A0A4W6FX64_LATCA Loading...

Small ribosomal subunit protein uS15

Component of the small ribosomal subunit. The ribosome is a large ribonucleoprotein complex responsible for the synthesis of proteins in the cell.

AlphaFold DB , UniProt , Accession A0A4W6FX64, Species LATCA (Lates calcarifer, Barramundi), Gene RPS13, Length 151 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	56.6	Low	89.2	Confident	234 Å²	234	112.6 Å²	112.6	100%	1.153	64%	0.637	S	S	*	*				0	128.5	0	-76.5	-179.7	-166.3	0	0	108.9
2	G	79.1	Confident	89.5	Confident	58 Å²	58	112.5 Å²	112.5	60%	0.598	65%	0.649	S	S	*	*			trans	-87.7	170.9	177.4	0	0	0	0	0	112.7
3	R	90.5	Very high	89.9	Confident	151 Å²	151	116.2 Å²	116.2	57%	0.57	66%	0.657	S	S	*	*	B	Isolated β-bridge	trans	-73.3	147.7	168.9	-61	-67.6	-179	167.8	-1	109.9	H5 A6 G8	R3-H5 PolarHBondContact O-N 2.75Å; R3-A6 HydrophobicContact CB-CB 3.87Å; R3-A6 WeakPolarHBondContact CB-O 3.43Å; R3-A6 VanDerWaalsContact O-O 3.05Å; R3-G8 WeakPolarHBondContact CG-O 3.3Å; R3-G8 PolarHBondContact N-O 3.44Å
4	M	93.5	Very high	90.2	Very high	119 Å²	119	115.4 Å²	115.4	59%	0.586	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-46.7	-173.1	-178.4	-177.4	-74.4	0	0	114	R121 R124	M4-R121 HydrophobicContact SD-CG 4.13Å; M4-R124 PolarHBondContact SD-NH1 3.23Å
5	H	95	Very high	90.6	Very high	64 Å²	64	114.5 Å²	114.5	30%	0.296	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.7	33	-179.6	-62.7	166.5	0	0	0	111.1	R3 L117	R3-H5 PolarHBondContact O-N 2.75Å; H5-L117 HydrophobicContact CB-CB 4.42Å; H5-L117 HydrophobicContact CB-CD1 4.17Å; H5-L117 HydrophobicContact CB-CD2 4.12Å; H5-L117 HydrophobicContact CB-CG 4.47Å; H5-L117 PolarHBondContact CE1-O 3.45Å; H5-L117 PolarHBondContact ND1-O 3.37Å; H5-L117 VanDerWaalsContact ND1-O 3.1Å
6	A	93.8	Very high	90.9	Very high	51 Å²	51	113.4 Å²	113.4	42%	0.421	66%	0.664	S	S	.	*	B	Isolated β-bridge	trans	-150.7	149.2	176.2	0	0	0	0	0	110.3	R3 G8	R3-A6 HydrophobicContact CB-CB 3.87Å; R3-A6 WeakPolarHBondContact CB-O 3.43Å; R3-A6 VanDerWaalsContact O-O 3.05Å; A6-G8 PolarHBondContact O-N 2.83Å
7	P	94.4	Very high	91.2	Very high	133 Å²	133	111.9 Å²	111.9	86%	0.864	66%	0.659	S	S	*	*	S	Bend	trans	-75	-5.3	-177.6	30.5	-36	0	0	0	113.9
8	G	94.6	Very high	91.5	Very high	36 Å²	36	117.8 Å²	117.8	37%	0.371	67%	0.67	S	S	.	*			trans	-64.4	145.6	-177	0	0	0	0	0	113.8	R3 A6	R3-G8 WeakPolarHBondContact CG-O 3.3Å; R3-G8 PolarHBondContact N-O 3.44Å; A6-G8 PolarHBondContact O-N 2.83Å
9	K	95.1	Very high	91.7	Very high	184 Å²	184	122.4 Å²	122.4	80%	0.8	68%	0.675	S	S	*	*			trans	-118.4	18.3	-179.6	-59.4	-177.3	-178.5	176.8	0	113.7
10	G	94.3	Very high	91.9	Very high	51 Å²	51	125.4 Å²	125.4	53%	0.526	68%	0.676	S	S	.	*			trans	-61.8	135.9	-174.5	0	0	0	0	0	113.7
11	L	94.1	Very high	92	Very high	158 Å²	158	123.7 Å²	123.7	83%	0.827	67%	0.673	S	S	*	*			trans	-111.3	88.8	179.6	-175.1	68.5	0	0	0	109.9
12	S	92.9	Very high	93.8	Very high	111 Å²	111	115.2 Å²	115.2	78%	0.776	64%	0.635	S	S	*	*			trans	-139.1	118	175.3	177.2	0	0	0	0	109
13	Q	94.5	Very high	94.5	Very high	160 Å²	160	115 Å²	115	75%	0.748	62%	0.622	S	S	*	*			trans	-158.8	157.3	-178.9	61.2	-174.6	-22.6	0	0	109.7	A15	Q13-A15 PolarHBondContact O-N 3.08Å
14	S	94.6	Very high	94.7	Very high	106 Å²	106	113.9 Å²	113.9	74%	0.741	63%	0.633	S	S	*	*			trans	-65.8	132.2	174.2	-52.1	0	0	0	0	111
15	A	96.4	Very high	94.8	Very high	101 Å²	101	116 Å²	116	84%	0.835	63%	0.634	S	S	*	*			trans	-97.8	107.8	169.7	0	0	0	0	0	108.9	Q13	Q13-A15 PolarHBondContact O-N 3.08Å
16	L	95.4	Very high	94.8	Very high	97 Å²	97	114 Å²	114	51%	0.508	63%	0.626	S	S	.	*			trans	-68.1	142.9	176.5	-79.7	96.4	0	0	0	110.4	Q62 F65	L16-Q62 HydrophobicContact CD2-CG 4.06Å; L16-F65 HydrophobicContact CD2-CZ 4.32Å
17	P	95.8	Very high	94.8	Very high	89 Å²	89	120 Å²	120	58%	0.578	64%	0.642	S	S	*	*			trans	-64.5	152.4	173.5	28.6	-34.8	0	0	0	110.9
18	Y	96.6	Very high	94.8	Very high	218 Å²	218	116.3 Å²	116.3	86%	0.855	62%	0.615	S	S	*	*	S	Bend	trans	-62.8	-45.2	176.8	178.7	-100.4	0	0	0	111.9	R20	Y18-R20 PolarHBondContact O-N 3.19Å
19	R	95.6	Very high	94.8	Very high	205 Å²	205	118 Å²	118	77%	0.774	62%	0.618	S	S	*	*			trans	-68.6	128.4	179.5	-66.9	-175.2	-180	-177.8	0.6	110.3
20	R	94.8	Very high	94.8	Very high	182 Å²	182	111.2 Å²	111.2	69%	0.687	59%	0.594	S	S	*	*			trans	-107.6	-2.4	-179.2	-56.7	-178.6	-177	163.8	2.3	113.5	Y18 F65	Y18-R20 PolarHBondContact O-N 3.19Å; R20-F65 HydrophobicContact CB-CD1 4.03Å; R20-F65 HydrophobicContact CB-CD2 4.47Å; R20-F65 HydrophobicContact CB-CE1 3.78Å; R20-F65 HydrophobicContact CB-CE2 4.25Å; R20-F65 HydrophobicContact CB-CG 4.4Å; R20-F65 HydrophobicContact CB-CZ 3.92Å; R20-F65 HydrophobicContact CG-CE1 3.81Å; R20-F65 HydrophobicContact CG-CE2 4.34Å; R20-F65 HydrophobicContact CG-CZ 3.7Å; R20-F65 WeakPolarHBondContact O-CB 3.36Å; R20-F65 VanDerWaalsContact O-CG 3.3Å; R20-F65 WeakPolarHBondContact O-CG 3.33Å
21	S	94.2	Very high	94.9	Very high	89 Å²	89	113.2 Å²	113.2	62%	0.622	59%	0.593	S	S	*	*	S	Bend	trans	-70.9	146.7	176.4	55	0	0	0	0	110.7
22	V	94.1	Very high	95	Very high	57 Å²	57	109.2 Å²	109.2	35%	0.345	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-68.3	133.2	173.6	-177	0	0	0	0	109.2	L26 F65 V66	V22-L26 HydrophobicContact CG1-CB 4.07Å; V22-L26 HydrophobicContact CG1-CD2 3.7Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; V22-F65 WeakPolarHBondContact CG2-O 3.13Å; V22-V66 HydrophobicContact CG1-CG2 4.31Å; V22-V66 HydrophobicContact CG2-CB 4.4Å; V22-V66 HydrophobicContact CG2-CG2 4Å
23	P	94.5	Very high	95.1	Very high	52 Å²	52	104 Å²	104	34%	0.338	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-63.7	145.1	175.9	-20.9	32.5	0	0	0	112.5	W25 L26	P23-W25 VanDerWaalsContact C-N 3.25Å; P23-W25 HydrophobicContact CB-CD2 4Å; P23-W25 VanDerWaalsContact CB-CE2 3.4Å; P23-W25 HydrophobicContact CB-CG 4.19Å; P23-W25 HydrophobicContact CB-CZ2 3.79Å; P23-W25 VanDerWaalsContact CB-NE1 3.26Å; P23-W25 HydrophobicContact CG-CZ2 3.79Å; P23-W25 PolarHBondContact O-N 3.31Å; P23-L26 WeakPolarHBondContact O-CB 3.19Å; P23-L26 PolarHBondContact O-N 3.18Å; P23-L26 VanDerWaalsContact O-N 3.09Å
24	T	95	Very high	95.2	Very high	128 Å²	128	99.1 Å²	99.1	79%	0.785	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.6	-175.9	51	0	0	0	0	114.6	L26 K27	T24-L26 VanDerWaalsContact C-N 3.34Å; T24-K27 PolarHBondContact O-NZ 2.97Å
25	W	95.5	Very high	95.3	Very high	165 Å²	165	99.5 Å²	99.5	63%	0.625	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-19	175.7	53.8	-103.8	0	0	0	112.9	P23 K27 G59	P23-W25 VanDerWaalsContact C-N 3.25Å; P23-W25 HydrophobicContact CB-CD2 4Å; P23-W25 VanDerWaalsContact CB-CE2 3.4Å; P23-W25 HydrophobicContact CB-CG 4.19Å; P23-W25 HydrophobicContact CB-CZ2 3.79Å; P23-W25 VanDerWaalsContact CB-NE1 3.26Å; P23-W25 HydrophobicContact CG-CZ2 3.79Å; P23-W25 PolarHBondContact O-N 3.31Å; W25-K27 PolarHBondContact O-N 3.13Å; W25-G59 WeakPolarHBondContact CH2-O 3.42Å
26	L	94.8	Very high	95.3	Very high	21 Å²	21	97.7 Å²	97.7	11%	0.11	48%	0.476	C	S	.	.			trans	-78.9	104.7	176.5	-171.6	70.7	0	0	0	108.9	V22 P23 T24 L28 V60 V66	V22-L26 HydrophobicContact CG1-CB 4.07Å; V22-L26 HydrophobicContact CG1-CD2 3.7Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; P23-L26 WeakPolarHBondContact O-CB 3.19Å; P23-L26 PolarHBondContact O-N 3.18Å; P23-L26 VanDerWaalsContact O-N 3.09Å; T24-L26 VanDerWaalsContact C-N 3.34Å; L26-L28 VanDerWaalsContact C-N 3.35Å; L26-L28 HydrophobicContact CD1-CB 4.39Å; L26-L28 HydrophobicContact CD1-CD1 4.15Å; L26-L28 HydrophobicContact CD1-CG 4.38Å; L26-L28 HydrophobicContact CG-CB 4.35Å; L26-V60 HydrophobicContact CD1-CG2 4.28Å; L26-V60 HydrophobicContact CD2-CG2 4.44Å; L26-V66 HydrophobicContact CD2-CG2 3.79Å
27	K	93.8	Very high	95.3	Very high	176 Å²	176	93.1 Å²	93.1	77%	0.765	45%	0.452	S	S	*	.			trans	-88.6	-0.5	-179.5	-55.8	-52.3	-174.2	-171.2	0	114.3	T24 W25	T24-K27 PolarHBondContact O-NZ 2.97Å; W25-K27 PolarHBondContact O-N 3.13Å
28	L	94.3	Very high	95.3	Very high	57 Å²	57	89.9 Å²	89.9	30%	0.298	43%	0.429	S	S	.	.			trans	-73.3	128.6	178	-67.9	174.1	0	0	0	110.6	L26 D32 V33 H58 V60	L26-L28 VanDerWaalsContact C-N 3.35Å; L26-L28 HydrophobicContact CD1-CB 4.39Å; L26-L28 HydrophobicContact CD1-CD1 4.15Å; L26-L28 HydrophobicContact CD1-CG 4.38Å; L26-L28 HydrophobicContact CG-CB 4.35Å; L28-D32 HydrophobicContact CD2-CB 4.2Å; L28-V33 HydrophobicContact CB-CG2 4.1Å; L28-H58 HydrophobicContact CD1-CB 4.29Å; L28-V60 HydrophobicContact CD1-CG2 3.7Å
29	T	95.3	Very high	95.3	Very high	72 Å²	72	85.2 Å²	85.2	44%	0.442	41%	0.413	S	S	.	.			trans	-79.4	170.3	174.6	71	0	0	0	0	111.2	D31 D32 V33	T29-D31 PolarHBondContact O-N 3.1Å; T29-D32 WeakPolarHBondContact CB-OD2 3.31Å; T29-D32 PolarHBondContact N-OD2 3.06Å; T29-D32 PolarHBondContact OG1-N 3.28Å; T29-D32 PolarHBondContact OG1-OD2 3.1Å; T29-V33 WeakPolarHBondContact O-CG2 3.44Å; T29-V33 PolarHBondContact O-N 3.42Å
30	S	95.2	Very high	95.4	Very high	41 Å²	41	76.1 Å²	76.1	29%	0.287	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-31.7	177.7	89.3	0	0	0	0	112.7	K34	S30-K34 VanDerWaalsContact O-CG 3.32Å; S30-K34 WeakPolarHBondContact O-CG 3.38Å; S30-K34 PolarHBondContact O-N 3.02Å
31	D	95.8	Very high	95.4	Very high	93 Å²	93	68.3 Å²	68.3	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-82.2	-37.4	-175.8	-62.5	-44	0	0	0	111.1	T29 V33 K34 E35	T29-D31 PolarHBondContact O-N 3.1Å; D31-V33 VanDerWaalsContact C-N 3.27Å; D31-V33 PolarHBondContact O-N 3.47Å; D31-K34 WeakPolarHBondContact O-CB 3.17Å; D31-K34 PolarHBondContact O-N 3.15Å; D31-K34 VanDerWaalsContact O-N 3.11Å; D31-K34 IonicContact OD1-NZ 2.75Å; D31-K34 PolarHBondContact OD1-NZ 3.19Å; D31-E35 PolarHBondContact O-N 2.97Å
32	D	95.1	Very high	95.4	Very high	74 Å²	74	71.8 Å²	71.8	40%	0.396	36%	0.358	S	S	.	.	H	α-helix	trans	-57	-43.7	171.1	-57.1	-41.9	0	0	0	111.3	L28 T29 K34 E35 Q36	L28-D32 HydrophobicContact CD2-CB 4.2Å; T29-D32 WeakPolarHBondContact CB-OD2 3.31Å; T29-D32 PolarHBondContact N-OD2 3.06Å; T29-D32 PolarHBondContact OG1-N 3.28Å; T29-D32 PolarHBondContact OG1-OD2 3.1Å; D32-K34 PolarHBondContact O-N 3.4Å; D32-E35 PolarHBondContact O-N 3.32Å; D32-Q36 WeakPolarHBondContact O-CG 3.37Å; D32-Q36 PolarHBondContact O-N 3Å
33	V	96.2	Very high	95.5	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-39.3	178.2	174.9	0	0	0	0	111.3	L28 T29 D31 Q36 I37 L54 V60 V63 V66 T67	L28-V33 HydrophobicContact CB-CG2 4.1Å; T29-V33 WeakPolarHBondContact O-CG2 3.44Å; T29-V33 PolarHBondContact O-N 3.42Å; D31-V33 VanDerWaalsContact C-N 3.27Å; D31-V33 PolarHBondContact O-N 3.47Å; V33-Q36 PolarHBondContact O-N 3.11Å; V33-I37 HydrophobicContact CG1-CD1 3.99Å; V33-I37 WeakPolarHBondContact O-CD1 2.88Å; V33-I37 VanDerWaalsContact O-CG1 3.22Å; V33-I37 WeakPolarHBondContact O-CG1 3.5Å; V33-I37 PolarHBondContact O-N 2.92Å; V33-L54 HydrophobicContact CG1-CD1 4.5Å; V33-V60 HydrophobicContact CG1-CG1 4.46Å; V33-V60 HydrophobicContact CG2-CG2 4.08Å; V33-V63 HydrophobicContact CG1-CG1 4.24Å; V33-V66 HydrophobicContact CG2-CG1 4Å; V33-T67 HydrophobicContact CB-CG2 3.99Å; V33-T67 HydrophobicContact CG1-CG2 3.78Å
34	K	96.4	Very high	95.4	Very high	57 Å²	57	76.4 Å²	76.4	25%	0.248	39%	0.386	C	S	.	.	H	α-helix	trans	-63.8	-43.7	175.3	-70.5	167.5	-162.2	155	0	111.2	S30 D31 D32 Q36 I37 F38 T67 I74	S30-K34 VanDerWaalsContact O-CG 3.32Å; S30-K34 WeakPolarHBondContact O-CG 3.38Å; S30-K34 PolarHBondContact O-N 3.02Å; D31-K34 WeakPolarHBondContact O-CB 3.17Å; D31-K34 PolarHBondContact O-N 3.15Å; D31-K34 VanDerWaalsContact O-N 3.11Å; D31-K34 IonicContact OD1-NZ 2.75Å; D31-K34 PolarHBondContact OD1-NZ 3.19Å; D32-K34 PolarHBondContact O-N 3.4Å; K34-Q36 VanDerWaalsContact C-N 3.35Å; K34-Q36 PolarHBondContact O-N 3.16Å; K34-I37 WeakPolarHBondContact O-CB 3.42Å; K34-I37 PolarHBondContact O-N 3.23Å; K34-I37 VanDerWaalsContact O-N 3.13Å; K34-F38 HydrophobicContact CB-CE2 3.91Å; K34-F38 HydrophobicContact CB-CZ 4.06Å; K34-F38 WeakPolarHBondContact O-CD2 3.49Å; K34-F38 WeakPolarHBondContact O-CG 3.32Å; K34-F38 PolarHBondContact O-N 2.92Å; K34-T67 HydrophobicContact CG-CG2 4.41Å; K34-I74 HydrophobicContact CG-CG2 4.15Å
35	E	96.2	Very high	95.4	Very high	115 Å²	115	72.7 Å²	72.7	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-61.9	-41.8	178	-74.5	-55.4	135.2	0	0	112	D31 D32 I37 F38 K39	D31-E35 PolarHBondContact O-N 2.97Å; D32-E35 PolarHBondContact O-N 3.32Å; E35-I37 VanDerWaalsContact C-N 3.34Å; E35-I37 PolarHBondContact O-N 3.22Å; E35-F38 PolarHBondContact O-N 3.22Å; E35-K39 WeakPolarHBondContact O-CB 3.46Å; E35-K39 PolarHBondContact O-N 3.34Å
36	Q	95.9	Very high	95.4	Very high	63 Å²	63	66.1 Å²	66.1	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-41	173.1	-66.4	-62.8	-11.2	0	0	112.1	D32 V33 K34 F38 K39 L40 L54	D32-Q36 WeakPolarHBondContact O-CG 3.37Å; D32-Q36 PolarHBondContact O-N 3Å; V33-Q36 PolarHBondContact O-N 3.11Å; K34-Q36 VanDerWaalsContact C-N 3.35Å; K34-Q36 PolarHBondContact O-N 3.16Å; Q36-F38 VanDerWaalsContact C-N 3.34Å; Q36-F38 PolarHBondContact O-N 2.91Å; Q36-K39 PolarHBondContact O-N 3.11Å; Q36-L40 WeakPolarHBondContact O-CB 3.45Å; Q36-L40 VanDerWaalsContact O-CG 3.26Å; Q36-L40 WeakPolarHBondContact O-CG 3.47Å; Q36-L40 PolarHBondContact O-N 3.33Å; Q36-L54 HydrophobicContact CB-CD2 4.04Å
37	I	96.8	Very high	95.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-45.9	174.7	-70.4	164.8	0	0	0	110.5	V33 K34 E35 L40 A41 I50 L54 V63 I71 I74 L75	V33-I37 HydrophobicContact CG1-CD1 3.99Å; V33-I37 WeakPolarHBondContact O-CD1 2.88Å; V33-I37 VanDerWaalsContact O-CG1 3.22Å; V33-I37 WeakPolarHBondContact O-CG1 3.5Å; V33-I37 PolarHBondContact O-N 2.92Å; K34-I37 WeakPolarHBondContact O-CB 3.42Å; K34-I37 PolarHBondContact O-N 3.23Å; K34-I37 VanDerWaalsContact O-N 3.13Å; E35-I37 VanDerWaalsContact C-N 3.34Å; E35-I37 PolarHBondContact O-N 3.22Å; I37-L40 PolarHBondContact O-N 3.45Å; I37-A41 VanDerWaalsContact O-CB 3.3Å; I37-A41 WeakPolarHBondContact O-CB 3.3Å; I37-A41 PolarHBondContact O-N 3.08Å; I37-I50 HydrophobicContact CB-CG2 4.46Å; I37-I50 HydrophobicContact CG1-CG2 3.99Å; I37-I50 HydrophobicContact CG2-CG2 4.43Å; I37-L54 HydrophobicContact CD1-CD1 4.19Å; I37-L54 HydrophobicContact CG1-CD1 3.65Å; I37-V63 HydrophobicContact CD1-CG1 3.63Å; I37-I71 HydrophobicContact CD1-CG1 4.47Å; I37-I71 HydrophobicContact CG2-CG2 4.18Å; I37-I74 HydrophobicContact CD1-CD1 3.79Å; I37-I74 HydrophobicContact CD1-CG2 4.44Å; I37-I74 HydrophobicContact CG2-CG2 4.18Å; I37-L75 HydrophobicContact CG2-CD2 3.65Å; I37-L75 HydrophobicContact CG2-CG 4.18Å
38	F	96.5	Very high	95.5	Very high	21 Å²	21	61.1 Å²	61.1	9%	0.092	33%	0.328	C	S	.	.	H	α-helix	trans	-64.7	-42.4	179.3	-57.6	-34.9	0	0	0	111.9	K34 E35 Q36 L40 A41 K42 I74 K78 L80	K34-F38 HydrophobicContact CB-CE2 3.91Å; K34-F38 HydrophobicContact CB-CZ 4.06Å; K34-F38 WeakPolarHBondContact O-CD2 3.49Å; K34-F38 WeakPolarHBondContact O-CG 3.32Å; K34-F38 PolarHBondContact O-N 2.92Å; E35-F38 PolarHBondContact O-N 3.22Å; Q36-F38 VanDerWaalsContact C-N 3.34Å; Q36-F38 PolarHBondContact O-N 2.91Å; F38-L40 PolarHBondContact O-N 3.11Å; F38-A41 PolarHBondContact O-N 3.22Å; F38-K42 WeakPolarHBondContact O-CB 3.49Å; F38-K42 WeakPolarHBondContact O-CG 3.15Å; F38-K42 PolarHBondContact O-N 3.34Å; F38-I74 HydrophobicContact CD1-CG2 4.49Å; F38-I74 HydrophobicContact CE1-CG2 3.57Å; F38-I74 HydrophobicContact CZ-CG2 3.93Å; F38-K78 HydrophobicContact CD1-CB 4.13Å; F38-K78 HydrophobicContact CD1-CG 4.02Å; F38-K78 HydrophobicContact CE1-CB 3.56Å; F38-K78 HydrophobicContact CE1-CG 3.78Å; F38-K78 HydrophobicContact CE2-CD 4.41Å; F38-K78 HydrophobicContact CE2-CG 4.4Å; F38-K78 HydrophobicContact CG-CG 4.44Å; F38-K78 HydrophobicContact CZ-CB 3.99Å; F38-K78 HydrophobicContact CZ-CD 4.23Å; F38-K78 HydrophobicContact CZ-CG 3.99Å; F38-L80 HydrophobicContact CB-CD1 4.16Å; F38-L80 HydrophobicContact CD1-CD1 3.9Å; F38-L80 HydrophobicContact CG-CD1 4.29Å
39	K	96.4	Very high	95.6	Very high	121 Å²	121	62.8 Å²	62.8	53%	0.526	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-45.2	176.9	-174	178.5	-176.4	176.8	0	111.6	E35 Q36 K43	E35-K39 WeakPolarHBondContact O-CB 3.46Å; E35-K39 PolarHBondContact O-N 3.34Å; Q36-K39 PolarHBondContact O-N 3.11Å; K39-K43 WeakPolarHBondContact O-CG 3.43Å; K39-K43 PolarHBondContact O-N 3.22Å
40	L	96.3	Very high	95.7	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-70.1	-37.5	178.9	-66.8	170.5	0	0	0	112	Q36 I37 F38 K43 L45 I50 I53 L54	Q36-L40 WeakPolarHBondContact O-CB 3.45Å; Q36-L40 VanDerWaalsContact O-CG 3.26Å; Q36-L40 WeakPolarHBondContact O-CG 3.47Å; Q36-L40 PolarHBondContact O-N 3.33Å; I37-L40 PolarHBondContact O-N 3.45Å; F38-L40 PolarHBondContact O-N 3.11Å; L40-K43 WeakPolarHBondContact O-CB 3.44Å; L40-K43 PolarHBondContact O-N 2.64Å; L40-L45 HydrophobicContact CB-CD1 4.05Å; L40-L45 HydrophobicContact CD2-CD1 3.72Å; L40-L45 HydrophobicContact CG-CD1 4.45Å; L40-L45 WeakPolarHBondContact O-CB 3.3Å; L40-L45 PolarHBondContact O-N 2.91Å; L40-I50 HydrophobicContact CB-CD1 4.28Å; L40-I50 HydrophobicContact CB-CG1 3.83Å; L40-I50 HydrophobicContact CD1-CG2 4.1Å; L40-I53 HydrophobicContact CD1-CB 4.34Å; L40-I53 HydrophobicContact CD1-CG2 3.99Å; L40-I53 HydrophobicContact CD2-CD1 4.24Å; L40-I53 HydrophobicContact CD2-CG2 4.35Å; L40-L54 HydrophobicContact CD1-CG 4.5Å
41	A	95.6	Very high	95.7	Very high	17 Å²	17	58.5 Å²	58.5	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-39.9	175.6	0	0	0	0	0	112.4	I37 F38 K43 G44 I50 L75	I37-A41 VanDerWaalsContact O-CB 3.3Å; I37-A41 WeakPolarHBondContact O-CB 3.3Å; I37-A41 PolarHBondContact O-N 3.08Å; F38-A41 PolarHBondContact O-N 3.22Å; A41-K43 PolarHBondContact O-N 2.98Å; A41-G44 WeakPolarHBondContact O-CA 3.22Å; A41-G44 PolarHBondContact O-N 3.31Å; A41-I50 HydrophobicContact CB-CD1 4.03Å; A41-L75 HydrophobicContact CB-CD2 3.45Å; A41-L75 VanDerWaalsContact CB-CD2 3.45Å
42	K	94.8	Very high	95.8	Very high	162 Å²	162	57.1 Å²	57.1	70%	0.704	31%	0.305	S	S	*	.	H	α-helix	trans	-62.6	-23.3	173.4	-75	176.9	178.3	-178.8	0	113.2	F38 G44	F38-K42 WeakPolarHBondContact O-CB 3.49Å; F38-K42 WeakPolarHBondContact O-CG 3.15Å; F38-K42 PolarHBondContact O-N 3.34Å; K42-G44 PolarHBondContact O-N 3.27Å
43	K	95.3	Very high	95.9	Very high	143 Å²	143	56.1 Å²	56.1	62%	0.622	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	0.5	170.6	-67	178.4	176.2	-169.9	0	113.4	K39 L40 A41 L45	K39-K43 WeakPolarHBondContact O-CG 3.43Å; K39-K43 PolarHBondContact O-N 3.22Å; L40-K43 WeakPolarHBondContact O-CB 3.44Å; L40-K43 PolarHBondContact O-N 2.64Å; A41-K43 PolarHBondContact O-N 2.98Å; K43-L45 HydrophobicContact CB-CG 4.48Å
44	G	92.8	Very high	95.9	Very high	63 Å²	63	56.1 Å²	56.1	65%	0.649	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	14.6	-179.6	0	0	0	0	0	114.6	A41 K42	A41-G44 WeakPolarHBondContact O-CA 3.22Å; A41-G44 PolarHBondContact O-N 3.31Å; K42-G44 PolarHBondContact O-N 3.27Å
45	L	95.4	Very high	95.9	Very high	50 Å²	50	59.3 Å²	59.3	26%	0.262	31%	0.31	S	S	.	.			trans	-77.9	143.2	179.6	-62.7	175.4	0	0	0	111.8	L40 K43 I50 I53	L40-L45 HydrophobicContact CB-CD1 4.05Å; L40-L45 HydrophobicContact CD2-CD1 3.72Å; L40-L45 HydrophobicContact CG-CD1 4.45Å; L40-L45 WeakPolarHBondContact O-CB 3.3Å; L40-L45 PolarHBondContact O-N 2.91Å; K43-L45 HydrophobicContact CB-CG 4.48Å; L45-I50 HydrophobicContact CB-CG1 3.95Å; L45-I53 HydrophobicContact CD1-CD1 3.57Å
46	T	94.9	Very high	95.9	Very high	28 Å²	28	58.5 Å²	58.5	17%	0.172	31%	0.309	C	S	.	.			trans	-77.7	155.9	-179.3	75	0	0	0	0	111.7	S48 Q49 I50 E86	T46-S48 PolarHBondContact O-N 3.17Å; T46-S48 VanDerWaalsContact O-N 3.11Å; T46-Q49 PolarHBondContact O-N 3.15Å; T46-Q49 PolarHBondContact OG1-N 3.48Å; T46-I50 VanDerWaalsContact O-CG1 3.3Å; T46-I50 WeakPolarHBondContact O-CG1 3.34Å; T46-I50 PolarHBondContact O-N 3.48Å; T46-E86 VanDerWaalsContact CB-CD 3.41Å; T46-E86 WeakPolarHBondContact CB-OE1 3.26Å; T46-E86 HydrophobicContact CG2-CG 4.31Å; T46-E86 PolarHBondContact OG1-OE1 3.45Å
47	P	95.7	Very high	95.9	Very high	20 Å²	20	59.9 Å²	59.9	13%	0.13	33%	0.326	C	S	.	.	H	α-helix	trans	-51.9	-36.6	177	-28	35	0	0	0	113.8	G51 I71 L72 L75 E86	P47-G51 PolarHBondContact O-N 3.46Å; P47-G51 VanDerWaalsContact O-N 3.1Å; P47-I71 HydrophobicContact CB-CB 4.45Å; P47-I71 HydrophobicContact CB-CG2 3.89Å; P47-I71 WeakPolarHBondContact O-CD1 3.38Å; P47-L72 HydrophobicContact CG-CD1 4.23Å; P47-L75 HydrophobicContact CG-CD1 3.98Å; P47-E86 WeakPolarHBondContact CD-OE2 3.4Å
48	S	95.4	Very high	95.8	Very high	72 Å²	72	63 Å²	63	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-46	176.6	-56	0	0	0	0	112.1	T46 G51 V52 E86	T46-S48 PolarHBondContact O-N 3.17Å; T46-S48 VanDerWaalsContact O-N 3.11Å; S48-G51 PolarHBondContact O-N 3.29Å; S48-V52 WeakPolarHBondContact O-CG2 3.19Å; S48-V52 PolarHBondContact O-N 3.44Å; S48-E86 WeakPolarHBondContact CB-OE1 3.45Å; S48-E86 PolarHBondContact N-OE2 2.9Å; S48-E86 PolarHBondContact OG-OE1 3.13Å; S48-E86 PolarHBondContact OG-OE2 2.8Å
49	Q	95.6	Very high	95.6	Very high	92 Å²	92	63.2 Å²	63.2	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-66.5	-40.5	177.1	-68.6	174.9	-38.1	0	0	112.3	T46 G51 V52 I53	T46-Q49 PolarHBondContact O-N 3.15Å; T46-Q49 PolarHBondContact OG1-N 3.48Å; Q49-G51 VanDerWaalsContact C-N 3.3Å; Q49-G51 PolarHBondContact O-N 2.89Å; Q49-V52 WeakPolarHBondContact O-CB 3.42Å; Q49-V52 PolarHBondContact O-N 3.14Å; Q49-V52 VanDerWaalsContact O-N 3.12Å; Q49-I53 WeakPolarHBondContact O-CG1 3.19Å; Q49-I53 PolarHBondContact O-N 2.91Å
50	I	96.9	Very high	95.6	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.8	-46.7	175.6	-67.6	171.1	0	0	0	110.2	I37 L40 A41 L45 T46 V52 I53 L54 I71 L75	I37-I50 HydrophobicContact CB-CG2 4.46Å; I37-I50 HydrophobicContact CG1-CG2 3.99Å; I37-I50 HydrophobicContact CG2-CG2 4.43Å; L40-I50 HydrophobicContact CB-CD1 4.28Å; L40-I50 HydrophobicContact CB-CG1 3.83Å; L40-I50 HydrophobicContact CD1-CG2 4.1Å; A41-I50 HydrophobicContact CB-CD1 4.03Å; L45-I50 HydrophobicContact CB-CG1 3.95Å; T46-I50 VanDerWaalsContact O-CG1 3.3Å; T46-I50 WeakPolarHBondContact O-CG1 3.34Å; T46-I50 PolarHBondContact O-N 3.48Å; I50-V52 VanDerWaalsContact C-N 3.3Å; I50-V52 PolarHBondContact O-N 2.91Å; I50-I53 PolarHBondContact O-N 3.46Å; I50-L54 HydrophobicContact CG2-CD1 3.84Å; I50-L54 HydrophobicContact CG2-CG 4.36Å; I50-L54 WeakPolarHBondContact O-CB 3.37Å; I50-L54 VanDerWaalsContact O-CG 3.3Å; I50-L54 WeakPolarHBondContact O-CG 3.48Å; I50-L54 PolarHBondContact O-N 3.28Å; I50-I71 HydrophobicContact CG2-CD1 4.32Å; I50-I71 HydrophobicContact CG2-CG2 4.31Å; I50-L75 HydrophobicContact CD1-CD1 4.48Å
51	G	96.3	Very high	95.4	Very high	23 Å²	23	60 Å²	60	24%	0.237	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-37.8	177.2	0	0	0	0	0	113.2	P47 S48 Q49 R55	P47-G51 PolarHBondContact O-N 3.46Å; P47-G51 VanDerWaalsContact O-N 3.1Å; S48-G51 PolarHBondContact O-N 3.29Å; Q49-G51 VanDerWaalsContact C-N 3.3Å; Q49-G51 PolarHBondContact O-N 2.89Å; G51-R55 WeakPolarHBondContact O-CB 3.42Å; G51-R55 PolarHBondContact O-N 2.91Å; G51-R55 VanDerWaalsContact O-N 3.09Å
52	V	97.3	Very high	95.5	Very high	64 Å²	64	62.8 Å²	62.8	39%	0.388	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-48	176.4	172	0	0	0	0	111.1	S48 Q49 I50 L54 R55 D56	S48-V52 WeakPolarHBondContact O-CG2 3.19Å; S48-V52 PolarHBondContact O-N 3.44Å; Q49-V52 WeakPolarHBondContact O-CB 3.42Å; Q49-V52 PolarHBondContact O-N 3.14Å; Q49-V52 VanDerWaalsContact O-N 3.12Å; I50-V52 VanDerWaalsContact C-N 3.3Å; I50-V52 PolarHBondContact O-N 2.91Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.09Å; V52-R55 PolarHBondContact O-N 3.47Å; V52-D56 VanDerWaalsContact CG1-OD2 3.26Å; V52-D56 WeakPolarHBondContact CG1-OD2 3.41Å; V52-D56 WeakPolarHBondContact O-CB 3.27Å; V52-D56 PolarHBondContact O-N 3.22Å
53	I	97.4	Very high	95.5	Very high	52 Å²	52	55.5 Å²	55.5	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-40.4	179.7	-67.6	168.4	0	0	0	111.8	L40 L45 Q49 I50 R55 S57 H58	L40-I53 HydrophobicContact CD1-CB 4.34Å; L40-I53 HydrophobicContact CD1-CG2 3.99Å; L40-I53 HydrophobicContact CD2-CD1 4.24Å; L40-I53 HydrophobicContact CD2-CG2 4.35Å; L45-I53 HydrophobicContact CD1-CD1 3.57Å; Q49-I53 WeakPolarHBondContact O-CG1 3.19Å; Q49-I53 PolarHBondContact O-N 2.91Å; I50-I53 PolarHBondContact O-N 3.46Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 2.97Å; I53-S57 WeakPolarHBondContact O-CB 3.23Å; I53-S57 PolarHBondContact O-N 2.91Å; I53-H58 PolarHBondContact O-ND1 2.73Å
54	L	96.4	Very high	95.6	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-37.5	176.8	-73.3	175.4	0	0	0	111.7	V33 Q36 I37 L40 I50 V52 H58 G59 V60 V63	V33-L54 HydrophobicContact CG1-CD1 4.5Å; Q36-L54 HydrophobicContact CB-CD2 4.04Å; I37-L54 HydrophobicContact CD1-CD1 4.19Å; I37-L54 HydrophobicContact CG1-CD1 3.65Å; L40-L54 HydrophobicContact CD1-CG 4.5Å; I50-L54 HydrophobicContact CG2-CD1 3.84Å; I50-L54 HydrophobicContact CG2-CG 4.36Å; I50-L54 WeakPolarHBondContact O-CB 3.37Å; I50-L54 VanDerWaalsContact O-CG 3.3Å; I50-L54 WeakPolarHBondContact O-CG 3.48Å; I50-L54 PolarHBondContact O-N 3.28Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.09Å; L54-H58 HydrophobicContact CD2-CB 4.49Å; L54-H58 CarbonylContact O-C 3.57Å; L54-H58 WeakPolarHBondContact O-CB 3.24Å; L54-H58 PolarHBondContact O-N 3.25Å; L54-G59 PolarHBondContact O-N 2.86Å; L54-V60 HydrophobicContact CB-CB 4.16Å; L54-V60 PolarHBondContact O-N 2.66Å; L54-V63 HydrophobicContact CD1-CG2 3.61Å
55	R	96.7	Very high	95.7	Very high	124 Å²	124	52.8 Å²	52.8	47%	0.468	29%	0.293	S	S	.	.	H	α-helix	trans	-69.9	-50.7	176.2	-175.4	-167.6	68.1	-161.1	-5.7	111.7	G51 V52 I53 G59 V60	G51-R55 WeakPolarHBondContact O-CB 3.42Å; G51-R55 PolarHBondContact O-N 2.91Å; G51-R55 VanDerWaalsContact O-N 3.09Å; V52-R55 PolarHBondContact O-N 3.47Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 2.97Å; R55-G59 PolarHBondContact O-N 2.96Å; R55-V60 WeakPolarHBondContact CA-O 3Å
56	D	96.5	Very high	95.7	Very high	98 Å²	98	51.6 Å²	51.6	52%	0.524	29%	0.288	S	S	.	.	H	α-helix	trans	-81.3	-36.3	-166.9	-65.1	-11.1	0	0	0	112.4	V52	V52-D56 VanDerWaalsContact CG1-OD2 3.26Å; V52-D56 WeakPolarHBondContact CG1-OD2 3.41Å; V52-D56 WeakPolarHBondContact O-CB 3.27Å; V52-D56 PolarHBondContact O-N 3.22Å
57	S	94.6	Very high	95.7	Very high	92 Å²	92	51.2 Å²	51.2	64%	0.643	29%	0.285	S	S	*	.	H	α-helix	trans	-104.6	-24.7	-176	-50.3	0	0	0	0	114.2	I53	I53-S57 WeakPolarHBondContact O-CB 3.23Å; I53-S57 PolarHBondContact O-N 2.91Å
58	H	94.1	Very high	95.6	Very high	64 Å²	64	52.9 Å²	52.9	30%	0.296	31%	0.307	S	S	.	.	H	α-helix	trans	-114.2	-1.5	-174.4	-57	76.6	0	0	0	113.5	L28 I53 L54 V60	L28-H58 HydrophobicContact CD1-CB 4.29Å; I53-H58 PolarHBondContact O-ND1 2.73Å; L54-H58 HydrophobicContact CD2-CB 4.49Å; L54-H58 CarbonylContact O-C 3.57Å; L54-H58 WeakPolarHBondContact O-CB 3.24Å; L54-H58 PolarHBondContact O-N 3.25Å; H58-V60 HydrophobicContact CB-CG2 4.23Å; H58-V60 PolarHBondContact O-N 3.19Å
59	G	94	Very high	95.6	Very high	27 Å²	27	52.9 Å²	52.9	28%	0.278	30%	0.301	S	S	.	.			trans	69.3	10.4	-179.6	0	0	0	0	0	114.8	W25 L54 R55 A61	W25-G59 WeakPolarHBondContact CH2-O 3.42Å; L54-G59 PolarHBondContact O-N 2.86Å; R55-G59 PolarHBondContact O-N 2.96Å; G59-A61 PolarHBondContact O-N 3.42Å; G59-A61 VanDerWaalsContact O-N 3.1Å
60	V	95	Very high	95.7	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.012	31%	0.308	C	S	.	.			trans	-83.4	89.3	179.5	-178.4	0	0	0	0	109.2	L26 L28 V33 L54 R55 H58 Q62 V63 V66	L26-V60 HydrophobicContact CD1-CG2 4.28Å; L26-V60 HydrophobicContact CD2-CG2 4.44Å; L28-V60 HydrophobicContact CD1-CG2 3.7Å; V33-V60 HydrophobicContact CG1-CG1 4.46Å; V33-V60 HydrophobicContact CG2-CG2 4.08Å; L54-V60 HydrophobicContact CB-CB 4.16Å; L54-V60 PolarHBondContact O-N 2.66Å; R55-V60 WeakPolarHBondContact CA-O 3Å; H58-V60 HydrophobicContact CB-CG2 4.23Å; H58-V60 PolarHBondContact O-N 3.19Å; V60-Q62 PolarHBondContact O-N 2.9Å; V60-V63 HydrophobicContact CG1-CG2 4.18Å; V60-V66 HydrophobicContact CG1-CG2 4.08Å
61	A	93.8	Very high	95.6	Very high	65 Å²	65	56 Å²	56	54%	0.537	31%	0.314	S	S	.	.	S	Bend	trans	-60.8	-40.9	-176	0	0	0	0	0	113.9	G59	G59-A61 PolarHBondContact O-N 3.42Å; G59-A61 VanDerWaalsContact O-N 3.1Å
62	Q	96.1	Very high	95.6	Very high	75 Å²	75	58.7 Å²	58.7	35%	0.35	32%	0.323	S	S	.	.			trans	-143.8	108	179.3	-75.6	-63.5	-57.7	0	0	110.7	L16 V60 R64 F65	L16-Q62 HydrophobicContact CD2-CG 4.06Å; V60-Q62 PolarHBondContact O-N 2.9Å; Q62-R64 PolarHBondContact O-N 3.01Å; Q62-R64 VanDerWaalsContact O-N 3.14Å; Q62-F65 HydrophobicContact CB-CB 4.3Å; Q62-F65 HydrophobicContact CB-CD2 3.41Å; Q62-F65 VanDerWaalsContact CB-CD2 3.41Å; Q62-F65 HydrophobicContact CB-CE2 3.76Å; Q62-F65 HydrophobicContact CB-CG 3.84Å; Q62-F65 HydrophobicContact CB-CZ 4.46Å; Q62-F65 HydrophobicContact CG-CD2 3.88Å; Q62-F65 HydrophobicContact CG-CE2 3.68Å; Q62-F65 HydrophobicContact CG-CZ 4.32Å; Q62-F65 PolarHBondContact O-N 2.89Å
63	V	96.2	Very high	95.5	Very high	10 Å²	10	63.3 Å²	63.3	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-54	-36.5	177.5	176	0	0	0	0	112.2	V33 I37 L54 V60 F65 V66 T67 I71 I74	V33-V63 HydrophobicContact CG1-CG1 4.24Å; I37-V63 HydrophobicContact CD1-CG1 3.63Å; L54-V63 HydrophobicContact CD1-CG2 3.61Å; V60-V63 HydrophobicContact CG1-CG2 4.18Å; V63-F65 VanDerWaalsContact C-N 3.27Å; V63-F65 PolarHBondContact O-N 3.45Å; V63-V66 PolarHBondContact O-N 3.5Å; V63-T67 HydrophobicContact CG1-CG2 4.12Å; V63-T67 PolarHBondContact O-N 3.13Å; V63-T67 PolarHBondContact O-OG1 3.46Å; V63-I71 HydrophobicContact CB-CG1 4.08Å; V63-I71 HydrophobicContact CG1-CG1 4.02Å; V63-I71 HydrophobicContact CG2-CD1 4.05Å; V63-I71 HydrophobicContact CG2-CG1 3.97Å; V63-I74 HydrophobicContact CG1-CD1 3.88Å
64	R	96.7	Very high	95.5	Very high	102 Å²	102	61.3 Å²	61.3	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-34.7	179	-178.7	177.8	62.7	167.2	-3.8	113	Q62 G68 N69	Q62-R64 PolarHBondContact O-N 3.01Å; Q62-R64 VanDerWaalsContact O-N 3.14Å; R64-G68 CarbonylContact O-C 3.37Å; R64-G68 WeakPolarHBondContact O-CA 3.48Å; R64-G68 PolarHBondContact O-N 3.46Å; R64-N69 WeakPolarHBondContact CA-O 3.44Å
65	F	95.1	Very high	95.4	Very high	47 Å²	47	61.4 Å²	61.4	21%	0.206	32%	0.323	C	S	.	.	H	α-helix	trans	-77.4	-30.5	-177.9	-61.4	-21.2	0	0	0	111.9	L16 R20 V22 Q62 V63	L16-F65 HydrophobicContact CD2-CZ 4.32Å; R20-F65 HydrophobicContact CB-CD1 4.03Å; R20-F65 HydrophobicContact CB-CD2 4.47Å; R20-F65 HydrophobicContact CB-CE1 3.78Å; R20-F65 HydrophobicContact CB-CE2 4.25Å; R20-F65 HydrophobicContact CB-CG 4.4Å; R20-F65 HydrophobicContact CB-CZ 3.92Å; R20-F65 HydrophobicContact CG-CE1 3.81Å; R20-F65 HydrophobicContact CG-CE2 4.34Å; R20-F65 HydrophobicContact CG-CZ 3.7Å; R20-F65 WeakPolarHBondContact O-CB 3.36Å; R20-F65 VanDerWaalsContact O-CG 3.3Å; R20-F65 WeakPolarHBondContact O-CG 3.33Å; V22-F65 WeakPolarHBondContact CG2-O 3.13Å; Q62-F65 HydrophobicContact CB-CB 4.3Å; Q62-F65 HydrophobicContact CB-CD2 3.41Å; Q62-F65 VanDerWaalsContact CB-CD2 3.41Å; Q62-F65 HydrophobicContact CB-CE2 3.76Å; Q62-F65 HydrophobicContact CB-CG 3.84Å; Q62-F65 HydrophobicContact CB-CZ 4.46Å; Q62-F65 HydrophobicContact CG-CD2 3.88Å; Q62-F65 HydrophobicContact CG-CE2 3.68Å; Q62-F65 HydrophobicContact CG-CZ 4.32Å; Q62-F65 PolarHBondContact O-N 2.89Å; V63-F65 VanDerWaalsContact C-N 3.27Å; V63-F65 PolarHBondContact O-N 3.45Å
66	V	94.7	Very high	95.3	Very high	25 Å²	25	61 Å²	61	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-81.5	-42.5	177.6	-172.3	0	0	0	0	111.9	V22 L26 V33 V60 V63	V22-V66 HydrophobicContact CG1-CG2 4.31Å; V22-V66 HydrophobicContact CG2-CB 4.4Å; V22-V66 HydrophobicContact CG2-CG2 4Å; L26-V66 HydrophobicContact CD2-CG2 3.79Å; V33-V66 HydrophobicContact CG2-CG1 4Å; V60-V66 HydrophobicContact CG1-CG2 4.08Å; V63-V66 PolarHBondContact O-N 3.5Å
67	T	94.5	Very high	95.2	Very high	19 Å²	19	61.7 Å²	61.7	12%	0.117	34%	0.338	C	S	.	.	H	α-helix	trans	-105.3	-7.9	-169.9	65.4	0	0	0	0	114.6	V33 K34 V63 N69 I74	V33-T67 HydrophobicContact CB-CG2 3.99Å; V33-T67 HydrophobicContact CG1-CG2 3.78Å; K34-T67 HydrophobicContact CG-CG2 4.41Å; V63-T67 HydrophobicContact CG1-CG2 4.12Å; V63-T67 PolarHBondContact O-N 3.13Å; V63-T67 PolarHBondContact O-OG1 3.46Å; T67-N69 PolarHBondContact O-N 3Å; T67-N69 VanDerWaalsContact O-N 3.15Å; T67-N69 PolarHBondContact OG1-N 3.34Å; T67-N69 PolarHBondContact OG1-O 2.93Å; T67-N69 VanDerWaalsContact OG1-O 3.1Å; T67-I74 HydrophobicContact CG2-CD1 4.3Å
68	G	94.6	Very high	95.2	Very high	56 Å²	56	63.4 Å²	63.4	58%	0.577	33%	0.333	S	S	*	.	S	Bend	trans	76.5	-16.7	-173.5	0	0	0	0	0	115	R64	R64-G68 CarbonylContact O-C 3.37Å; R64-G68 WeakPolarHBondContact O-CA 3.48Å; R64-G68 PolarHBondContact O-N 3.46Å
69	N	95.5	Very high	95.1	Very high	72 Å²	72	63.6 Å²	63.6	39%	0.385	35%	0.353	S	S	.	.	S	Bend	trans	-124.6	161.5	-176.2	-81.8	-53.2	0	0	0	113	R64 T67 R73 I74	R64-N69 WeakPolarHBondContact CA-O 3.44Å; T67-N69 PolarHBondContact O-N 3Å; T67-N69 VanDerWaalsContact O-N 3.15Å; T67-N69 PolarHBondContact OG1-N 3.34Å; T67-N69 PolarHBondContact OG1-O 2.93Å; T67-N69 VanDerWaalsContact OG1-O 3.1Å; N69-R73 HydrophobicContact CB-CB 4.42Å; N69-I74 HydrophobicContact CB-CG1 4.09Å
70	K	96.6	Very high	95.1	Very high	131 Å²	131	65.2 Å²	65.2	57%	0.57	35%	0.354	S	S	*	.			trans	-82.5	153.9	174.9	-63.8	-175.4	-179.5	-176.8	0	110.6	L72 R73 I74	K70-L72 VanDerWaalsContact C-N 3.32Å; K70-L72 PolarHBondContact O-N 3.37Å; K70-R73 WeakPolarHBondContact O-CB 3.3Å; K70-R73 PolarHBondContact O-N 3.36Å; K70-I74 PolarHBondContact O-N 3.22Å; K70-I74 VanDerWaalsContact O-N 3.1Å
71	I	96.1	Very high	94.9	Very high	25 Å²	25	66.4 Å²	66.4	13%	0.128	36%	0.364	C	S	.	.	H	α-helix	trans	-48.5	-50.3	180	-60.5	172.2	0	0	0	111.8	I37 P47 I50 V63 R73 I74 L75	I37-I71 HydrophobicContact CD1-CG1 4.47Å; I37-I71 HydrophobicContact CG2-CG2 4.18Å; P47-I71 HydrophobicContact CB-CB 4.45Å; P47-I71 HydrophobicContact CB-CG2 3.89Å; P47-I71 WeakPolarHBondContact O-CD1 3.38Å; I50-I71 HydrophobicContact CG2-CD1 4.32Å; I50-I71 HydrophobicContact CG2-CG2 4.31Å; V63-I71 HydrophobicContact CB-CG1 4.08Å; V63-I71 HydrophobicContact CG1-CG1 4.02Å; V63-I71 HydrophobicContact CG2-CD1 4.05Å; V63-I71 HydrophobicContact CG2-CG1 3.97Å; I71-R73 VanDerWaalsContact C-N 3.27Å; I71-R73 PolarHBondContact O-N 3.25Å; I71-I74 WeakPolarHBondContact O-CB 3.3Å; I71-I74 PolarHBondContact O-N 3.34Å; I71-I74 VanDerWaalsContact O-N 3.11Å; I71-L75 HydrophobicContact CG2-CD1 4.06Å; I71-L75 HydrophobicContact CG2-CG 4.35Å; I71-L75 WeakPolarHBondContact O-CG 3.43Å; I71-L75 PolarHBondContact O-N 3.5Å
72	L	95.6	Very high	94.7	Very high	81 Å²	81	66.6 Å²	66.6	42%	0.424	36%	0.361	S	S	.	.	H	α-helix	trans	-60.9	-33.5	-179.3	-170.8	67.7	0	0	0	113.1	P47 K70 K76	P47-L72 HydrophobicContact CG-CD1 4.23Å; K70-L72 VanDerWaalsContact C-N 3.32Å; K70-L72 PolarHBondContact O-N 3.37Å; L72-K76 VanDerWaalsContact O-CG 3.31Å; L72-K76 WeakPolarHBondContact O-CG 3.38Å; L72-K76 PolarHBondContact O-N 2.89Å
73	R	95.7	Very high	94.3	Very high	160 Å²	160	70.6 Å²	70.6	60%	0.604	38%	0.384	S	S	*	.	H	α-helix	trans	-70	-43.6	175.4	-73.3	-170.1	178.7	175.8	-3.9	111.1	N69 K70 I71 L75 K76 S77	N69-R73 HydrophobicContact CB-CB 4.42Å; K70-R73 WeakPolarHBondContact O-CB 3.3Å; K70-R73 PolarHBondContact O-N 3.36Å; I71-R73 VanDerWaalsContact C-N 3.27Å; I71-R73 PolarHBondContact O-N 3.25Å; R73-L75 VanDerWaalsContact C-N 3.28Å; R73-L75 PolarHBondContact O-N 3.47Å; R73-K76 PolarHBondContact O-N 2.97Å; R73-S77 PolarHBondContact O-N 3.27Å; R73-S77 PolarHBondContact O-OG 3.47Å
74	I	96.1	Very high	94.1	Very high	11 Å²	11	71.3 Å²	71.3	6%	0.056	39%	0.387	C	S	.	.	H	α-helix	trans	-57.9	-44.2	177.2	-64.5	167.1	0	0	0	110.3	K34 I37 F38 V63 T67 N69 K70 I71 S77 K78	K34-I74 HydrophobicContact CG-CG2 4.15Å; I37-I74 HydrophobicContact CD1-CD1 3.79Å; I37-I74 HydrophobicContact CD1-CG2 4.44Å; I37-I74 HydrophobicContact CG2-CG2 4.18Å; F38-I74 HydrophobicContact CD1-CG2 4.49Å; F38-I74 HydrophobicContact CE1-CG2 3.57Å; F38-I74 HydrophobicContact CZ-CG2 3.93Å; V63-I74 HydrophobicContact CG1-CD1 3.88Å; T67-I74 HydrophobicContact CG2-CD1 4.3Å; N69-I74 HydrophobicContact CB-CG1 4.09Å; K70-I74 PolarHBondContact O-N 3.22Å; K70-I74 VanDerWaalsContact O-N 3.1Å; I71-I74 WeakPolarHBondContact O-CB 3.3Å; I71-I74 PolarHBondContact O-N 3.34Å; I71-I74 VanDerWaalsContact O-N 3.11Å; I74-S77 PolarHBondContact O-N 2.93Å; I74-K78 PolarHBondContact O-N 3.38Å
75	L	95.9	Very high	94	Very high	3 Å²	3	67.3 Å²	67.3	2%	0.016	38%	0.375	C	S	.	.	H	α-helix	trans	-65.2	-42.3	176.5	-65.1	177.6	0	0	0	112.7	I37 A41 P47 I50 I71 R73 K78 G79 L80 A81	I37-L75 HydrophobicContact CG2-CD2 3.65Å; I37-L75 HydrophobicContact CG2-CG 4.18Å; A41-L75 HydrophobicContact CB-CD2 3.45Å; A41-L75 VanDerWaalsContact CB-CD2 3.45Å; P47-L75 HydrophobicContact CG-CD1 3.98Å; I50-L75 HydrophobicContact CD1-CD1 4.48Å; I71-L75 HydrophobicContact CG2-CD1 4.06Å; I71-L75 HydrophobicContact CG2-CG 4.35Å; I71-L75 WeakPolarHBondContact O-CG 3.43Å; I71-L75 PolarHBondContact O-N 3.5Å; R73-L75 VanDerWaalsContact C-N 3.28Å; R73-L75 PolarHBondContact O-N 3.47Å; L75-K78 PolarHBondContact O-N 3.38Å; L75-G79 PolarHBondContact O-N 3.06Å; L75-G79 VanDerWaalsContact O-N 3.11Å; L75-L80 HydrophobicContact CD2-CB 4.21Å; L75-L80 PolarHBondContact O-N 3.39Å; L75-A81 HydrophobicContact CB-CB 4.32Å
76	K	94.8	Very high	94	Very high	117 Å²	117	67 Å²	67	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-61.9	-43.1	176.3	-77.3	-178	178.7	-160.9	0	112.3	L72 R73 K78 G79 A81	L72-K76 VanDerWaalsContact O-CG 3.31Å; L72-K76 WeakPolarHBondContact O-CG 3.38Å; L72-K76 PolarHBondContact O-N 2.89Å; R73-K76 PolarHBondContact O-N 2.97Å; K76-K78 PolarHBondContact O-N 2.82Å; K76-G79 PolarHBondContact O-N 2.79Å; K76-G79 VanDerWaalsContact O-N 3.08Å; K76-A81 HydrophobicContact CB-CB 4.37Å; K76-A81 HydrophobicContact CG-CB 3.52Å
77	S	93.9	Very high	94.1	Very high	112 Å²	112	68.9 Å²	68.9	78%	0.783	38%	0.383	S	S	*	.	H	α-helix	trans	-61.3	-26.7	177.9	-64.7	0	0	0	0	113.1	R73 I74	R73-S77 PolarHBondContact O-N 3.27Å; R73-S77 PolarHBondContact O-OG 3.47Å; I74-S77 PolarHBondContact O-N 2.93Å
78	K	93.4	Very high	94.1	Very high	128 Å²	128	68 Å²	68	56%	0.557	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-2	177.3	-161.6	62.2	176.1	-174.8	0	113.5	F38 I74 L75 K76 L80	F38-K78 HydrophobicContact CD1-CB 4.13Å; F38-K78 HydrophobicContact CD1-CG 4.02Å; F38-K78 HydrophobicContact CE1-CB 3.56Å; F38-K78 HydrophobicContact CE1-CG 3.78Å; F38-K78 HydrophobicContact CE2-CD 4.41Å; F38-K78 HydrophobicContact CE2-CG 4.4Å; F38-K78 HydrophobicContact CG-CG 4.44Å; F38-K78 HydrophobicContact CZ-CB 3.99Å; F38-K78 HydrophobicContact CZ-CD 4.23Å; F38-K78 HydrophobicContact CZ-CG 3.99Å; I74-K78 PolarHBondContact O-N 3.38Å; L75-K78 PolarHBondContact O-N 3.38Å; K76-K78 PolarHBondContact O-N 2.82Å; K78-L80 VanDerWaalsContact C-N 3.3Å; K78-L80 HydrophobicContact CB-CD1 4.19Å; K78-L80 HydrophobicContact CB-CG 4.3Å; K78-L80 HydrophobicContact CG-CD1 3.78Å; K78-L80 HydrophobicContact CG-CG 4.14Å; K78-L80 PolarHBondContact O-N 3.1Å
79	G	93.2	Very high	94.1	Very high	68 Å²	68	68 Å²	68	70%	0.701	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	20.7	-175.4	0	0	0	0	0	114.5	L75 K76	L75-G79 PolarHBondContact O-N 3.06Å; L75-G79 VanDerWaalsContact O-N 3.11Å; K76-G79 PolarHBondContact O-N 2.79Å; K76-G79 VanDerWaalsContact O-N 3.08Å
80	L	92.8	Very high	94.2	Very high	60 Å²	60	68.4 Å²	68.4	31%	0.314	36%	0.36	S	S	.	.			trans	-105.6	14.8	-179	-63.3	172.4	0	0	0	112.5	F38 L75 K78	F38-L80 HydrophobicContact CB-CD1 4.16Å; F38-L80 HydrophobicContact CD1-CD1 3.9Å; F38-L80 HydrophobicContact CG-CD1 4.29Å; L75-L80 HydrophobicContact CD2-CB 4.21Å; L75-L80 PolarHBondContact O-N 3.39Å; K78-L80 VanDerWaalsContact C-N 3.3Å; K78-L80 HydrophobicContact CB-CD1 4.19Å; K78-L80 HydrophobicContact CB-CG 4.3Å; K78-L80 HydrophobicContact CG-CD1 3.78Å; K78-L80 HydrophobicContact CG-CG 4.14Å; K78-L80 PolarHBondContact O-N 3.1Å
81	A	91.1	Very high	94.2	Very high	27 Å²	27	63 Å²	63	22%	0.223	34%	0.338	C	S	.	.			trans	-78.6	143.5	179.6	0	0	0	0	0	110.5	L75 K76	L75-A81 HydrophobicContact CB-CB 4.32Å; K76-A81 HydrophobicContact CB-CB 4.37Å; K76-A81 HydrophobicContact CG-CB 3.52Å
82	P	90.1	Very high	94.2	Very high	70 Å²	70	61.9 Å²	61.9	46%	0.455	33%	0.331	S	S	.	.			trans	-67.1	146.1	174.2	29.1	-34.6	0	0	0	110.9
83	D	88.5	Confident	94.2	Very high	158 Å²	158	62.9 Å²	62.9	85%	0.845	33%	0.333	S	S	*	.	S	Bend	trans	-64.4	-41.6	178.4	-61.8	-37	0	0	0	111.8
84	L	91.5	Very high	94.2	Very high	25 Å²	25	60.6 Å²	60.6	13%	0.131	33%	0.327	C	S	.	.	S	Bend	trans	-94.5	135.9	175	-75.8	176.6	0	0	0	111.1	E86 L88 L135 W139 L149	L84-E86 PolarHBondContact O-N 3.27Å; L84-L88 HydrophobicContact CD2-CD2 4.42Å; L84-L135 HydrophobicContact CD2-CD2 3.9Å; L84-W139 HydrophobicContact CD2-CZ2 4.1Å; L84-L149 HydrophobicContact CD1-CB 4.33Å
85	P	95.1	Very high	94.2	Very high	18 Å²	18	60 Å²	60	12%	0.117	32%	0.324	C	S	.	.			trans	-55.6	136.8	169	-26	35.6	0	0	0	112.1	D87 L88 Y89 Y129 V134	P85-D87 VanDerWaalsContact C-N 3.3Å; P85-D87 VanDerWaalsContact CB-OD1 3.24Å; P85-D87 WeakPolarHBondContact CB-OD1 3.45Å; P85-D87 PolarHBondContact O-N 3.27Å; P85-L88 HydrophobicContact CB-CB 4.29Å; P85-L88 PolarHBondContact O-N 2.67Å; P85-L88 VanDerWaalsContact O-N 3.13Å; P85-Y89 PolarHBondContact O-N 3.33Å; P85-Y129 HydrophobicContact CB-CD2 4.23Å; P85-Y129 HydrophobicContact CB-CE1 4.07Å; P85-Y129 HydrophobicContact CB-CE2 3.65Å; P85-Y129 HydrophobicContact CG-CD1 3.99Å; P85-Y129 HydrophobicContact CG-CD2 3.92Å; P85-Y129 HydrophobicContact CG-CE1 3.92Å; P85-Y129 HydrophobicContact CG-CE2 3.85Å; P85-Y129 HydrophobicContact CG-CG 4Å; P85-V134 HydrophobicContact CG-CG1 3.9Å
86	E	95	Very high	94.3	Very high	42 Å²	42	61.9 Å²	61.9	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-41.9	-174.2	-178.3	-176.5	177.6	0	0	112.9	T46 P47 S48 L84 Y89 H90	T46-E86 VanDerWaalsContact CB-CD 3.41Å; T46-E86 WeakPolarHBondContact CB-OE1 3.26Å; T46-E86 HydrophobicContact CG2-CG 4.31Å; T46-E86 PolarHBondContact OG1-OE1 3.45Å; P47-E86 WeakPolarHBondContact CD-OE2 3.4Å; S48-E86 WeakPolarHBondContact CB-OE1 3.45Å; S48-E86 PolarHBondContact N-OE2 2.9Å; S48-E86 PolarHBondContact OG-OE1 3.13Å; S48-E86 PolarHBondContact OG-OE2 2.8Å; L84-E86 PolarHBondContact O-N 3.27Å; E86-Y89 PolarHBondContact O-N 3.09Å; E86-H90 PolarHBondContact O-N 3.39Å; E86-H90 PolarHBondContact O-ND1 3.33Å; E86-H90 IonicContact OE1-CE1 3.81Å
87	D	95.3	Very high	94.3	Very high	63 Å²	63	59.2 Å²	59.2	34%	0.337	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-41.1	179.5	56.9	-17	0	0	0	112.4	P85 L91 Y129	P85-D87 VanDerWaalsContact C-N 3.3Å; P85-D87 VanDerWaalsContact CB-OD1 3.24Å; P85-D87 WeakPolarHBondContact CB-OD1 3.45Å; P85-D87 PolarHBondContact O-N 3.27Å; D87-L91 WeakPolarHBondContact O-CG 3.26Å; D87-L91 PolarHBondContact O-N 3.11Å; D87-Y129 WeakPolarHBondContact OD1-CE2 3.32Å; D87-Y129 PolarHBondContact OD1-OH 3.01Å; D87-Y129 PolarHBondContact OD2-OH 3.49Å
88	L	95.3	Very high	94.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-45.5	175.5	-172.3	61.6	0	0	0	111	L84 P85 H90 L91 I92 I122 L125 L135 W139	L84-L88 HydrophobicContact CD2-CD2 4.42Å; P85-L88 HydrophobicContact CB-CB 4.29Å; P85-L88 PolarHBondContact O-N 2.67Å; P85-L88 VanDerWaalsContact O-N 3.13Å; L88-H90 PolarHBondContact O-N 3.1Å; L88-L91 PolarHBondContact O-N 3.38Å; L88-I92 HydrophobicContact CD1-CD1 4.38Å; L88-I92 HydrophobicContact CG-CD1 3.99Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.45Å; L88-I92 PolarHBondContact O-N 3.34Å; L88-I122 HydrophobicContact CD1-CB 4.47Å; L88-I122 HydrophobicContact CD1-CG2 3.88Å; L88-L125 HydrophobicContact CD1-CB 4.19Å; L88-L135 HydrophobicContact CD2-CD1 3.64Å; L88-W139 HydrophobicContact CD1-CH2 4.48Å; L88-W139 HydrophobicContact CD2-CH2 3.86Å; L88-W139 HydrophobicContact CD2-CZ2 4.02Å; L88-W139 HydrophobicContact CD2-CZ3 4.41Å; L88-W139 HydrophobicContact CG-CH2 4.42Å
89	Y	95.4	Very high	94.5	Very high	57 Å²	57	53 Å²	53	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-54.7	-49.3	176.2	174.6	-89.8	0	0	0	111.7	P85 E86 L91 I92 K93 V150	P85-Y89 PolarHBondContact O-N 3.33Å; E86-Y89 PolarHBondContact O-N 3.09Å; Y89-L91 PolarHBondContact O-N 2.99Å; Y89-I92 PolarHBondContact O-N 2.9Å; Y89-K93 HydrophobicContact CE1-CD 4.12Å; Y89-K93 WeakPolarHBondContact O-CB 3.47Å; Y89-K93 PolarHBondContact O-N 3.4Å; Y89-V150 HydrophobicContact CD1-CG1 4.36Å; Y89-V150 HydrophobicContact CD2-CB 4.43Å; Y89-V150 HydrophobicContact CD2-CG1 4Å; Y89-V150 HydrophobicContact CD2-CG2 4.14Å; Y89-V150 HydrophobicContact CE1-CG1 3.87Å; Y89-V150 HydrophobicContact CE2-CB 3.97Å; Y89-V150 HydrophobicContact CE2-CG1 3.48Å; Y89-V150 VanDerWaalsContact CE2-CG1 3.48Å; Y89-V150 HydrophobicContact CE2-CG2 4.17Å; Y89-V150 HydrophobicContact CG-CG1 4.41Å
90	H	96	Very high	94.6	Very high	80 Å²	80	55.7 Å²	55.7	37%	0.37	29%	0.287	S	S	.	.	H	α-helix	trans	-69.4	-29.5	-178.7	-74.2	93.2	0	0	0	113.9	E86 L88 K94	E86-H90 PolarHBondContact O-N 3.39Å; E86-H90 PolarHBondContact O-ND1 3.33Å; E86-H90 IonicContact OE1-CE1 3.81Å; L88-H90 PolarHBondContact O-N 3.1Å; H90-K94 WeakPolarHBondContact O-CB 3.39Å; H90-K94 PolarHBondContact O-N 3.22Å; H90-K94 VanDerWaalsContact O-N 3.09Å
91	L	96.8	Very high	94.8	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-70	-42.3	172.2	-74.7	173.9	0	0	0	111.5	D87 L88 Y89 K94 A95 I118 R121 I122 L125	D87-L91 WeakPolarHBondContact O-CG 3.26Å; D87-L91 PolarHBondContact O-N 3.11Å; L88-L91 PolarHBondContact O-N 3.38Å; Y89-L91 PolarHBondContact O-N 2.99Å; L91-K94 PolarHBondContact O-N 3.46Å; L91-A95 PolarHBondContact O-N 3.36Å; L91-I118 HydrophobicContact CD2-CG2 4.39Å; L91-I118 WeakPolarHBondContact O-CG2 3.48Å; L91-R121 HydrophobicContact CD1-CB 3.87Å; L91-R121 HydrophobicContact CD2-CB 4.44Å; L91-I122 HydrophobicContact CB-CD1 4.26Å; L91-I122 HydrophobicContact CB-CG1 3.62Å; L91-I122 HydrophobicContact CD1-CG1 4.44Å; L91-L125 HydrophobicContact CD1-CD1 3.41Å; L91-L125 VanDerWaalsContact CD1-CD1 3.41Å
92	I	96	Very high	95	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-46.6	174.9	-64.2	168.5	0	0	0	109.7	L88 Y89 K94 A95 V96 I122 W139 Y141 A146 V150	L88-I92 HydrophobicContact CD1-CD1 4.38Å; L88-I92 HydrophobicContact CG-CD1 3.99Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.45Å; L88-I92 PolarHBondContact O-N 3.34Å; Y89-I92 PolarHBondContact O-N 2.9Å; I92-K94 VanDerWaalsContact C-N 3.26Å; I92-K94 PolarHBondContact O-N 3.24Å; I92-A95 WeakPolarHBondContact O-CB 3.41Å; I92-A95 PolarHBondContact O-N 2.87Å; I92-A95 VanDerWaalsContact O-N 3.08Å; I92-V96 HydrophobicContact CG2-CG2 4.36Å; I92-V96 WeakPolarHBondContact O-CG2 3.46Å; I92-V96 PolarHBondContact O-N 2.96Å; I92-I122 HydrophobicContact CG1-CD1 3.98Å; I92-I122 HydrophobicContact CG1-CG1 4.35Å; I92-I122 HydrophobicContact CG1-CG2 4.21Å; I92-W139 HydrophobicContact CD1-CH2 4.11Å; I92-W139 HydrophobicContact CD1-CZ2 4.11Å; I92-Y141 HydrophobicContact CD1-CD2 4.42Å; I92-Y141 HydrophobicContact CG1-CD2 4.08Å; I92-Y141 HydrophobicContact CG1-CE2 4.16Å; I92-Y141 HydrophobicContact CG2-CE2 4.08Å; I92-A146 HydrophobicContact CG2-CB 3.88Å; I92-V150 HydrophobicContact CB-CG2 3.86Å; I92-V150 HydrophobicContact CG2-CG2 3.36Å
93	K	95.8	Very high	95.2	Very high	103 Å²	103	59.4 Å²	59.4	45%	0.448	29%	0.293	S	S	.	.	H	α-helix	trans	-51.1	-46.6	174.2	-166.5	158.7	-173.5	163.8	0	112.2	Y89 V96 A97 V150	Y89-K93 HydrophobicContact CE1-CD 4.12Å; Y89-K93 WeakPolarHBondContact O-CB 3.47Å; Y89-K93 PolarHBondContact O-N 3.4Å; K93-V96 PolarHBondContact O-N 3.09Å; K93-A97 PolarHBondContact O-N 3.23Å; K93-V150 HydrophobicContact CB-CG1 3.34Å; K93-V150 HydrophobicContact CD-CG1 3.76Å; K93-V150 HydrophobicContact CG-CG1 3.6Å
94	K	96.6	Very high	95.6	Very high	111 Å²	111	61.3 Å²	61.3	48%	0.483	29%	0.288	S	S	.	.	H	α-helix	trans	-67.2	-41.8	179.4	-167.3	175.7	-66	-176	0	112	H90 L91 I92 A97 V98 I118	H90-K94 WeakPolarHBondContact O-CB 3.39Å; H90-K94 PolarHBondContact O-N 3.22Å; H90-K94 VanDerWaalsContact O-N 3.09Å; L91-K94 PolarHBondContact O-N 3.46Å; I92-K94 VanDerWaalsContact C-N 3.26Å; I92-K94 PolarHBondContact O-N 3.24Å; K94-A97 PolarHBondContact O-N 3.18Å; K94-V98 VanDerWaalsContact O-CG2 3.32Å; K94-V98 WeakPolarHBondContact O-CG2 3.38Å; K94-V98 PolarHBondContact O-N 3.47Å; K94-I118 HydrophobicContact CD-CD1 3.92Å; K94-I118 HydrophobicContact CD-CG1 4.33Å; K94-I118 HydrophobicContact CG-CD1 3.83Å
95	A	96.7	Very high	95.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-44.1	176.5	0	0	0	0	0	111.6	L91 I92 A97 V98 R99 L115 I118 I122 Y141	L91-A95 PolarHBondContact O-N 3.36Å; I92-A95 WeakPolarHBondContact O-CB 3.41Å; I92-A95 PolarHBondContact O-N 2.87Å; I92-A95 VanDerWaalsContact O-N 3.08Å; A95-A97 PolarHBondContact O-N 3.31Å; A95-V98 PolarHBondContact O-N 3.47Å; A95-R99 VanDerWaalsContact O-CB 3.31Å; A95-R99 WeakPolarHBondContact O-CB 3.3Å; A95-R99 PolarHBondContact O-N 3.25Å; A95-L115 HydrophobicContact CB-CD1 4.09Å; A95-I118 HydrophobicContact CB-CG2 3.84Å; A95-I122 HydrophobicContact CB-CD1 3.85Å; A95-Y141 WeakPolarHBondContact CB-OH 3.37Å
96	V	96.6	Very high	95.8	Very high	42 Å²	42	73.6 Å²	73.6	26%	0.255	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-45.9	176.4	172.7	0	0	0	0	110.9	I92 K93 R99 K100 A146	I92-V96 HydrophobicContact CG2-CG2 4.36Å; I92-V96 WeakPolarHBondContact O-CG2 3.46Å; I92-V96 PolarHBondContact O-N 2.96Å; K93-V96 PolarHBondContact O-N 3.09Å; V96-R99 PolarHBondContact O-N 3.04Å; V96-K100 WeakPolarHBondContact O-CB 3.43Å; V96-K100 PolarHBondContact O-N 3.07Å; V96-A146 HydrophobicContact CG2-CB 3.7Å
97	A	95.8	Very high	95.9	Very high	61 Å²	61	81.2 Å²	81.2	50%	0.504	37%	0.368	S	S	.	.	H	α-helix	trans	-61.5	-45.3	177.6	0	0	0	0	0	112.7	K93 K94 A95 K100 H101	K93-A97 PolarHBondContact O-N 3.23Å; K94-A97 PolarHBondContact O-N 3.18Å; A95-A97 PolarHBondContact O-N 3.31Å; A97-K100 PolarHBondContact O-N 3Å; A97-H101 PolarHBondContact O-N 3.22Å
98	V	96.3	Very high	96	Very high	31 Å²	31	80.8 Å²	80.8	19%	0.188	37%	0.366	C	S	.	.	H	α-helix	trans	-67	-37.2	178.8	174.6	0	0	0	0	111.4	K94 A95 H101 L102 A111 L115 I118	K94-V98 VanDerWaalsContact O-CG2 3.32Å; K94-V98 WeakPolarHBondContact O-CG2 3.38Å; K94-V98 PolarHBondContact O-N 3.47Å; A95-V98 PolarHBondContact O-N 3.47Å; V98-H101 WeakPolarHBondContact O-CB 3.47Å; V98-H101 PolarHBondContact O-N 2.97Å; V98-L102 HydrophobicContact CG1-CD1 4.1Å; V98-L102 WeakPolarHBondContact O-CG 3.2Å; V98-L102 PolarHBondContact O-N 2.99Å; V98-A111 HydrophobicContact CG1-CB 4.39Å; V98-L115 HydrophobicContact CB-CD1 4.33Å; V98-L115 HydrophobicContact CG1-CB 3.87Å; V98-L115 HydrophobicContact CG1-CD1 4.25Å; V98-L115 HydrophobicContact CG1-CG 4.5Å; V98-I118 HydrophobicContact CG2-CD1 4.06Å
99	R	95.1	Very high	96.1	Very high	79 Å²	79	89.5 Å²	89.5	30%	0.298	40%	0.404	S	S	.	.	H	α-helix	trans	-65	-46	176.5	-173.2	171	-74.7	-99	4.4	111.6	A95 V96 H101 L102 E103 E119	A95-R99 VanDerWaalsContact O-CB 3.31Å; A95-R99 WeakPolarHBondContact O-CB 3.3Å; A95-R99 PolarHBondContact O-N 3.25Å; V96-R99 PolarHBondContact O-N 3.04Å; R99-H101 VanDerWaalsContact C-N 3.26Å; R99-H101 PolarHBondContact O-N 2.94Å; R99-L102 PolarHBondContact O-N 3.41Å; R99-L102 VanDerWaalsContact O-N 3.09Å; R99-E103 WeakPolarHBondContact O-CG 3.42Å; R99-E103 PolarHBondContact O-N 3.42Å; R99-E119 IonicContact CZ-OE1 3.46Å; R99-E119 IonicContact NE-OE1 3.41Å; R99-E119 IonicContact NH2-OE1 3.61Å; R99-E119 PolarHBondContact NH2-OE1 2.99Å
100	K	94.8	Very high	96.2	Very high	123 Å²	123	90.7 Å²	90.7	54%	0.535	41%	0.414	S	S	.	.	H	α-helix	trans	-58.4	-36.8	173.5	-173.5	178	-177.5	176.8	0	112.5	V96 A97	V96-K100 WeakPolarHBondContact O-CB 3.43Å; V96-K100 PolarHBondContact O-N 3.07Å; A97-K100 PolarHBondContact O-N 3Å
101	H	96.3	Very high	96.2	Very high	77 Å²	77	87.3 Å²	87.3	36%	0.356	40%	0.4	S	S	.	.	H	α-helix	trans	-64.9	-46.3	173	170.1	78.7	0	0	0	112.1	A97 V98 R99 E103 R104 N105 D108	A97-H101 PolarHBondContact O-N 3.22Å; V98-H101 WeakPolarHBondContact O-CB 3.47Å; V98-H101 PolarHBondContact O-N 2.97Å; R99-H101 VanDerWaalsContact C-N 3.26Å; R99-H101 PolarHBondContact O-N 2.94Å; H101-E103 VanDerWaalsContact C-N 3.33Å; H101-E103 PolarHBondContact O-N 3.48Å; H101-R104 PolarHBondContact O-N 3.26Å; H101-N105 PolarHBondContact CE1-ND2 2.64Å; H101-N105 PolarHBondContact ND1-ND2 3.03Å; H101-N105 VanDerWaalsContact ND1-ND2 3.16Å; H101-N105 WeakPolarHBondContact O-CB 3.47Å; H101-N105 PolarHBondContact O-N 2.76Å; H101-N105 PolarHBondContact O-ND2 3.04Å; H101-N105 VanDerWaalsContact O-ND2 3.12Å; H101-D108 IonicContact CD2-OD2 3.75Å; H101-D108 IonicContact CE1-OD2 3.91Å; H101-D108 IonicContact NE2-OD2 2.87Å; H101-D108 PolarHBondContact NE2-OD2 3.02Å
102	L	96.3	Very high	96.3	Very high	26 Å²	26	92.9 Å²	92.9	14%	0.136	42%	0.423	C	S	.	.	H	α-helix	trans	-68.1	-27.4	-178.4	-78.9	170.1	0	0	0	114.1	V98 R99 R104 N105 R106 D108 A111 K112 L115	V98-L102 HydrophobicContact CG1-CD1 4.1Å; V98-L102 WeakPolarHBondContact O-CG 3.2Å; V98-L102 PolarHBondContact O-N 2.99Å; R99-L102 PolarHBondContact O-N 3.41Å; R99-L102 VanDerWaalsContact O-N 3.09Å; L102-R104 PolarHBondContact O-N 3.25Å; L102-N105 CarbonylContact O-C 3.57Å; L102-N105 PolarHBondContact O-N 2.85Å; L102-R106 WeakPolarHBondContact O-CA 3.18Å; L102-R106 PolarHBondContact O-N 3.46Å; L102-D108 HydrophobicContact CD2-CB 4.15Å; L102-D108 WeakPolarHBondContact CD2-O 3.43Å; L102-A111 HydrophobicContact CD1-CB 4.44Å; L102-A111 HydrophobicContact CD2-CB 3.76Å; L102-A111 HydrophobicContact CG-CB 4.06Å; L102-K112 HydrophobicContact CD1-CB 4.34Å; L102-K112 HydrophobicContact CD2-CB 4.35Å; L102-L115 HydrophobicContact CD1-CB 4.3Å; L102-L115 HydrophobicContact CD1-CD2 3.82Å
103	E	94.3	Very high	96.4	Very high	133 Å²	133	98.5 Å²	98.5	62%	0.621	45%	0.448	S	S	*	.	H	α-helix	trans	-58.1	-39.4	172.9	-76.2	166.9	-169.4	0	0	111.6	R99 H101	R99-E103 WeakPolarHBondContact O-CG 3.42Å; R99-E103 PolarHBondContact O-N 3.42Å; H101-E103 VanDerWaalsContact C-N 3.33Å; H101-E103 PolarHBondContact O-N 3.48Å
104	R	96.4	Very high	96.4	Very high	197 Å²	197	100.7 Å²	100.7	74%	0.743	45%	0.453	S	S	*	.	H	α-helix	trans	-84.7	-36.8	177	-58.9	176.3	-176.1	-174.3	-4.7	111.6	H101 L102	H101-R104 PolarHBondContact O-N 3.26Å; L102-R104 PolarHBondContact O-N 3.25Å
105	N	96.4	Very high	96.5	Very high	75 Å²	75	96 Å²	96	40%	0.401	43%	0.434	S	S	.	.			trans	-111.3	60.5	-172.7	-60.5	-68	0	0	0	112	H101 L102 K107 D108	H101-N105 PolarHBondContact CE1-ND2 2.64Å; H101-N105 PolarHBondContact ND1-ND2 3.03Å; H101-N105 VanDerWaalsContact ND1-ND2 3.16Å; H101-N105 WeakPolarHBondContact O-CB 3.47Å; H101-N105 PolarHBondContact O-N 2.76Å; H101-N105 PolarHBondContact O-ND2 3.04Å; H101-N105 VanDerWaalsContact O-ND2 3.12Å; L102-N105 CarbonylContact O-C 3.57Å; L102-N105 PolarHBondContact O-N 2.85Å; N105-K107 PolarHBondContact O-N 3.42Å; N105-D108 HydrophobicContact CB-CB 4.28Å; N105-D108 WeakPolarHBondContact O-CB 3.47Å; N105-D108 PolarHBondContact O-N 2.88Å
106	R	94.7	Very high	96.5	Very high	227 Å²	227	100.2 Å²	100.2	86%	0.857	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.1	-173.3	-65.8	-178.5	67.2	-154	1.9	115	L102	L102-R106 WeakPolarHBondContact O-CA 3.18Å; L102-R106 PolarHBondContact O-N 3.46Å
107	K	97.1	Very high	96.6	Very high	202 Å²	202	100 Å²	100	88%	0.878	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.4	180	-66.6	-176.2	178.7	179.1	0	113.6	N105 K109	N105-K107 PolarHBondContact O-N 3.42Å; K107-K109 PolarHBondContact O-N 3.21Å
108	D	97.6	Very high	96.7	Very high	54 Å²	54	97.4 Å²	97.4	29%	0.289	43%	0.43	S	S	.	.			trans	-75.8	91.8	-179.5	-171.9	-13.5	0	0	0	111.3	H101 L102 N105 D110 A111 K112	H101-D108 IonicContact CD2-OD2 3.75Å; H101-D108 IonicContact CE1-OD2 3.91Å; H101-D108 IonicContact NE2-OD2 2.87Å; H101-D108 PolarHBondContact NE2-OD2 3.02Å; L102-D108 HydrophobicContact CD2-CB 4.15Å; L102-D108 WeakPolarHBondContact CD2-O 3.43Å; N105-D108 HydrophobicContact CB-CB 4.28Å; N105-D108 WeakPolarHBondContact O-CB 3.47Å; N105-D108 PolarHBondContact O-N 2.88Å; D108-D110 VanDerWaalsContact C-N 3.35Å; D108-D110 PolarHBondContact OD1-N 3.12Å; D108-A111 HydrophobicContact CB-CB 4.18Å; D108-A111 VanDerWaalsContact CG-CB 3.4Å; D108-A111 PolarHBondContact OD1-N 2.85Å; D108-A111 VanDerWaalsContact OD2-CB 3.29Å; D108-A111 WeakPolarHBondContact OD2-CB 3.41Å; D108-K112 PolarHBondContact O-N 3.48Å
109	K	97.4	Very high	96.7	Very high	182 Å²	182	97.6 Å²	97.6	79%	0.791	43%	0.429	S	S	*	.	H	α-helix	trans	-70.8	-29.5	-179.8	-64.3	-179.9	-177.4	176.6	0	112.5	K107 K112 F113	K107-K109 PolarHBondContact O-N 3.21Å; K109-K112 PolarHBondContact O-N 2.96Å; K109-F113 PolarHBondContact O-N 3.28Å
110	D	97.3	Very high	96.8	Very high	83 Å²	83	96.1 Å²	96.1	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-71	-46.7	179.3	-177.6	64.3	0	0	0	110.6	D108 K112 F113 R114	D108-D110 VanDerWaalsContact C-N 3.35Å; D108-D110 PolarHBondContact OD1-N 3.12Å; D110-K112 PolarHBondContact O-N 2.97Å; D110-F113 PolarHBondContact O-N 3.42Å; D110-F113 VanDerWaalsContact O-N 3.14Å; D110-R114 WeakPolarHBondContact O-CG 3.42Å; D110-R114 PolarHBondContact O-N 3.03Å; D110-R114 IonicContact OD1-NE 2.73Å; D110-R114 IonicContact OD2-CZ 2.7Å; D110-R114 IonicContact OD2-NE 3.92Å; D110-R114 PolarHBondContact OD2-NE 3.08Å; D110-R114 IonicContact OD2-NH2 3.71Å; D110-R114 PolarHBondContact OD2-NH2 3.34Å
111	A	97.1	Very high	97	Very high	9 Å²	9	94 Å²	94	7%	0.074	42%	0.42	C	S	.	.	H	α-helix	trans	-59.6	-37.8	174.3	0	0	0	0	0	111.7	V98 L102 D108 R114 L115	V98-A111 HydrophobicContact CG1-CB 4.39Å; L102-A111 HydrophobicContact CD1-CB 4.44Å; L102-A111 HydrophobicContact CD2-CB 3.76Å; L102-A111 HydrophobicContact CG-CB 4.06Å; D108-A111 HydrophobicContact CB-CB 4.18Å; D108-A111 VanDerWaalsContact CG-CB 3.4Å; D108-A111 PolarHBondContact OD1-N 2.85Å; D108-A111 VanDerWaalsContact OD2-CB 3.29Å; D108-A111 WeakPolarHBondContact OD2-CB 3.41Å; A111-R114 PolarHBondContact O-N 3.4Å; A111-L115 WeakPolarHBondContact O-CB 3.43Å; A111-L115 PolarHBondContact O-N 3.44Å
112	K	97.3	Very high	97	Very high	135 Å²	135	90.4 Å²	90.4	59%	0.587	40%	0.403	S	S	*	.	H	α-helix	trans	-62.3	-45.9	174.2	-171.6	178.7	-178.7	-179.4	0	112	L102 D108 K109 D110 L115 I116	L102-K112 HydrophobicContact CD1-CB 4.34Å; L102-K112 HydrophobicContact CD2-CB 4.35Å; D108-K112 PolarHBondContact O-N 3.48Å; K109-K112 PolarHBondContact O-N 2.96Å; D110-K112 PolarHBondContact O-N 2.97Å; K112-L115 PolarHBondContact O-N 3.18Å; K112-I116 WeakPolarHBondContact O-CG1 3.45Å; K112-I116 PolarHBondContact O-N 3.42Å
113	F	97.8	Very high	97	Very high	119 Å²	119	93.4 Å²	93.4	52%	0.522	42%	0.416	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.3	175.3	-105.5	0	0	0	111.7	K109 D110 L115 I116 L117	K109-F113 PolarHBondContact O-N 3.28Å; D110-F113 PolarHBondContact O-N 3.42Å; D110-F113 VanDerWaalsContact O-N 3.14Å; F113-L115 VanDerWaalsContact C-N 3.33Å; F113-L115 PolarHBondContact O-N 3.33Å; F113-I116 WeakPolarHBondContact O-CB 3.24Å; F113-I116 PolarHBondContact O-N 3.28Å; F113-L117 HydrophobicContact CD1-CD1 4.16Å; F113-L117 HydrophobicContact CE1-CD1 3.58Å; F113-L117 HydrophobicContact CE1-CG 4.29Å; F113-L117 HydrophobicContact CZ-CD1 3.9Å; F113-L117 HydrophobicContact CZ-CD2 4.34Å; F113-L117 HydrophobicContact CZ-CG 4.29Å; F113-L117 PolarHBondContact O-N 3.02Å
114	R	97.8	Very high	97.2	Very high	148 Å²	148	93 Å²	93	56%	0.558	41%	0.408	S	S	*	.	H	α-helix	trans	-64	-35.7	177.6	-69.3	-179.1	-172.9	-123.3	-0.3	112.9	D110 A111 L117 I118	D110-R114 WeakPolarHBondContact O-CG 3.42Å; D110-R114 PolarHBondContact O-N 3.03Å; D110-R114 IonicContact OD1-NE 2.73Å; D110-R114 IonicContact OD2-CZ 2.7Å; D110-R114 IonicContact OD2-NE 3.92Å; D110-R114 PolarHBondContact OD2-NE 3.08Å; D110-R114 IonicContact OD2-NH2 3.71Å; D110-R114 PolarHBondContact OD2-NH2 3.34Å; A111-R114 PolarHBondContact O-N 3.4Å; R114-L117 PolarHBondContact O-N 2.74Å; R114-I118 VanDerWaalsContact O-CG1 3.32Å; R114-I118 WeakPolarHBondContact O-CG1 3.35Å; R114-I118 PolarHBondContact O-N 3.13Å
115	L	97.4	Very high	97.2	Very high	14 Å²	14	85.7 Å²	85.7	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-59.6	-47.6	174.5	-179.2	59.6	0	0	0	110.8	A95 V98 L102 A111 K112 F113 L117 I118 E119	A95-L115 HydrophobicContact CB-CD1 4.09Å; V98-L115 HydrophobicContact CB-CD1 4.33Å; V98-L115 HydrophobicContact CG1-CB 3.87Å; V98-L115 HydrophobicContact CG1-CD1 4.25Å; V98-L115 HydrophobicContact CG1-CG 4.5Å; L102-L115 HydrophobicContact CD1-CB 4.3Å; L102-L115 HydrophobicContact CD1-CD2 3.82Å; A111-L115 WeakPolarHBondContact O-CB 3.43Å; A111-L115 PolarHBondContact O-N 3.44Å; K112-L115 PolarHBondContact O-N 3.18Å; F113-L115 VanDerWaalsContact C-N 3.33Å; F113-L115 PolarHBondContact O-N 3.33Å; L115-L117 VanDerWaalsContact C-N 3.25Å; L115-L117 PolarHBondContact O-N 2.91Å; L115-I118 PolarHBondContact O-N 3.46Å; L115-E119 HydrophobicContact CD1-CG 4.05Å; L115-E119 HydrophobicContact CG-CG 4.35Å; L115-E119 PolarHBondContact O-N 2.88Å
116	I	97.6	Very high	97.2	Very high	87 Å²	87	82.4 Å²	82.4	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-54.9	-43.3	175.9	-66.7	159.2	0	0	0	110.8	K112 F113 I118 S120	K112-I116 WeakPolarHBondContact O-CG1 3.45Å; K112-I116 PolarHBondContact O-N 3.42Å; F113-I116 WeakPolarHBondContact O-CB 3.24Å; F113-I116 PolarHBondContact O-N 3.28Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 3.48Å; I116-S120 VanDerWaalsContact O-CB 3.24Å; I116-S120 WeakPolarHBondContact O-CB 3.49Å; I116-S120 PolarHBondContact O-N 3.01Å; I116-S120 PolarHBondContact O-OG 3.49Å
117	L	98	Very high	97.3	Very high	39 Å²	39	80 Å²	80	20%	0.204	36%	0.358	C	S	.	.	H	α-helix	trans	-68.6	-29.1	178.1	-61.8	-178.1	0	0	0	113.7	H5 F113 R114 L115 R121	H5-L117 HydrophobicContact CB-CB 4.42Å; H5-L117 HydrophobicContact CB-CD1 4.17Å; H5-L117 HydrophobicContact CB-CD2 4.12Å; H5-L117 HydrophobicContact CB-CG 4.47Å; H5-L117 PolarHBondContact CE1-O 3.45Å; H5-L117 PolarHBondContact ND1-O 3.37Å; H5-L117 VanDerWaalsContact ND1-O 3.1Å; F113-L117 HydrophobicContact CD1-CD1 4.16Å; F113-L117 HydrophobicContact CE1-CD1 3.58Å; F113-L117 HydrophobicContact CE1-CG 4.29Å; F113-L117 HydrophobicContact CZ-CD1 3.9Å; F113-L117 HydrophobicContact CZ-CD2 4.34Å; F113-L117 HydrophobicContact CZ-CG 4.29Å; F113-L117 PolarHBondContact O-N 3.02Å; R114-L117 PolarHBondContact O-N 2.74Å; L115-L117 VanDerWaalsContact C-N 3.25Å; L115-L117 PolarHBondContact O-N 2.91Å; L117-R121 WeakPolarHBondContact O-CG 3.26Å; L117-R121 PolarHBondContact O-N 2.9Å; L117-R121 PolarHBondContact O-NE 3.1Å; L117-R121 VanDerWaalsContact O-NE 3.13Å
118	I	97.3	Very high	97.3	Very high	6 Å²	6	76.1 Å²	76.1	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-74.4	-50.9	175	-66.4	159.2	0	0	0	109.5	L91 K94 A95 V98 R114 L115 I116 S120 R121 I122	L91-I118 HydrophobicContact CD2-CG2 4.39Å; L91-I118 WeakPolarHBondContact O-CG2 3.48Å; K94-I118 HydrophobicContact CD-CD1 3.92Å; K94-I118 HydrophobicContact CD-CG1 4.33Å; K94-I118 HydrophobicContact CG-CD1 3.83Å; A95-I118 HydrophobicContact CB-CG2 3.84Å; V98-I118 HydrophobicContact CG2-CD1 4.06Å; R114-I118 VanDerWaalsContact O-CG1 3.32Å; R114-I118 WeakPolarHBondContact O-CG1 3.35Å; R114-I118 PolarHBondContact O-N 3.13Å; L115-I118 PolarHBondContact O-N 3.46Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 3.48Å; I118-S120 VanDerWaalsContact C-N 3.29Å; I118-S120 PolarHBondContact O-N 2.7Å; I118-R121 VanDerWaalsContact CG1-NH2 3.34Å; I118-R121 WeakPolarHBondContact O-CA 3.4Å; I118-R121 WeakPolarHBondContact O-CB 3.38Å; I118-R121 PolarHBondContact O-N 3.08Å; I118-I122 HydrophobicContact CG2-CD1 4.16Å; I118-I122 PolarHBondContact O-N 3.25Å
119	E	96.9	Very high	97.3	Very high	35 Å²	35	75.3 Å²	75.3	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-40.9	179.3	-68.4	179.7	161.8	0	0	111.3	R99 L115 R121 I122 H123 Y141	R99-E119 IonicContact CZ-OE1 3.46Å; R99-E119 IonicContact NE-OE1 3.41Å; R99-E119 IonicContact NH2-OE1 3.61Å; R99-E119 PolarHBondContact NH2-OE1 2.99Å; L115-E119 HydrophobicContact CD1-CG 4.05Å; L115-E119 HydrophobicContact CG-CG 4.35Å; L115-E119 PolarHBondContact O-N 2.88Å; E119-R121 VanDerWaalsContact C-N 3.26Å; E119-R121 PolarHBondContact O-N 2.91Å; E119-I122 WeakPolarHBondContact O-CB 3.44Å; E119-I122 PolarHBondContact O-N 3.28Å; E119-I122 VanDerWaalsContact O-N 3.07Å; E119-H123 PolarHBondContact O-CD2 3.15Å; E119-H123 PolarHBondContact O-N 3.09Å; E119-Y141 HydrophobicContact CG-CE1 3.98Å
120	S	97.6	Very high	97.3	Very high	48 Å²	48	70.1 Å²	70.1	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-57.3	-37.1	172.8	-63.2	0	0	0	0	112.7	I116 I118 R124	I116-S120 VanDerWaalsContact O-CB 3.24Å; I116-S120 WeakPolarHBondContact O-CB 3.49Å; I116-S120 PolarHBondContact O-N 3.01Å; I116-S120 PolarHBondContact O-OG 3.49Å; I118-S120 VanDerWaalsContact C-N 3.29Å; I118-S120 PolarHBondContact O-N 2.7Å; S120-R124 VanDerWaalsContact O-CG 3.26Å; S120-R124 WeakPolarHBondContact O-CG 3.5Å; S120-R124 PolarHBondContact O-N 3.41Å
121	R	97.9	Very high	97.3	Very high	79 Å²	79	71.4 Å²	71.4	30%	0.298	32%	0.32	S	S	.	.	H	α-helix	trans	-71.6	-39.5	174.6	-74.3	179	-74.8	172.6	-6.6	112.2	M4 L91 L117 I118 E119 R124 L125	M4-R121 HydrophobicContact SD-CG 4.13Å; L91-R121 HydrophobicContact CD1-CB 3.87Å; L91-R121 HydrophobicContact CD2-CB 4.44Å; L117-R121 WeakPolarHBondContact O-CG 3.26Å; L117-R121 PolarHBondContact O-N 2.9Å; L117-R121 PolarHBondContact O-NE 3.1Å; L117-R121 VanDerWaalsContact O-NE 3.13Å; I118-R121 VanDerWaalsContact CG1-NH2 3.34Å; I118-R121 WeakPolarHBondContact O-CA 3.4Å; I118-R121 WeakPolarHBondContact O-CB 3.38Å; I118-R121 PolarHBondContact O-N 3.08Å; E119-R121 VanDerWaalsContact C-N 3.26Å; E119-R121 PolarHBondContact O-N 2.91Å; R121-R124 PolarHBondContact O-N 3.07Å; R121-L125 PolarHBondContact O-N 3.25Å
122	I	97.1	Very high	97.2	Very high	0 Å²	0	77 Å²	77	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-57.6	-50.8	175.6	-66	171.1	0	0	0	109.7	L88 L91 I92 A95 I118 E119 R124 L125 A126 Y141	L88-I122 HydrophobicContact CD1-CB 4.47Å; L88-I122 HydrophobicContact CD1-CG2 3.88Å; L91-I122 HydrophobicContact CB-CD1 4.26Å; L91-I122 HydrophobicContact CB-CG1 3.62Å; L91-I122 HydrophobicContact CD1-CG1 4.44Å; I92-I122 HydrophobicContact CG1-CD1 3.98Å; I92-I122 HydrophobicContact CG1-CG1 4.35Å; I92-I122 HydrophobicContact CG1-CG2 4.21Å; A95-I122 HydrophobicContact CB-CD1 3.85Å; I118-I122 HydrophobicContact CG2-CD1 4.16Å; I118-I122 PolarHBondContact O-N 3.25Å; E119-I122 WeakPolarHBondContact O-CB 3.44Å; E119-I122 PolarHBondContact O-N 3.28Å; E119-I122 VanDerWaalsContact O-N 3.07Å; I122-R124 VanDerWaalsContact C-N 3.34Å; I122-R124 PolarHBondContact O-N 3.28Å; I122-L125 PolarHBondContact O-N 3.27Å; I122-A126 VanDerWaalsContact O-CB 3.27Å; I122-A126 WeakPolarHBondContact O-CB 3.45Å; I122-A126 PolarHBondContact O-N 2.86Å; I122-Y141 HydrophobicContact CD1-CD2 4.43Å; I122-Y141 HydrophobicContact CD1-CE1 4.34Å; I122-Y141 HydrophobicContact CD1-CE2 4.03Å; I122-Y141 HydrophobicContact CG2-CD1 4.1Å; I122-Y141 HydrophobicContact CG2-CD2 3.92Å; I122-Y141 HydrophobicContact CG2-CG 3.67Å
123	H	96.9	Very high	97.1	Very high	90 Å²	90	81.5 Å²	81.5	42%	0.417	36%	0.357	S	S	.	.	H	α-helix	trans	-62.2	-39.3	-179.8	-66.8	-58.7	0	0	0	113	E119 R127 Y141	E119-H123 PolarHBondContact O-CD2 3.15Å; E119-H123 PolarHBondContact O-N 3.09Å; H123-R127 WeakPolarHBondContact O-CB 3.41Å; H123-R127 PolarHBondContact O-N 3.25Å; H123-Y141 AromaticContact CE1-CD1 3.79Å
124	R	97.6	Very high	96.9	Very high	123 Å²	123	78.9 Å²	78.9	46%	0.464	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-46.5	175.3	-73.5	173.3	65.9	172.3	4.4	112.1	M4 S120 R121 I122 R127 Y128	M4-R124 PolarHBondContact SD-NH1 3.23Å; S120-R124 VanDerWaalsContact O-CG 3.26Å; S120-R124 WeakPolarHBondContact O-CG 3.5Å; S120-R124 PolarHBondContact O-N 3.41Å; R121-R124 PolarHBondContact O-N 3.07Å; I122-R124 VanDerWaalsContact C-N 3.34Å; I122-R124 PolarHBondContact O-N 3.28Å; R124-R127 PolarHBondContact O-N 3.23Å; R124-Y128 PolarHBondContact O-N 3.24Å
125	L	96.8	Very high	96.7	Very high	44 Å²	44	72.4 Å²	72.4	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-41.4	178.9	-84.3	168.8	0	0	0	112.3	L88 L91 R121 I122 R127 Y128 Y129	L88-L125 HydrophobicContact CD1-CB 4.19Å; L91-L125 HydrophobicContact CD1-CD1 3.41Å; L91-L125 VanDerWaalsContact CD1-CD1 3.41Å; R121-L125 PolarHBondContact O-N 3.25Å; I122-L125 PolarHBondContact O-N 3.27Å; L125-R127 VanDerWaalsContact C-N 3.31Å; L125-R127 PolarHBondContact O-N 3.41Å; L125-Y128 WeakPolarHBondContact O-CB 3.32Å; L125-Y128 PolarHBondContact O-N 3.36Å; L125-Y128 VanDerWaalsContact O-N 3.15Å; L125-Y129 HydrophobicContact CB-CD2 4.46Å; L125-Y129 HydrophobicContact CB-CE2 4.47Å; L125-Y129 HydrophobicContact CD2-CE2 4.08Å; L125-Y129 VanDerWaalsContact O-CD2 3.23Å; L125-Y129 WeakPolarHBondContact O-CD2 3.31Å; L125-Y129 PolarHBondContact O-N 2.89Å
126	A	96.5	Very high	96.5	Very high	6 Å²	6	74.1 Å²	74.1	5%	0.05	34%	0.342	C	S	.	.	H	α-helix	trans	-57.4	-44.9	175	0	0	0	0	0	111.3	I122 Y128 Y129 K130 W139	I122-A126 VanDerWaalsContact O-CB 3.27Å; I122-A126 WeakPolarHBondContact O-CB 3.45Å; I122-A126 PolarHBondContact O-N 2.86Å; A126-Y128 VanDerWaalsContact C-N 3.35Å; A126-Y128 PolarHBondContact O-N 2.87Å; A126-Y129 PolarHBondContact O-N 3.38Å; A126-K130 VanDerWaalsContact O-CG 3.3Å; A126-K130 WeakPolarHBondContact O-CG 3.47Å; A126-K130 PolarHBondContact O-N 3.38Å; A126-W139 HydrophobicContact CB-CE3 3.93Å; A126-W139 HydrophobicContact CB-CH2 4.37Å; A126-W139 HydrophobicContact CB-CZ3 3.43Å; A126-W139 VanDerWaalsContact CB-CZ3 3.43Å
127	R	97.1	Very high	96.4	Very high	176 Å²	176	75.4 Å²	75.4	66%	0.664	36%	0.357	S	S	*	.	H	α-helix	trans	-58.7	-45	175.1	-171.9	-172.4	-59.9	159.6	0.4	112.1	H123 R124 L125 K130 T131	H123-R127 WeakPolarHBondContact O-CB 3.41Å; H123-R127 PolarHBondContact O-N 3.25Å; R124-R127 PolarHBondContact O-N 3.23Å; L125-R127 VanDerWaalsContact C-N 3.31Å; L125-R127 PolarHBondContact O-N 3.41Å; R127-K130 PolarHBondContact O-N 2.97Å; R127-T131 PolarHBondContact O-N 3.45Å; R127-T131 VanDerWaalsContact O-N 3.08Å; R127-T131 PolarHBondContact O-OG1 2.73Å
128	Y	97.5	Very high	96.2	Very high	121 Å²	121	80.2 Å²	80.2	48%	0.475	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-48.8	176.3	167.7	-102	0	0	0	111.6	R124 L125 A126 K130 T131 K132	R124-Y128 PolarHBondContact O-N 3.24Å; L125-Y128 WeakPolarHBondContact O-CB 3.32Å; L125-Y128 PolarHBondContact O-N 3.36Å; L125-Y128 VanDerWaalsContact O-N 3.15Å; A126-Y128 VanDerWaalsContact C-N 3.35Å; A126-Y128 PolarHBondContact O-N 2.87Å; Y128-K130 PolarHBondContact O-N 3.45Å; Y128-T131 WeakPolarHBondContact O-CB 3.38Å; Y128-T131 PolarHBondContact O-N 3.31Å; Y128-K132 HydrophobicContact CD2-CG 4.34Å; Y128-K132 HydrophobicContact CE1-CG 4.34Å; Y128-K132 HydrophobicContact CE2-CD 4.48Å; Y128-K132 HydrophobicContact CE2-CG 3.84Å; Y128-K132 PolarHBondContact O-N 3.27Å
129	Y	97.3	Very high	96	Very high	38 Å²	38	82 Å²	82	15%	0.149	39%	0.389	C	S	.	.	H	α-helix	trans	-69.7	-30.7	-178.2	-75.8	-59	0	0	0	113.9	P85 D87 L125 A126 K132 R133 V134 L135	P85-Y129 HydrophobicContact CB-CD2 4.23Å; P85-Y129 HydrophobicContact CB-CE1 4.07Å; P85-Y129 HydrophobicContact CB-CE2 3.65Å; P85-Y129 HydrophobicContact CG-CD1 3.99Å; P85-Y129 HydrophobicContact CG-CD2 3.92Å; P85-Y129 HydrophobicContact CG-CE1 3.92Å; P85-Y129 HydrophobicContact CG-CE2 3.85Å; P85-Y129 HydrophobicContact CG-CG 4Å; D87-Y129 WeakPolarHBondContact OD1-CE2 3.32Å; D87-Y129 PolarHBondContact OD1-OH 3.01Å; D87-Y129 PolarHBondContact OD2-OH 3.49Å; L125-Y129 HydrophobicContact CB-CD2 4.46Å; L125-Y129 HydrophobicContact CB-CE2 4.47Å; L125-Y129 HydrophobicContact CD2-CE2 4.08Å; L125-Y129 VanDerWaalsContact O-CD2 3.23Å; L125-Y129 WeakPolarHBondContact O-CD2 3.31Å; L125-Y129 PolarHBondContact O-N 2.89Å; A126-Y129 PolarHBondContact O-N 3.38Å; Y129-K132 CarbonylContact O-C 3.44Å; Y129-K132 PolarHBondContact O-N 2.92Å; Y129-R133 PolarHBondContact O-N 3.37Å; Y129-V134 HydrophobicContact CD1-CB 3.83Å; Y129-V134 HydrophobicContact CD1-CG1 3.96Å; Y129-V134 HydrophobicContact CD1-CG2 4.03Å; Y129-V134 HydrophobicContact CG-CB 4.45Å; Y129-V134 PolarHBondContact O-N 3.36Å; Y129-L135 PolarHBondContact O-N 3.35Å
130	K	96.1	Very high	95.9	Very high	73 Å²	73	87 Å²	87	32%	0.317	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-45.9	168.2	-72.6	180	-175.3	-153.9	0	111.8	A126 R127 Y128 K132 R133 L135 P137 W139	A126-K130 VanDerWaalsContact O-CG 3.3Å; A126-K130 WeakPolarHBondContact O-CG 3.47Å; A126-K130 PolarHBondContact O-N 3.38Å; R127-K130 PolarHBondContact O-N 2.97Å; Y128-K130 PolarHBondContact O-N 3.45Å; K130-K132 PolarHBondContact O-N 2.98Å; K130-R133 PolarHBondContact O-N 3.14Å; K130-L135 HydrophobicContact CG-CB 4.26Å; K130-P137 WeakPolarHBondContact CE-O 3.29Å; K130-P137 PolarHBondContact NZ-O 3.39Å; K130-W139 WeakPolarHBondContact CE-O 3.43Å; K130-W139 PolarHBondContact NZ-O 3Å
131	T	97.1	Very high	95.6	Very high	109 Å²	109	85.3 Å²	85.3	67%	0.669	40%	0.396	S	S	*	.	H	α-helix	trans	-61	-36.5	178.2	-51.2	0	0	0	0	111.3	R127 Y128 R133	R127-T131 PolarHBondContact O-N 3.45Å; R127-T131 VanDerWaalsContact O-N 3.08Å; R127-T131 PolarHBondContact O-OG1 2.73Å; Y128-T131 WeakPolarHBondContact O-CB 3.38Å; Y128-T131 PolarHBondContact O-N 3.31Å; T131-R133 VanDerWaalsContact C-N 3.27Å; T131-R133 PolarHBondContact O-N 3.41Å
132	K	95.9	Very high	95.4	Very high	128 Å²	128	85 Å²	85	56%	0.557	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	5.7	175.7	-64.8	-62.4	-174.9	-175.7	0	114.3	Y128 Y129 K130 V134	Y128-K132 HydrophobicContact CD2-CG 4.34Å; Y128-K132 HydrophobicContact CE1-CG 4.34Å; Y128-K132 HydrophobicContact CE2-CD 4.48Å; Y128-K132 HydrophobicContact CE2-CG 3.84Å; Y128-K132 PolarHBondContact O-N 3.27Å; Y129-K132 CarbonylContact O-C 3.44Å; Y129-K132 PolarHBondContact O-N 2.92Å; K130-K132 PolarHBondContact O-N 2.98Å; K132-V134 HydrophobicContact CB-CG2 4.08Å; K132-V134 PolarHBondContact O-N 3.26Å; K132-V134 VanDerWaalsContact O-N 3.13Å
133	R	94.2	Very high	94.9	Very high	229 Å²	229	87.2 Å²	87.2	86%	0.864	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	27.7	-177.9	-54.6	-178.7	-178.9	-177.9	-0.8	113.8	Y129 K130 T131	Y129-R133 PolarHBondContact O-N 3.37Å; K130-R133 PolarHBondContact O-N 3.14Å; T131-R133 VanDerWaalsContact C-N 3.27Å; T131-R133 PolarHBondContact O-N 3.41Å
134	V	93.9	Very high	94.5	Very high	63 Å²	63	87.4 Å²	87.4	38%	0.382	43%	0.425	S	S	.	.	S	Bend	trans	-83.2	-35	172.9	178.4	0	0	0	0	110	P85 Y129 K132	P85-V134 HydrophobicContact CG-CG1 3.9Å; Y129-V134 HydrophobicContact CD1-CB 3.83Å; Y129-V134 HydrophobicContact CD1-CG1 3.96Å; Y129-V134 HydrophobicContact CD1-CG2 4.03Å; Y129-V134 HydrophobicContact CG-CB 4.45Å; Y129-V134 PolarHBondContact O-N 3.36Å; K132-V134 HydrophobicContact CB-CG2 4.08Å; K132-V134 PolarHBondContact O-N 3.26Å; K132-V134 VanDerWaalsContact O-N 3.13Å
135	L	93.8	Very high	94.1	Very high	13 Å²	13	85.1 Å²	85.1	7%	0.068	43%	0.425	C	S	.	.	S	Bend	trans	-106.9	149.9	171.2	-66.7	173.7	0	0	0	110	L84 L88 Y129 K130 W139	L84-L135 HydrophobicContact CD2-CD2 3.9Å; L88-L135 HydrophobicContact CD2-CD1 3.64Å; Y129-L135 PolarHBondContact O-N 3.35Å; K130-L135 HydrophobicContact CG-CB 4.26Å; L135-W139 HydrophobicContact CB-CB 4.19Å; L135-W139 HydrophobicContact CB-CG 4.3Å; L135-W139 HydrophobicContact CD1-CD2 3.91Å; L135-W139 HydrophobicContact CD1-CE3 3.97Å; L135-W139 HydrophobicContact CD1-CG 4.29Å; L135-W139 HydrophobicContact CD1-CZ3 4.44Å; L135-W139 HydrophobicContact CD2-CD2 4.4Å; L135-W139 HydrophobicContact CD2-CG 4.23Å
136	A	93.9	Very high	93.6	Very high	49 Å²	49	83 Å²	83	41%	0.405	41%	0.414	S	S	.	.			trans	-60.3	145.6	172.6	0	0	0	0	0	110.9	N138 W139	A136-N138 WeakPolarHBondContact CB-OD1 3.46Å; A136-N138 PolarHBondContact O-N 2.98Å; A136-W139 WeakPolarHBondContact O-CB 3.47Å; A136-W139 PolarHBondContact O-N 3.09Å
137	P	94.1	Very high	92.9	Very high	115 Å²	115	86 Å²	86	75%	0.747	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.8	-178.5	-26.2	34.8	0	0	0	113.6	K130 W139	K130-P137 WeakPolarHBondContact CE-O 3.29Å; K130-P137 PolarHBondContact NZ-O 3.39Å; P137-W139 VanDerWaalsContact C-N 3.31Å; P137-W139 PolarHBondContact O-N 3.31Å
138	N	94.2	Very high	92.2	Very high	140 Å²	140	81.6 Å²	81.6	75%	0.749	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.5	177.9	65.8	-27.4	0	0	0	114.1	A136 K140	A136-N138 WeakPolarHBondContact CB-OD1 3.46Å; A136-N138 PolarHBondContact O-N 2.98Å; N138-K140 PolarHBondContact O-N 3.32Å
139	W	94.5	Very high	91.4	Very high	42 Å²	42	79.2 Å²	79.2	16%	0.159	43%	0.431	C	S	.	.			trans	-58.1	130.8	179.1	-173.1	94	0	0	0	110.7	L84 L88 I92 A126 K130 L135 A136 P137	L84-W139 HydrophobicContact CD2-CZ2 4.1Å; L88-W139 HydrophobicContact CD1-CH2 4.48Å; L88-W139 HydrophobicContact CD2-CH2 3.86Å; L88-W139 HydrophobicContact CD2-CZ2 4.02Å; L88-W139 HydrophobicContact CD2-CZ3 4.41Å; L88-W139 HydrophobicContact CG-CH2 4.42Å; I92-W139 HydrophobicContact CD1-CH2 4.11Å; I92-W139 HydrophobicContact CD1-CZ2 4.11Å; A126-W139 HydrophobicContact CB-CE3 3.93Å; A126-W139 HydrophobicContact CB-CH2 4.37Å; A126-W139 HydrophobicContact CB-CZ3 3.43Å; A126-W139 VanDerWaalsContact CB-CZ3 3.43Å; K130-W139 WeakPolarHBondContact CE-O 3.43Å; K130-W139 PolarHBondContact NZ-O 3Å; L135-W139 HydrophobicContact CB-CB 4.19Å; L135-W139 HydrophobicContact CB-CG 4.3Å; L135-W139 HydrophobicContact CD1-CD2 3.91Å; L135-W139 HydrophobicContact CD1-CE3 3.97Å; L135-W139 HydrophobicContact CD1-CG 4.29Å; L135-W139 HydrophobicContact CD1-CZ3 4.44Å; L135-W139 HydrophobicContact CD2-CD2 4.4Å; L135-W139 HydrophobicContact CD2-CG 4.23Å; A136-W139 WeakPolarHBondContact O-CB 3.47Å; A136-W139 PolarHBondContact O-N 3.09Å; P137-W139 VanDerWaalsContact C-N 3.31Å; P137-W139 PolarHBondContact O-N 3.31Å
140	K	93	Very high	90.6	Very high	140 Å²	140	78 Å²	78	61%	0.609	43%	0.428	S	S	*	.			trans	-137.5	138.5	-179.6	-166.3	174.2	175	-151.3	0	110.2	N138 E142	N138-K140 PolarHBondContact O-N 3.32Å; K140-E142 WeakPolarHBondContact CD-OE1 3.47Å; K140-E142 WeakPolarHBondContact CE-OE1 3.33Å; K140-E142 HydrophobicContact CG-CG 4.44Å; K140-E142 IonicContact NZ-OE1 2.67Å; K140-E142 PolarHBondContact NZ-OE1 3.05Å; K140-E142 PolarHBondContact O-N 3.22Å
141	Y	93	Very high	88.8	Confident	13 Å²	13	81.2 Å²	81.2	5%	0.051	47%	0.467	C	S	.	.			trans	-79.5	116.1	168.5	171.9	-108.8	0	0	0	108.3	I92 A95 E119 I122 H123 A146	I92-Y141 HydrophobicContact CD1-CD2 4.42Å; I92-Y141 HydrophobicContact CG1-CD2 4.08Å; I92-Y141 HydrophobicContact CG1-CE2 4.16Å; I92-Y141 HydrophobicContact CG2-CE2 4.08Å; A95-Y141 WeakPolarHBondContact CB-OH 3.37Å; E119-Y141 HydrophobicContact CG-CE1 3.98Å; I122-Y141 HydrophobicContact CD1-CD2 4.43Å; I122-Y141 HydrophobicContact CD1-CE1 4.34Å; I122-Y141 HydrophobicContact CD1-CE2 4.03Å; I122-Y141 HydrophobicContact CG2-CD1 4.1Å; I122-Y141 HydrophobicContact CG2-CD2 3.92Å; I122-Y141 HydrophobicContact CG2-CG 3.67Å; H123-Y141 AromaticContact CE1-CD1 3.79Å; Y141-A146 HydrophobicContact CD2-CB 4.43Å; Y141-A146 HydrophobicContact CE2-CB 3.71Å
142	E	92.5	Very high	88.4	Confident	74 Å²	74	79.8 Å²	79.8	35%	0.346	46%	0.457	S	S	.	.			trans	-120.5	127.9	173.6	-67.3	-67.1	173.7	0	0	108.5	K140 S144 T145 A146	K140-E142 WeakPolarHBondContact CD-OE1 3.47Å; K140-E142 WeakPolarHBondContact CE-OE1 3.33Å; K140-E142 HydrophobicContact CG-CG 4.44Å; K140-E142 IonicContact NZ-OE1 2.67Å; K140-E142 PolarHBondContact NZ-OE1 3.05Å; K140-E142 PolarHBondContact O-N 3.22Å; E142-S144 PolarHBondContact O-N 3.01Å; E142-T145 PolarHBondContact O-N 2.87Å; E142-T145 PolarHBondContact O-OG1 2.94Å; E142-A146 WeakPolarHBondContact O-CB 3.44Å; E142-A146 PolarHBondContact O-N 3.02Å
143	S	87.2	Confident	88	Confident	45 Å²	45	77.3 Å²	77.3	32%	0.315	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.3	-173.7	57.8	0	0	0	0	113.4
144	S	88.2	Confident	87.6	Confident	94 Å²	94	68.8 Å²	68.8	66%	0.657	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-33.9	-179.8	47.9	0	0	0	0	112.8	E142	E142-S144 PolarHBondContact O-N 3.01Å
145	T	89	Confident	87.3	Confident	75 Å²	75	69.2 Å²	69.2	46%	0.46	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-10.7	-178	62.1	0	0	0	0	113	E142 S147 A148	E142-T145 PolarHBondContact O-N 2.87Å; E142-T145 PolarHBondContact O-OG1 2.94Å; T145-S147 PolarHBondContact O-N 3.16Å; T145-S147 VanDerWaalsContact O-N 3.15Å; T145-A148 PolarHBondContact O-N 3.02Å; T145-A148 VanDerWaalsContact O-N 3.08Å
146	A	85.8	Confident	86.9	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.6	-178.1	0	0	0	0	0	114.4	I92 V96 Y141 E142 L149	I92-A146 HydrophobicContact CG2-CB 3.88Å; V96-A146 HydrophobicContact CG2-CB 3.7Å; Y141-A146 HydrophobicContact CD2-CB 4.43Å; Y141-A146 HydrophobicContact CE2-CB 3.71Å; E142-A146 WeakPolarHBondContact O-CB 3.44Å; E142-A146 PolarHBondContact O-N 3.02Å; A146-L149 PolarHBondContact O-N 3.18Å
147	S	81.9	Confident	86.4	Confident	69 Å²	69	74.3 Å²	74.3	48%	0.483	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.9	176.6	51.6	0	0	0	0	112.4	T145 L149 V150 A151	T145-S147 PolarHBondContact O-N 3.16Å; T145-S147 VanDerWaalsContact O-N 3.15Å; S147-L149 VanDerWaalsContact C-N 3.27Å; S147-L149 PolarHBondContact O-N 3.12Å; S147-V150 PolarHBondContact O-N 3.24Å; S147-A151 PolarHBondContact O-N 3.43Å
148	A	83.9	Confident	85.9	Confident	84 Å²	84	71.4 Å²	71.4	69%	0.694	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.1	178.7	0	0	0	0	0	112.8	T145 V150	T145-A148 PolarHBondContact O-N 3.02Å; T145-A148 VanDerWaalsContact O-N 3.08Å; A148-V150 VanDerWaalsContact C-N 3.32Å
149	L	81.1	Confident	85.2	Confident	71 Å²	71	66.1 Å²	66.1	37%	0.372	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.7	178.5	-64.4	175.1	0	0	0	113.5	L84 A146 S147	L84-L149 HydrophobicContact CD1-CB 4.33Å; A146-L149 PolarHBondContact O-N 3.18Å; S147-L149 VanDerWaalsContact C-N 3.27Å; S147-L149 PolarHBondContact O-N 3.12Å
150	V	79.7	Confident	84.4	Confident	13 Å²	13	68.1 Å²	68.1	8%	0.079	43%	0.434	C	S	.	.			trans	-137	22	-168	-165.1	0	0	0	0	112.8	Y89 I92 K93 S147 A148	Y89-V150 HydrophobicContact CD1-CG1 4.36Å; Y89-V150 HydrophobicContact CD2-CB 4.43Å; Y89-V150 HydrophobicContact CD2-CG1 4Å; Y89-V150 HydrophobicContact CD2-CG2 4.14Å; Y89-V150 HydrophobicContact CE1-CG1 3.87Å; Y89-V150 HydrophobicContact CE2-CB 3.97Å; Y89-V150 HydrophobicContact CE2-CG1 3.48Å; Y89-V150 VanDerWaalsContact CE2-CG1 3.48Å; Y89-V150 HydrophobicContact CE2-CG2 4.17Å; Y89-V150 HydrophobicContact CG-CG1 4.41Å; I92-V150 HydrophobicContact CB-CG2 3.86Å; I92-V150 HydrophobicContact CG2-CG2 3.36Å; K93-V150 HydrophobicContact CB-CG1 3.34Å; K93-V150 HydrophobicContact CD-CG1 3.76Å; K93-V150 HydrophobicContact CG-CG1 3.6Å; S147-V150 PolarHBondContact O-N 3.24Å; A148-V150 VanDerWaalsContact C-N 3.32Å
151	A	58.1	Low	83.7	Confident	139 Å²	139	61.5 Å²	61.5	100%	1.149	42%	0.419	S	S	*	.			trans	-65.9	0	169.3	0	0	0	0	0	111	S147	S147-A151 PolarHBondContact O-N 3.43Å

Retrieved 151 of 151 residues in 103.9 ms (Link to these results)

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