; D280-K283 WeakPolarHBondContact OD1-CE 3.21Å; D280-K283 IonicContact OD1-NZ 3.97Å; D280-K283 PolarHBondContact OD1-NZ 2.82Å

Retrieved 283 of 283 residues in 61.9 ms (Link to these results)

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