A0A077Z4B3_TRITR Loading...

Ank and Ank 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4B3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 294 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	37.5	Very low	65.5	Low	239 Å²	239	128.8 Å²	128.8	100%	1.177	68%	0.681	S	S	*	*				0	96.7	0	-76.1	167.4	63.8	0	0	107.2	N3	M1-N3 PolarHBondContact O-N 3.17Å; M1-N3 VanDerWaalsContact O-N 3.17Å
2	V	39.7	Very low	67.9	Low	138 Å²	138	121.5 Å²	121.5	84%	0.836	64%	0.641	S	S	*	*			trans	-68.1	112.3	166.5	-177.2	0	0	0	0	104.1	E4	V2-E4 VanDerWaalsContact C-N 3.26Å; V2-E4 PolarHBondContact O-N 2.71Å
3	N	43.3	Very low	70	Confident	145 Å²	145	114 Å²	114	78%	0.775	60%	0.601	S	S	*	*			trans	-63.8	99.7	170.8	-156.8	8.4	0	0	0	104.2	M1 K5	M1-N3 PolarHBondContact O-N 3.17Å; M1-N3 VanDerWaalsContact O-N 3.17Å; N3-K5 PolarHBondContact O-N 2.91Å
4	E	48.3	Very low	71.8	Confident	180 Å²	180	109.4 Å²	109.4	84%	0.841	59%	0.587	S	S	*	*			trans	-58.5	88.9	169.1	-80.6	-179.3	165.8	0	0	105.3	V2 S6	V2-E4 VanDerWaalsContact C-N 3.26Å; V2-E4 PolarHBondContact O-N 2.71Å; E4-S6 PolarHBondContact O-N 2.79Å
5	K	51.6	Low	73.5	Confident	178 Å²	178	109.7 Å²	109.7	77%	0.774	58%	0.583	S	S	*	*			trans	-50.9	114.4	165.8	-81.8	-176.4	171.7	-176	0	104	N3 I7	N3-K5 PolarHBondContact O-N 2.91Å; K5-I7 VanDerWaalsContact C-N 3.32Å; K5-I7 WeakPolarHBondContact O-CG1 3.37Å; K5-I7 PolarHBondContact O-N 2.93Å
6	S	59.9	Low	74.9	Confident	53 Å²	53	102.8 Å²	102.8	37%	0.371	55%	0.547	S	S	.	.			trans	-54.5	103.9	176.8	-162.9	0	0	0	0	106.2	E4 V8 K34	E4-S6 PolarHBondContact O-N 2.79Å; S6-V8 PolarHBondContact O-N 3.33Å; S6-K34 WeakPolarHBondContact OG-CE 3.25Å; S6-K34 PolarHBondContact OG-NZ 3.09Å
7	I	77.5	Confident	76.1	Confident	141 Å²	141	97.9 Å²	97.9	72%	0.723	52%	0.52	S	S	*	.			trans	-72.7	107	-178.7	-58.7	177.8	0	0	0	104.3	K5 T9	K5-I7 VanDerWaalsContact C-N 3.32Å; K5-I7 WeakPolarHBondContact O-CG1 3.37Å; K5-I7 PolarHBondContact O-N 2.93Å; I7-T9 PolarHBondContact O-N 3.43Å
8	V	86.4	Confident	77.3	Confident	34 Å²	34	98.3 Å²	98.3	21%	0.206	52%	0.522	C	S	.	.			trans	-55.9	123.2	169.2	174.1	0	0	0	0	107.3	S6 I13 E36 L37 A40	S6-V8 PolarHBondContact O-N 3.33Å; V8-I13 HydrophobicContact CG1-CD1 3.88Å; V8-I13 HydrophobicContact CG1-CG1 3.57Å; V8-E36 HydrophobicContact CG2-CB 3.61Å; V8-L37 HydrophobicContact CG1-CD2 3.42Å; V8-L37 VanDerWaalsContact CG1-CD2 3.42Å; V8-L37 HydrophobicContact CG1-CG 4.07Å; V8-L37 HydrophobicContact CG2-CD2 4.47Å; V8-L37 HydrophobicContact CG2-CG 4.23Å; V8-A40 HydrophobicContact CG1-CB 4.07Å
9	T	91.5	Very high	78.3	Confident	64 Å²	64	93.5 Å²	93.5	39%	0.393	50%	0.498	S	S	.	.			trans	-90.2	154	-178	66.5	0	0	0	0	111.3	I7 A11 E12 I13	I7-T9 PolarHBondContact O-N 3.43Å; T9-A11 PolarHBondContact O-N 3.03Å; T9-E12 PolarHBondContact N-OE2 2.61Å; T9-E12 PolarHBondContact O-N 3.25Å; T9-E12 VanDerWaalsContact O-N 3.08Å; T9-E12 VanDerWaalsContact OG1-CG 3.24Å; T9-E12 WeakPolarHBondContact OG1-CG 3.16Å; T9-E12 PolarHBondContact OG1-N 3.28Å; T9-E12 PolarHBondContact OG1-OE2 3.01Å; T9-E12 VanDerWaalsContact OG1-OE2 3.14Å; T9-I13 WeakPolarHBondContact O-CG1 3.46Å; T9-I13 PolarHBondContact O-N 3.33Å; T9-I13 VanDerWaalsContact O-N 3.13Å
10	E	91.6	Very high	79.3	Confident	174 Å²	174	88.9 Å²	88.9	81%	0.813	47%	0.473	S	S	*	.	H	α-helix	trans	-57.1	-34.2	175.5	-67.1	178.6	177.4	0	0	112.3	I13 A14	E10-I13 PolarHBondContact O-N 3.34Å; E10-A14 WeakPolarHBondContact O-CB 3.35Å; E10-A14 PolarHBondContact O-N 3.02Å
11	A	93.5	Very high	80.1	Confident	71 Å²	71	89.7 Å²	89.7	59%	0.587	48%	0.477	S	S	*	.	H	α-helix	trans	-65.1	-40.6	176.4	0	0	0	0	0	112.4	T9 I13 A14 E15	T9-A11 PolarHBondContact O-N 3.03Å; A11-I13 VanDerWaalsContact C-N 3.34Å; A11-A14 PolarHBondContact O-N 3.37Å; A11-E15 WeakPolarHBondContact O-CB 3.39Å; A11-E15 PolarHBondContact O-N 3.08Å
12	E	94.3	Very high	82.9	Confident	41 Å²	41	82 Å²	82	19%	0.192	45%	0.446	C	S	.	.	H	α-helix	trans	-67.8	-35.3	176.5	-70.6	169.9	137.4	0	0	111.9	T9 L16 K34 L37	T9-E12 PolarHBondContact N-OE2 2.61Å; T9-E12 PolarHBondContact O-N 3.25Å; T9-E12 VanDerWaalsContact O-N 3.08Å; T9-E12 VanDerWaalsContact OG1-CG 3.24Å; T9-E12 WeakPolarHBondContact OG1-CG 3.16Å; T9-E12 PolarHBondContact OG1-N 3.28Å; T9-E12 PolarHBondContact OG1-OE2 3.01Å; T9-E12 VanDerWaalsContact OG1-OE2 3.14Å; E12-L16 WeakPolarHBondContact O-CB 3.19Å; E12-L16 PolarHBondContact O-N 3.46Å; E12-K34 WeakPolarHBondContact OE1-CE 3.43Å; E12-K34 IonicContact OE1-NZ 2.61Å; E12-K34 PolarHBondContact OE1-NZ 2.95Å; E12-K34 IonicContact OE2-NZ 3.33Å; E12-K34 PolarHBondContact OE2-NZ 3.38Å; E12-L37 HydrophobicContact CB-CD2 4.1Å
13	I	95.2	Very high	85.6	Confident	24 Å²	24	78.2 Å²	78.2	12%	0.123	43%	0.427	C	S	.	.	H	α-helix	trans	-65.8	-48.2	174.5	-61.2	172.1	0	0	0	109.7	V8 T9 E10 A11 E15 L16 F17 L37 A40 D42	V8-I13 HydrophobicContact CG1-CD1 3.88Å; V8-I13 HydrophobicContact CG1-CG1 3.57Å; T9-I13 WeakPolarHBondContact O-CG1 3.46Å; T9-I13 PolarHBondContact O-N 3.33Å; T9-I13 VanDerWaalsContact O-N 3.13Å; E10-I13 PolarHBondContact O-N 3.34Å; A11-I13 VanDerWaalsContact C-N 3.34Å; I13-E15 PolarHBondContact O-N 2.9Å; I13-L16 PolarHBondContact O-N 3.31Å; I13-F17 HydrophobicContact CG2-CD2 3.94Å; I13-F17 HydrophobicContact CG2-CE2 3.93Å; I13-F17 VanDerWaalsContact O-CD2 3.25Å; I13-F17 WeakPolarHBondContact O-CD2 3.39Å; I13-F17 PolarHBondContact O-N 3.08Å; I13-L37 HydrophobicContact CG1-CD2 4.33Å; I13-A40 HydrophobicContact CD1-CB 3.99Å; I13-A40 HydrophobicContact CG1-CB 3.87Å; I13-D42 HydrophobicContact CG2-CB 4.46Å
14	A	95.7	Very high	88.2	Confident	50 Å²	50	74.9 Å²	74.9	41%	0.413	41%	0.409	S	S	.	.	H	α-helix	trans	-58.6	-46.7	177.3	0	0	0	0	0	111.8	E10 A11 L16 F17 D18	E10-A14 WeakPolarHBondContact O-CB 3.35Å; E10-A14 PolarHBondContact O-N 3.02Å; A11-A14 PolarHBondContact O-N 3.37Å; A14-L16 VanDerWaalsContact C-N 3.32Å; A14-L16 PolarHBondContact O-N 3.22Å; A14-F17 PolarHBondContact O-N 2.64Å; A14-D18 PolarHBondContact O-N 3.13Å
15	E	96.1	Very high	90.4	Very high	113 Å²	113	68.7 Å²	68.7	53%	0.528	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-39.8	178	-167	-176.2	172.9	0	0	112	A11 I13 A19 L31	A11-E15 WeakPolarHBondContact O-CB 3.39Å; A11-E15 PolarHBondContact O-N 3.08Å; I13-E15 PolarHBondContact O-N 2.9Å; E15-A19 WeakPolarHBondContact O-CB 3.47Å; E15-A19 PolarHBondContact O-N 3.08Å; E15-L31 HydrophobicContact CB-CD1 4.37Å; E15-L31 VanDerWaalsContact CD-CD2 3.49Å; E15-L31 HydrophobicContact CG-CD1 3.89Å; E15-L31 HydrophobicContact CG-CD2 4.08Å
16	L	96	Very high	92.6	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65	-43.6	175.8	176.4	59.1	0	0	0	111.9	E12 I13 A14 A19 I20 V28 L31 C32 L37 P48	E12-L16 WeakPolarHBondContact O-CB 3.19Å; E12-L16 PolarHBondContact O-N 3.46Å; I13-L16 PolarHBondContact O-N 3.31Å; A14-L16 VanDerWaalsContact C-N 3.32Å; A14-L16 PolarHBondContact O-N 3.22Å; L16-A19 WeakPolarHBondContact O-CB 3.02Å; L16-A19 PolarHBondContact O-N 3.37Å; L16-I20 HydrophobicContact CD1-CD1 4.21Å; L16-I20 HydrophobicContact CD1-CG1 4.47Å; L16-I20 HydrophobicContact CG-CD1 4.16Å; L16-I20 VanDerWaalsContact O-CG1 3.31Å; L16-I20 WeakPolarHBondContact O-CG1 3.24Å; L16-I20 PolarHBondContact O-N 3.28Å; L16-V28 HydrophobicContact CD1-CB 4.31Å; L16-V28 HydrophobicContact CD1-CG1 4Å; L16-V28 HydrophobicContact CD1-CG2 4.21Å; L16-L31 HydrophobicContact CB-CD1 4.35Å; L16-L31 HydrophobicContact CD1-CB 4.33Å; L16-L31 HydrophobicContact CD1-CD1 4.49Å; L16-C32 VanDerWaalsContact CD1-SG 3.59Å; L16-L37 HydrophobicContact CD2-CB 4.09Å; L16-L37 HydrophobicContact CD2-CD2 4.15Å; L16-P48 HydrophobicContact CD2-CB 4.33Å; L16-P48 HydrophobicContact CD2-CG 3.55Å; L16-P48 HydrophobicContact CG-CG 4.33Å
17	F	96.4	Very high	94.3	Very high	20 Å²	20	62 Å²	62	9%	0.088	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-41.2	178	-87.4	-114	0	0	0	111.5	I13 A14 A19 I20 L21 D42 Q46 P48 A51	I13-F17 HydrophobicContact CG2-CD2 3.94Å; I13-F17 HydrophobicContact CG2-CE2 3.93Å; I13-F17 VanDerWaalsContact O-CD2 3.25Å; I13-F17 WeakPolarHBondContact O-CD2 3.39Å; I13-F17 PolarHBondContact O-N 3.08Å; A14-F17 PolarHBondContact O-N 2.64Å; F17-A19 VanDerWaalsContact C-N 3.3Å; F17-A19 PolarHBondContact O-N 3.22Å; F17-I20 PolarHBondContact O-N 2.92Å; F17-I20 VanDerWaalsContact O-N 3.15Å; F17-L21 WeakPolarHBondContact O-CB 3.42Å; F17-L21 VanDerWaalsContact O-CG 3.26Å; F17-L21 WeakPolarHBondContact O-CG 3.09Å; F17-L21 PolarHBondContact O-N 3.16Å; F17-D42 HydrophobicContact CD1-CB 4.41Å; F17-D42 HydrophobicContact CE1-CB 3.95Å; F17-D42 HydrophobicContact CE2-CB 4.34Å; F17-D42 HydrophobicContact CZ-CB 3.92Å; F17-Q46 HydrophobicContact CE1-CB 4.23Å; F17-Q46 HydrophobicContact CZ-CB 4.42Å; F17-Q46 VanDerWaalsContact CZ-O 3.27Å; F17-Q46 WeakPolarHBondContact CZ-O 3.27Å; F17-P48 HydrophobicContact CE2-CG 4.28Å; F17-A51 HydrophobicContact CD1-CB 3.97Å; F17-A51 HydrophobicContact CE1-CB 3.87Å
18	D	96.8	Very high	95.1	Very high	105 Å²	105	55.3 Å²	55.3	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-61.1	-39.6	174	-74.1	-18	0	0	0	111.6	A14 I20 L21 S22	A14-D18 PolarHBondContact O-N 3.13Å; D18-I20 VanDerWaalsContact C-N 3.34Å; D18-I20 PolarHBondContact O-N 3.14Å; D18-L21 PolarHBondContact O-N 3.42Å; D18-S22 VanDerWaalsContact O-CB 3.32Å; D18-S22 WeakPolarHBondContact O-CB 3.45Å; D18-S22 PolarHBondContact O-N 3.35Å; D18-S22 PolarHBondContact O-OG 3.12Å
19	A	97.4	Very high	95.5	Very high	7 Å²	7	57.8 Å²	57.8	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-38.8	174.3	0	0	0	0	0	112.5	E15 L16 F17 S22 S23 N24 A27 V28 L31	E15-A19 WeakPolarHBondContact O-CB 3.47Å; E15-A19 PolarHBondContact O-N 3.08Å; L16-A19 WeakPolarHBondContact O-CB 3.02Å; L16-A19 PolarHBondContact O-N 3.37Å; F17-A19 VanDerWaalsContact C-N 3.3Å; F17-A19 PolarHBondContact O-N 3.22Å; A19-S22 WeakPolarHBondContact CA-OG 3.36Å; A19-S22 PolarHBondContact O-OG 2.88Å; A19-S23 PolarHBondContact O-N 2.97Å; A19-N24 PolarHBondContact O-N 2.8Å; A19-A27 HydrophobicContact CB-CB 3.78Å; A19-V28 HydrophobicContact CB-CG2 3.88Å; A19-L31 HydrophobicContact CB-CD1 4.1Å
20	I	97.4	Very high	95.6	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-70.7	-46.1	176.9	-65.2	165.7	0	0	0	110.9	L16 F17 D18 S22 S23 V28 P48 A51 A52 V55 I60	L16-I20 HydrophobicContact CD1-CD1 4.21Å; L16-I20 HydrophobicContact CD1-CG1 4.47Å; L16-I20 HydrophobicContact CG-CD1 4.16Å; L16-I20 VanDerWaalsContact O-CG1 3.31Å; L16-I20 WeakPolarHBondContact O-CG1 3.24Å; L16-I20 PolarHBondContact O-N 3.28Å; F17-I20 PolarHBondContact O-N 2.92Å; F17-I20 VanDerWaalsContact O-N 3.15Å; D18-I20 VanDerWaalsContact C-N 3.34Å; D18-I20 PolarHBondContact O-N 3.14Å; I20-S22 PolarHBondContact O-N 3.31Å; I20-S23 PolarHBondContact O-N 3Å; I20-V28 HydrophobicContact CG1-CG2 3.61Å; I20-P48 HydrophobicContact CD1-CB 3.63Å; I20-A51 HydrophobicContact CB-CB 4.43Å; I20-A51 HydrophobicContact CD1-CB 4.43Å; I20-A51 HydrophobicContact CG2-CB 3.77Å; I20-A52 HydrophobicContact CG2-CB 4.09Å; I20-V55 HydrophobicContact CG2-CG2 4.5Å; I20-I60 HydrophobicContact CG1-CG2 4.11Å; I20-I60 HydrophobicContact CG2-CG2 4.31Å
21	L	95.7	Very high	95.6	Very high	106 Å²	106	55.2 Å²	55.2	56%	0.555	32%	0.319	S	S	*	.	H	α-helix	trans	-63.6	-26.1	178.7	-69.1	173.5	0	0	0	112.6	F17 D18 V55	F17-L21 WeakPolarHBondContact O-CB 3.42Å; F17-L21 VanDerWaalsContact O-CG 3.26Å; F17-L21 WeakPolarHBondContact O-CG 3.09Å; F17-L21 PolarHBondContact O-N 3.16Å; D18-L21 PolarHBondContact O-N 3.42Å; L21-V55 HydrophobicContact CD2-CG2 3.84Å
22	S	96.8	Very high	95.4	Very high	77 Å²	77	52.4 Å²	52.4	54%	0.538	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	8.3	173.7	59.5	0	0	0	0	114.2	D18 A19 I20 N24	D18-S22 VanDerWaalsContact O-CB 3.32Å; D18-S22 WeakPolarHBondContact O-CB 3.45Å; D18-S22 PolarHBondContact O-N 3.35Å; D18-S22 PolarHBondContact O-OG 3.12Å; A19-S22 WeakPolarHBondContact CA-OG 3.36Å; A19-S22 PolarHBondContact O-OG 2.88Å; I20-S22 PolarHBondContact O-N 3.31Å; S22-N24 PolarHBondContact O-N 3.38Å
23	S	96.8	Very high	94.9	Very high	60 Å²	60	58.7 Å²	58.7	42%	0.42	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	34.1	-179.5	-82.8	0	0	0	0	113.7	A19 I20 L25 D57	A19-S23 PolarHBondContact O-N 2.97Å; I20-S23 PolarHBondContact O-N 3Å; S23-L25 PolarHBondContact O-N 3.1Å; S23-D57 WeakPolarHBondContact CA-OD2 3.35Å; S23-D57 WeakPolarHBondContact CB-OD2 3.4Å; S23-D57 PolarHBondContact OG-OD2 2.85Å
24	N	96.9	Very high	94.4	Very high	75 Å²	75	60.6 Å²	60.6	40%	0.401	33%	0.329	S	S	.	.			trans	-98.3	79.9	-177.6	-169.4	-18.6	0	0	0	111.6	A19 S22 A26 A27 V28	A19-N24 PolarHBondContact O-N 2.8Å; S22-N24 PolarHBondContact O-N 3.38Å; N24-A26 VanDerWaalsContact C-N 3.25Å; N24-A26 PolarHBondContact O-N 2.93Å; N24-A26 PolarHBondContact OD1-N 3.28Å; N24-A27 HydrophobicContact CB-CB 3.99Å; N24-A27 VanDerWaalsContact CG-CB 3.42Å; N24-A27 PolarHBondContact O-N 2.91Å; N24-A27 VanDerWaalsContact O-N 3.09Å; N24-A27 WeakPolarHBondContact OD1-CB 3.42Å; N24-A27 PolarHBondContact OD1-N 3.38Å; N24-V28 WeakPolarHBondContact O-CG2 3.35Å; N24-V28 PolarHBondContact O-N 3.04Å
25	L	96.2	Very high	93.8	Very high	50 Å²	50	66.7 Å²	66.7	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-54.3	-39.6	179.3	178.3	62	0	0	0	113	S23 A27 V28 Q29 P59 I60 W63	S23-L25 PolarHBondContact O-N 3.1Å; L25-A27 VanDerWaalsContact C-N 3.34Å; L25-A27 PolarHBondContact O-N 3.15Å; L25-V28 PolarHBondContact O-N 3.37Å; L25-Q29 HydrophobicContact CD1-CG 4.09Å; L25-Q29 HydrophobicContact CG-CG 4.34Å; L25-Q29 WeakPolarHBondContact O-CB 3.35Å; L25-Q29 VanDerWaalsContact O-CG 3.27Å; L25-Q29 WeakPolarHBondContact O-CG 3.34Å; L25-Q29 PolarHBondContact O-N 2.94Å; L25-P59 HydrophobicContact CD2-CB 4.08Å; L25-I60 HydrophobicContact CB-CG1 3.97Å; L25-I60 HydrophobicContact CD1-CG1 3.88Å; L25-W63 HydrophobicContact CD1-CB 4.02Å; L25-W63 HydrophobicContact CD1-CG 4.12Å
26	A	96.2	Very high	93.5	Very high	66 Å²	66	65.8 Å²	65.8	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-64.8	-39	-179.9	0	0	0	0	0	112	N24 K30	N24-A26 VanDerWaalsContact C-N 3.25Å; N24-A26 PolarHBondContact O-N 2.93Å; N24-A26 PolarHBondContact OD1-N 3.28Å; A26-K30 WeakPolarHBondContact O-CB 3.21Å; A26-K30 PolarHBondContact O-N 3.41Å
27	A	95.8	Very high	93.3	Very high	25 Å²	25	65.9 Å²	65.9	21%	0.207	34%	0.343	C	S	.	.	H	α-helix	trans	-67.1	-44.4	173.8	0	0	0	0	0	111.4	A19 N24 L25 Q29 K30 L31	A19-A27 HydrophobicContact CB-CB 3.78Å; N24-A27 HydrophobicContact CB-CB 3.99Å; N24-A27 VanDerWaalsContact CG-CB 3.42Å; N24-A27 PolarHBondContact O-N 2.91Å; N24-A27 VanDerWaalsContact O-N 3.09Å; N24-A27 WeakPolarHBondContact OD1-CB 3.42Å; N24-A27 PolarHBondContact OD1-N 3.38Å; L25-A27 VanDerWaalsContact C-N 3.34Å; L25-A27 PolarHBondContact O-N 3.15Å; A27-Q29 PolarHBondContact O-N 2.93Å; A27-K30 PolarHBondContact O-N 2.96Å; A27-K30 VanDerWaalsContact O-N 3.15Å; A27-L31 WeakPolarHBondContact O-CB 3.23Å; A27-L31 VanDerWaalsContact O-CG 3.27Å; A27-L31 WeakPolarHBondContact O-CG 3.47Å; A27-L31 PolarHBondContact O-N 3.45Å
28	V	95.4	Very high	93.1	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-54.9	-50.3	174.9	172.1	0	0	0	0	111.1	L16 A19 I20 N24 L25 K30 L31 C32 I60 W63	L16-V28 HydrophobicContact CD1-CB 4.31Å; L16-V28 HydrophobicContact CD1-CG1 4Å; L16-V28 HydrophobicContact CD1-CG2 4.21Å; A19-V28 HydrophobicContact CB-CG2 3.88Å; I20-V28 HydrophobicContact CG1-CG2 3.61Å; N24-V28 WeakPolarHBondContact O-CG2 3.35Å; N24-V28 PolarHBondContact O-N 3.04Å; L25-V28 PolarHBondContact O-N 3.37Å; V28-K30 VanDerWaalsContact C-N 3.32Å; V28-K30 PolarHBondContact O-N 3.24Å; V28-L31 PolarHBondContact O-N 3.36Å; V28-C32 WeakPolarHBondContact O-CB 3.27Å; V28-C32 PolarHBondContact O-N 3.02Å; V28-I60 HydrophobicContact CG1-CG2 4.46Å; V28-I60 HydrophobicContact CG2-CD1 4.34Å; V28-I60 HydrophobicContact CG2-CG2 4.4Å; V28-W63 HydrophobicContact CG1-CE3 4.01Å; V28-W63 HydrophobicContact CG1-CZ3 4.08Å
29	Q	94.6	Very high	93	Very high	85 Å²	85	63.2 Å²	63.2	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-37.9	178.4	-73	176.5	-15.4	0	0	112.8	L25 A27 W63	L25-Q29 HydrophobicContact CD1-CG 4.09Å; L25-Q29 HydrophobicContact CG-CG 4.34Å; L25-Q29 WeakPolarHBondContact O-CB 3.35Å; L25-Q29 VanDerWaalsContact O-CG 3.27Å; L25-Q29 WeakPolarHBondContact O-CG 3.34Å; L25-Q29 PolarHBondContact O-N 2.94Å; A27-Q29 PolarHBondContact O-N 2.93Å; Q29-W63 HydrophobicContact CG-CD2 4.16Å; Q29-W63 HydrophobicContact CG-CG 4.42Å; Q29-W63 HydrophobicContact CG-CZ2 4.08Å
30	K	93.6	Very high	92.9	Very high	154 Å²	154	63.5 Å²	63.5	67%	0.67	34%	0.336	S	S	*	.	H	α-helix	trans	-67.9	-42.2	177.9	-176.7	-174.9	173.7	-167.2	0	111.5	A26 A27 V28 K33	A26-K30 WeakPolarHBondContact O-CB 3.21Å; A26-K30 PolarHBondContact O-N 3.41Å; A27-K30 PolarHBondContact O-N 2.96Å; A27-K30 VanDerWaalsContact O-N 3.15Å; V28-K30 VanDerWaalsContact C-N 3.32Å; V28-K30 PolarHBondContact O-N 3.24Å; K30-K33 WeakPolarHBondContact O-CG 3.25Å
31	L	91.8	Very high	92.8	Very high	30 Å²	30	67.3 Å²	67.3	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-71.3	-45.9	-178.2	-69.6	165.9	0	0	0	111.2	E15 L16 A19 A27 V28 K33 L37	E15-L31 HydrophobicContact CB-CD1 4.37Å; E15-L31 VanDerWaalsContact CD-CD2 3.49Å; E15-L31 HydrophobicContact CG-CD1 3.89Å; E15-L31 HydrophobicContact CG-CD2 4.08Å; L16-L31 HydrophobicContact CB-CD1 4.35Å; L16-L31 HydrophobicContact CD1-CB 4.33Å; L16-L31 HydrophobicContact CD1-CD1 4.49Å; A19-L31 HydrophobicContact CB-CD1 4.1Å; A27-L31 WeakPolarHBondContact O-CB 3.23Å; A27-L31 VanDerWaalsContact O-CG 3.27Å; A27-L31 WeakPolarHBondContact O-CG 3.47Å; A27-L31 PolarHBondContact O-N 3.45Å; V28-L31 PolarHBondContact O-N 3.36Å; L31-K33 PolarHBondContact O-N 2.98Å; L31-L37 WeakPolarHBondContact O-CD1 3.5Å
32	C	88.4	Confident	92.7	Very high	12 Å²	12	63.9 Å²	63.9	8%	0.081	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	18	-178.9	-69.1	0	0	0	0	115.1	L16 V28 K34 W63	L16-C32 VanDerWaalsContact CD1-SG 3.59Å; V28-C32 WeakPolarHBondContact O-CB 3.27Å; V28-C32 PolarHBondContact O-N 3.02Å; C32-K34 PolarHBondContact O-N 2.93Å; C32-W63 HydrophobicContact CB-CH2 3.35Å; C32-W63 HydrophobicContact CB-CZ2 4.49Å; C32-W63 HydrophobicContact CB-CZ3 3.7Å
33	K	83.6	Confident	92.6	Very high	173 Å²	173	66 Å²	66	75%	0.752	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.2	165.8	-77	-179.5	177	-177.6	0	112.2	K30 L31 K35	K30-K33 WeakPolarHBondContact O-CG 3.25Å; L31-K33 PolarHBondContact O-N 2.98Å; K33-K35 PolarHBondContact O-N 3.38Å
34	K	84.9	Confident	92.5	Very high	64 Å²	64	66.7 Å²	66.7	28%	0.278	35%	0.35	S	S	.	.	S	Bend	trans	-80	107.6	163.8	-62.5	-179.2	175.6	-173.8	0	107.7	S6 E12 C32 E36 L37	S6-K34 WeakPolarHBondContact OG-CE 3.25Å; S6-K34 PolarHBondContact OG-NZ 3.09Å; E12-K34 WeakPolarHBondContact OE1-CE 3.43Å; E12-K34 IonicContact OE1-NZ 2.61Å; E12-K34 PolarHBondContact OE1-NZ 2.95Å; E12-K34 IonicContact OE2-NZ 3.33Å; E12-K34 PolarHBondContact OE2-NZ 3.38Å; C32-K34 PolarHBondContact O-N 2.93Å; K34-E36 PolarHBondContact O-N 3.43Å; K34-E36 VanDerWaalsContact O-N 3.08Å; K34-L37 HydrophobicContact CB-CD1 4.09Å; K34-L37 HydrophobicContact CB-CG 4.37Å; K34-L37 HydrophobicContact CD-CD1 4.47Å; K34-L37 WeakPolarHBondContact O-CB 3.46Å; K34-L37 PolarHBondContact O-N 3.08Å
35	K	84.1	Confident	92.5	Very high	178 Å²	178	63.7 Å²	63.7	77%	0.774	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-57.7	-27.4	-176.1	-73.2	-168.9	174.4	-169.5	0	112.4	K33 L37 I38	K33-K35 PolarHBondContact O-N 3.38Å; K35-L37 PolarHBondContact O-N 3.4Å; K35-I38 WeakPolarHBondContact O-CG2 3.37Å; K35-I38 PolarHBondContact O-N 3.05Å
36	E	88.2	Confident	92.6	Very high	94 Å²	94	62.7 Å²	62.7	44%	0.439	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-63	-26.2	178.5	-60.6	82.1	180	0	0	113.1	V8 K34 I38 S39 A40	V8-E36 HydrophobicContact CG2-CB 3.61Å; K34-E36 PolarHBondContact O-N 3.43Å; K34-E36 VanDerWaalsContact O-N 3.08Å; E36-I38 VanDerWaalsContact C-N 3.28Å; E36-I38 PolarHBondContact O-N 3.34Å; E36-S39 PolarHBondContact O-N 2.9Å; E36-S39 PolarHBondContact O-OG 2.6Å; E36-A40 PolarHBondContact O-N 2.92Å
37	L	92.1	Very high	92.6	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.01	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-65.8	-28.7	179.7	-87.1	167	0	0	0	113	V8 E12 I13 L16 L31 K34 K35 S39 A40 P48	V8-L37 HydrophobicContact CG1-CD2 3.42Å; V8-L37 VanDerWaalsContact CG1-CD2 3.42Å; V8-L37 HydrophobicContact CG1-CG 4.07Å; V8-L37 HydrophobicContact CG2-CD2 4.47Å; V8-L37 HydrophobicContact CG2-CG 4.23Å; E12-L37 HydrophobicContact CB-CD2 4.1Å; I13-L37 HydrophobicContact CG1-CD2 4.33Å; L16-L37 HydrophobicContact CD2-CB 4.09Å; L16-L37 HydrophobicContact CD2-CD2 4.15Å; L31-L37 WeakPolarHBondContact O-CD1 3.5Å; K34-L37 HydrophobicContact CB-CD1 4.09Å; K34-L37 HydrophobicContact CB-CG 4.37Å; K34-L37 HydrophobicContact CD-CD1 4.47Å; K34-L37 WeakPolarHBondContact O-CB 3.46Å; K34-L37 PolarHBondContact O-N 3.08Å; K35-L37 PolarHBondContact O-N 3.4Å; L37-S39 PolarHBondContact O-N 3.42Å; L37-A40 HydrophobicContact CD2-CB 4.34Å; L37-A40 WeakPolarHBondContact O-CB 3.48Å; L37-A40 PolarHBondContact O-N 3.47Å; L37-A40 VanDerWaalsContact O-N 3.08Å; L37-P48 WeakPolarHBondContact O-CG 3.3Å
38	I	93.2	Very high	92.7	Very high	13 Å²	13	58.3 Å²	58.3	7%	0.067	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-65.5	-26	-178.1	-160.2	52	0	0	0	112.9	K35 E36 P48 W63 C64 A69	K35-I38 WeakPolarHBondContact O-CG2 3.37Å; K35-I38 PolarHBondContact O-N 3.05Å; E36-I38 VanDerWaalsContact C-N 3.28Å; E36-I38 PolarHBondContact O-N 3.34Å; I38-P48 HydrophobicContact CD1-CB 4.46Å; I38-W63 HydrophobicContact CD1-CZ3 3.97Å; I38-C64 HydrophobicContact CD1-CB 3.9Å; I38-A69 HydrophobicContact CD1-CB 4.24Å; I38-A69 HydrophobicContact CG1-CB 3.88Å
39	S	94.2	Very high	92.8	Very high	57 Å²	57	58.3 Å²	58.3	40%	0.399	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-104.6	2.8	177.4	55.3	0	0	0	0	113.2	E36 L37	E36-S39 PolarHBondContact O-N 2.9Å; E36-S39 PolarHBondContact O-OG 2.6Å; L37-S39 PolarHBondContact O-N 3.42Å
40	A	94.6	Very high	93	Very high	12 Å²	12	54.3 Å²	54.3	10%	0.099	28%	0.276	C	S	.	.			trans	-67.4	154.8	-179.6	0	0	0	0	0	111.1	V8 I13 E36 L37 T47 P48	V8-A40 HydrophobicContact CG1-CB 4.07Å; I13-A40 HydrophobicContact CD1-CB 3.99Å; I13-A40 HydrophobicContact CG1-CB 3.87Å; E36-A40 PolarHBondContact O-N 2.92Å; L37-A40 HydrophobicContact CD2-CB 4.34Å; L37-A40 WeakPolarHBondContact O-CB 3.48Å; L37-A40 PolarHBondContact O-N 3.47Å; L37-A40 VanDerWaalsContact O-N 3.08Å; A40-T47 WeakPolarHBondContact O-CA 3.47Å; A40-P48 VanDerWaalsContact O-CD 3.23Å; A40-P48 WeakPolarHBondContact O-CD 3.21Å
41	E	95.1	Very high	93.2	Very high	80 Å²	80	47.3 Å²	47.3	37%	0.374	25%	0.247	S	C	.	.			trans	-121.5	134.6	-173.9	-68.1	173.5	-126	0	0	110	Q46 T47 K73	E41-Q46 CarbonylContact C-O 3.6Å; E41-Q46 VanDerWaalsContact CA-O 3.25Å; E41-Q46 WeakPolarHBondContact CA-O 3.11Å; E41-T47 HydrophobicContact CG-CG2 4.26Å; E41-K73 VanDerWaalsContact CD-NZ 3.27Å; E41-K73 WeakPolarHBondContact OE1-CE 3.3Å; E41-K73 IonicContact OE1-NZ 2.64Å; E41-K73 PolarHBondContact OE1-NZ 3.25Å; E41-K73 WeakPolarHBondContact OE2-CE 3.5Å; E41-K73 IonicContact OE2-NZ 3.28Å; E41-K73 PolarHBondContact OE2-NZ 2.86Å
42	D	95	Very high	93.5	Very high	34 Å²	34	45.9 Å²	45.9	18%	0.182	24%	0.239	C	C	.	.			trans	-72	-177.1	168.5	81.3	-15.6	0	0	0	111.4	I13 F17 N44 G45 Q46	I13-D42 HydrophobicContact CG2-CB 4.46Å; F17-D42 HydrophobicContact CD1-CB 4.41Å; F17-D42 HydrophobicContact CE1-CB 3.95Å; F17-D42 HydrophobicContact CE2-CB 4.34Å; F17-D42 HydrophobicContact CZ-CB 3.92Å; D42-N44 PolarHBondContact O-N 3.03Å; D42-N44 VanDerWaalsContact O-N 3.09Å; D42-N44 VanDerWaalsContact OD1-CA 3.31Å; D42-N44 WeakPolarHBondContact OD1-CA 3.01Å; D42-N44 WeakPolarHBondContact OD1-CB 3.41Å; D42-N44 PolarHBondContact OD1-N 3.1Å; D42-N44 PolarHBondContact OD2-ND2 2.96Å; D42-G45 PolarHBondContact O-N 3.29Å; D42-G45 PolarHBondContact OD1-N 3.18Å; D42-G45 VanDerWaalsContact OD1-N 3.08Å; D42-Q46 PolarHBondContact N-O 3Å; D42-Q46 WeakPolarHBondContact OD1-CA 3.44Å; D42-Q46 WeakPolarHBondContact OD1-CB 3.19Å; D42-Q46 PolarHBondContact OD1-N 2.9Å
43	S	94.4	Very high	94	Very high	121 Å²	121	45.3 Å²	45.3	85%	0.846	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.1	178.1	57.2	0	0	0	0	114.4
44	N	95.2	Very high	94.6	Very high	75 Å²	75	40.4 Å²	40.4	40%	0.401	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	4.3	175.7	-59	-61.5	0	0	0	112.5	D42 Q46 C76	D42-N44 PolarHBondContact O-N 3.03Å; D42-N44 VanDerWaalsContact O-N 3.09Å; D42-N44 VanDerWaalsContact OD1-CA 3.31Å; D42-N44 WeakPolarHBondContact OD1-CA 3.01Å; D42-N44 WeakPolarHBondContact OD1-CB 3.41Å; D42-N44 PolarHBondContact OD1-N 3.1Å; D42-N44 PolarHBondContact OD2-ND2 2.96Å; N44-Q46 HydrophobicContact CB-CG 4.01Å; N44-Q46 PolarHBondContact O-N 3.39Å; N44-C76 VanDerWaalsContact O-CB 3.25Å; N44-C76 WeakPolarHBondContact O-CB 3.35Å; N44-C76 PolarHBondContact O-N 3.14Å; N44-C76 PolarHBondContact O-SG 3.38Å
45	G	96.1	Very high	95.2	Very high	12 Å²	12	39.8 Å²	39.8	12%	0.124	22%	0.216	C	C	.	.	S	Bend	trans	74.6	12.9	-175.1	0	0	0	0	0	113.6	D42 D75	D42-G45 PolarHBondContact O-N 3.29Å; D42-G45 PolarHBondContact OD1-N 3.18Å; D42-G45 VanDerWaalsContact OD1-N 3.08Å; G45-D75 WeakPolarHBondContact O-CA 3.26Å
46	Q	97.5	Very high	95.8	Very high	29 Å²	29	32.5 Å²	32.5	14%	0.136	19%	0.191	C	C	.	.			trans	-80.4	139.9	178.1	-58.8	-167.4	-85	0	0	109.7	F17 E41 D42 N44 H50 D75 R84	F17-Q46 HydrophobicContact CE1-CB 4.23Å; F17-Q46 HydrophobicContact CZ-CB 4.42Å; F17-Q46 VanDerWaalsContact CZ-O 3.27Å; F17-Q46 WeakPolarHBondContact CZ-O 3.27Å; E41-Q46 CarbonylContact C-O 3.6Å; E41-Q46 VanDerWaalsContact CA-O 3.25Å; E41-Q46 WeakPolarHBondContact CA-O 3.11Å; D42-Q46 PolarHBondContact N-O 3Å; D42-Q46 WeakPolarHBondContact OD1-CA 3.44Å; D42-Q46 WeakPolarHBondContact OD1-CB 3.19Å; D42-Q46 PolarHBondContact OD1-N 2.9Å; N44-Q46 HydrophobicContact CB-CG 4.01Å; N44-Q46 PolarHBondContact O-N 3.39Å; Q46-H50 HydrophobicContact CB-CB 3.93Å; Q46-H50 HydrophobicContact CG-CB 4.44Å; Q46-D75 HydrophobicContact CG-CB 3.92Å; Q46-R84 VanDerWaalsContact NE2-NH2 3.19Å
47	T	97.6	Very high	96.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.177	C	C	.	.			trans	-92.3	165.2	172.4	65.2	0	0	0	0	111.3	A40 E41 L49 H50 A51 P70 K73	A40-T47 WeakPolarHBondContact O-CA 3.47Å; E41-T47 HydrophobicContact CG-CG2 4.26Å; T47-L49 PolarHBondContact O-N 3.41Å; T47-L49 VanDerWaalsContact O-N 3.11Å; T47-H50 PolarHBondContact N-ND1 3.02Å; T47-H50 VanDerWaalsContact N-ND1 3.1Å; T47-H50 VanDerWaalsContact O-CB 3.32Å; T47-H50 WeakPolarHBondContact O-CB 3.49Å; T47-H50 PolarHBondContact O-N 2.89Å; T47-H50 PolarHBondContact OG1-ND1 3.45Å; T47-A51 PolarHBondContact O-N 2.9Å; T47-P70 HydrophobicContact CG2-CG 4.11Å; T47-K73 HydrophobicContact CG2-CB 4.1Å; T47-K73 HydrophobicContact CG2-CG 3.68Å
48	P	97.4	Very high	96.5	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-46.5	-40.2	169.7	-34.7	38.8	0	0	0	113.6	L16 F17 I20 L37 I38 A40 H50 A51 A52	L16-P48 HydrophobicContact CD2-CB 4.33Å; L16-P48 HydrophobicContact CD2-CG 3.55Å; L16-P48 HydrophobicContact CG-CG 4.33Å; F17-P48 HydrophobicContact CE2-CG 4.28Å; I20-P48 HydrophobicContact CD1-CB 3.63Å; L37-P48 WeakPolarHBondContact O-CG 3.3Å; I38-P48 HydrophobicContact CD1-CB 4.46Å; A40-P48 VanDerWaalsContact O-CD 3.23Å; A40-P48 WeakPolarHBondContact O-CD 3.21Å; P48-H50 VanDerWaalsContact C-N 3.35Å; P48-H50 PolarHBondContact O-N 3.28Å; P48-A51 PolarHBondContact O-N 3.07Å; P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 3.32Å
49	L	98	Very high	96.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-31.8	178.5	-175.2	58.2	0	0	0	112.9	T47 A53 A61 C64 I65 A69 L71 P81 L97	T47-L49 PolarHBondContact O-N 3.41Å; T47-L49 VanDerWaalsContact O-N 3.11Å; L49-A53 WeakPolarHBondContact O-CB 3.34Å; L49-A53 PolarHBondContact O-N 2.92Å; L49-A61 HydrophobicContact CD1-CB 4.34Å; L49-C64 HydrophobicContact CB-CB 4.4Å; L49-C64 HydrophobicContact CD1-CB 4.08Å; L49-I65 HydrophobicContact CD1-CD1 4.21Å; L49-I65 HydrophobicContact CD1-CG1 3.81Å; L49-I65 HydrophobicContact CD2-CG1 4.07Å; L49-A69 HydrophobicContact CB-CB 3.93Å; L49-A69 HydrophobicContact CD2-CB 3.84Å; L49-A69 HydrophobicContact CG-CB 4.43Å; L49-L71 HydrophobicContact CD2-CD2 3.75Å; L49-P81 HydrophobicContact CB-CB 4.48Å; L49-P81 HydrophobicContact CB-CG 4.17Å; L49-P81 HydrophobicContact CD2-CB 4.19Å; L49-P81 HydrophobicContact CD2-CG 3.99Å; L49-P81 HydrophobicContact CG-CB 3.76Å; L49-P81 HydrophobicContact CG-CG 3.82Å; L49-L97 HydrophobicContact CD2-CD2 3.99Å
50	H	98.2	Very high	96.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-43.4	171.3	-72.2	83.2	0	0	0	111.6	Q46 T47 P48 F54 K73 L79 P81 R84	Q46-H50 HydrophobicContact CB-CB 3.93Å; Q46-H50 HydrophobicContact CG-CB 4.44Å; T47-H50 PolarHBondContact N-ND1 3.02Å; T47-H50 VanDerWaalsContact N-ND1 3.1Å; T47-H50 VanDerWaalsContact O-CB 3.32Å; T47-H50 WeakPolarHBondContact O-CB 3.49Å; T47-H50 PolarHBondContact O-N 2.89Å; T47-H50 PolarHBondContact OG1-ND1 3.45Å; P48-H50 VanDerWaalsContact C-N 3.35Å; P48-H50 PolarHBondContact O-N 3.28Å; H50-F54 WeakPolarHBondContact O-CB 3.46Å; H50-F54 PolarHBondContact O-N 3.23Å; H50-K73 PolarHBondContact CE1-O 3.38Å; H50-K73 PolarHBondContact NE2-O 2.71Å; H50-L79 PolarHBondContact NE2-O 3.09Å; H50-P81 VanDerWaalsContact CE1-CD 3.49Å; H50-P81 WeakPolarHBondContact CE1-CD 3.37Å; H50-P81 WeakPolarHBondContact NE2-CD 3.08Å; H50-R84 HydrophobicContact CB-CG 4.45Å
51	A	97.5	Very high	97.1	Very high	7 Å²	7	31.2 Å²	31.2	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-48.6	178.5	0	0	0	0	0	110.6	F17 I20 T47 P48 A53 F54 V55	F17-A51 HydrophobicContact CD1-CB 3.97Å; F17-A51 HydrophobicContact CE1-CB 3.87Å; I20-A51 HydrophobicContact CB-CB 4.43Å; I20-A51 HydrophobicContact CD1-CB 4.43Å; I20-A51 HydrophobicContact CG2-CB 3.77Å; T47-A51 PolarHBondContact O-N 2.9Å; P48-A51 PolarHBondContact O-N 3.07Å; A51-A53 PolarHBondContact O-N 3.2Å; A51-F54 PolarHBondContact O-N 3.1Å; A51-F54 VanDerWaalsContact O-N 3.17Å; A51-V55 WeakPolarHBondContact O-CG2 3.27Å; A51-V55 PolarHBondContact O-N 3.01Å
52	A	98.1	Very high	97.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-43.9	178.2	0	0	0	0	0	112	I20 P48 F54 V55 G56 I60 A61	I20-A52 HydrophobicContact CG2-CB 4.09Å; P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 3.32Å; A52-F54 VanDerWaalsContact C-N 3.33Å; A52-F54 PolarHBondContact O-N 3.23Å; A52-V55 PolarHBondContact O-N 3.45Å; A52-G56 PolarHBondContact O-N 2.78Å; A52-I60 HydrophobicContact CB-CB 4.45Å; A52-I60 HydrophobicContact CB-CG2 3.79Å; A52-A61 HydrophobicContact CB-CB 3.98Å
53	A	98.3	Very high	97.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-36.8	176	0	0	0	0	0	113.1	L49 A51 P81 R84 A85 N90 I93	L49-A53 WeakPolarHBondContact O-CB 3.34Å; L49-A53 PolarHBondContact O-N 2.92Å; A51-A53 PolarHBondContact O-N 3.2Å; A53-P81 HydrophobicContact CB-CB 4.08Å; A53-P81 WeakPolarHBondContact CB-O 3.31Å; A53-R84 HydrophobicContact CB-CB 4.09Å; A53-A85 HydrophobicContact CB-CB 4.04Å; A53-A85 WeakPolarHBondContact O-CA 3.49Å; A53-N90 PolarHBondContact O-ND2 3.22Å; A53-I93 HydrophobicContact CB-CG2 4.23Å
54	F	97.3	Very high	97.4	Very high	71 Å²	71	26 Å²	26	31%	0.311	14%	0.141	S	C	.	.	H	α-helix	trans	-73.8	-43.9	175.9	-177.6	-105.3	0	0	0	112.4	H50 A51 A52 G56 R84 Q88	H50-F54 WeakPolarHBondContact O-CB 3.46Å; H50-F54 PolarHBondContact O-N 3.23Å; A51-F54 PolarHBondContact O-N 3.1Å; A51-F54 VanDerWaalsContact O-N 3.17Å; A52-F54 VanDerWaalsContact C-N 3.33Å; A52-F54 PolarHBondContact O-N 3.23Å; F54-G56 VanDerWaalsContact C-N 3.25Å; F54-G56 PolarHBondContact O-N 3.01Å; F54-R84 HydrophobicContact CB-CB 4.09Å; F54-Q88 HydrophobicContact CD2-CG 3.69Å; F54-Q88 HydrophobicContact CE2-CG 3.83Å; F54-Q88 HydrophobicContact CG-CG 4.47Å; F54-Q88 WeakPolarHBondContact O-CG 3.49Å
55	V	97.3	Very high	97.5	Very high	51 Å²	51	22.8 Å²	22.8	31%	0.309	12%	0.124	S	C	.	.	H	α-helix	trans	-63.2	-36.8	176.8	172.8	0	0	0	0	110.6	I20 L21 A51 A52 D57	I20-V55 HydrophobicContact CG2-CG2 4.5Å; L21-V55 HydrophobicContact CD2-CG2 3.84Å; A51-V55 WeakPolarHBondContact O-CG2 3.27Å; A51-V55 PolarHBondContact O-N 3.01Å; A52-V55 PolarHBondContact O-N 3.45Å; V55-D57 HydrophobicContact CG1-CB 4.14Å
56	G	96.8	Very high	97.5	Very high	24 Å²	24	26.5 Å²	26.5	25%	0.247	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	14.4	-177.8	0	0	0	0	0	114.3	A52 F54 F58 N90	A52-G56 PolarHBondContact O-N 2.78Å; F54-G56 VanDerWaalsContact C-N 3.25Å; F54-G56 PolarHBondContact O-N 3.01Å; G56-F58 PolarHBondContact O-N 3.1Å; G56-N90 VanDerWaalsContact CA-CG 3.4Å; G56-N90 WeakPolarHBondContact CA-ND2 3.47Å; G56-N90 PolarHBondContact N-ND2 3.44Å
57	D	96.8	Very high	97.4	Very high	28 Å²	28	29 Å²	29	15%	0.15	16%	0.155	C	C	.	.			trans	-75.3	96	173.2	-167.4	-46.7	0	0	0	109.3	S23 V55 P59 I60 A61	S23-D57 WeakPolarHBondContact CA-OD2 3.35Å; S23-D57 WeakPolarHBondContact CB-OD2 3.4Å; S23-D57 PolarHBondContact OG-OD2 2.85Å; V55-D57 HydrophobicContact CG1-CB 4.14Å; D57-P59 VanDerWaalsContact OD1-CD 3.23Å; D57-P59 WeakPolarHBondContact OD1-CD 3.49Å; D57-I60 HydrophobicContact CB-CB 4.15Å; D57-I60 HydrophobicContact CB-CD1 4.13Å; D57-I60 HydrophobicContact CB-CG1 4.29Å; D57-I60 PolarHBondContact O-N 3.11Å; D57-I60 WeakPolarHBondContact OD1-CG1 3.48Å; D57-I60 PolarHBondContact OD1-N 2.87Å; D57-I60 VanDerWaalsContact OD1-N 3.13Å; D57-I60 WeakPolarHBondContact OD2-CD1 3.32Å; D57-A61 WeakPolarHBondContact O-CB 3.31Å; D57-A61 PolarHBondContact O-N 3.19Å
58	F	98.1	Very high	97.3	Very high	59 Å²	59	31.6 Å²	31.6	26%	0.259	18%	0.182	S	C	.	.	H	α-helix	trans	-57.9	-49.9	-177.4	175.9	-92.8	0	0	0	112.7	G56 I60 A61 E62 F92 I93 T96	G56-F58 PolarHBondContact O-N 3.1Å; F58-I60 VanDerWaalsContact C-N 3.29Å; F58-I60 PolarHBondContact O-N 3.44Å; F58-A61 PolarHBondContact O-N 2.89Å; F58-A61 VanDerWaalsContact O-N 3.11Å; F58-E62 HydrophobicContact CE1-CB 4.16Å; F58-E62 HydrophobicContact CE1-CG 4.42Å; F58-E62 HydrophobicContact CZ-CB 4.18Å; F58-E62 HydrophobicContact CZ-CG 4.35Å; F58-E62 VanDerWaalsContact O-CB 3.31Å; F58-E62 WeakPolarHBondContact O-CB 3.43Å; F58-E62 PolarHBondContact O-N 3.28Å; F58-F92 HydrophobicContact CD2-CB 3.5Å; F58-F92 VanDerWaalsContact CD2-CB 3.5Å; F58-F92 HydrophobicContact CE2-CB 3.79Å; F58-F92 HydrophobicContact CG-CB 4.27Å; F58-I93 HydrophobicContact CB-CG1 4.47Å; F58-I93 HydrophobicContact CD2-CG1 4.06Å; F58-T96 WeakPolarHBondContact CE2-OG1 3.39Å
59	P	98.1	Very high	97.2	Very high	64 Å²	64	31.8 Å²	31.8	42%	0.416	18%	0.184	S	C	.	.	H	α-helix	trans	-53.3	-40.9	175.6	-29.1	34.4	0	0	0	114.5	L25 D57 W63	L25-P59 HydrophobicContact CD2-CB 4.08Å; D57-P59 VanDerWaalsContact OD1-CD 3.23Å; D57-P59 WeakPolarHBondContact OD1-CD 3.49Å; P59-W63 WeakPolarHBondContact O-CB 3.48Å; P59-W63 PolarHBondContact O-N 3.03Å
60	I	98.1	Very high	97.2	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-44.1	176.7	-65.6	177	0	0	0	111	I20 L25 V28 A52 D57 F58 W63 C64	I20-I60 HydrophobicContact CG1-CG2 4.11Å; I20-I60 HydrophobicContact CG2-CG2 4.31Å; L25-I60 HydrophobicContact CB-CG1 3.97Å; L25-I60 HydrophobicContact CD1-CG1 3.88Å; V28-I60 HydrophobicContact CG1-CG2 4.46Å; V28-I60 HydrophobicContact CG2-CD1 4.34Å; V28-I60 HydrophobicContact CG2-CG2 4.4Å; A52-I60 HydrophobicContact CB-CB 4.45Å; A52-I60 HydrophobicContact CB-CG2 3.79Å; D57-I60 HydrophobicContact CB-CB 4.15Å; D57-I60 HydrophobicContact CB-CD1 4.13Å; D57-I60 HydrophobicContact CB-CG1 4.29Å; D57-I60 PolarHBondContact O-N 3.11Å; D57-I60 WeakPolarHBondContact OD1-CG1 3.48Å; D57-I60 PolarHBondContact OD1-N 2.87Å; D57-I60 VanDerWaalsContact OD1-N 3.13Å; D57-I60 WeakPolarHBondContact OD2-CD1 3.32Å; F58-I60 VanDerWaalsContact C-N 3.29Å; F58-I60 PolarHBondContact O-N 3.44Å; I60-W63 PolarHBondContact O-N 3.29Å; I60-C64 WeakPolarHBondContact O-CB 3.42Å; I60-C64 PolarHBondContact O-N 3.41Å; I60-C64 PolarHBondContact O-SG 3.47Å
61	A	97.9	Very high	97.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-47.1	179.5	0	0	0	0	0	111.9	L49 A52 D57 F58 C64 I65 I93	L49-A61 HydrophobicContact CD1-CB 4.34Å; A52-A61 HydrophobicContact CB-CB 3.98Å; D57-A61 WeakPolarHBondContact O-CB 3.31Å; D57-A61 PolarHBondContact O-N 3.19Å; F58-A61 PolarHBondContact O-N 2.89Å; F58-A61 VanDerWaalsContact O-N 3.11Å; A61-C64 WeakPolarHBondContact O-CB 3.46Å; A61-C64 PolarHBondContact O-N 3.02Å; A61-I65 VanDerWaalsContact O-CG1 3.26Å; A61-I65 WeakPolarHBondContact O-CG1 3.49Å; A61-I65 PolarHBondContact O-N 2.89Å; A61-I93 HydrophobicContact CB-CD1 3.66Å; A61-I93 HydrophobicContact CB-CG1 3.86Å; A61-I93 HydrophobicContact CB-CG2 4.03Å
62	E	98	Very high	97.2	Very high	78 Å²	78	38.1 Å²	38.1	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-57.6	-48.7	174.4	-177.6	178.4	-123.4	0	0	110.5	F58 C64 I65 D66	F58-E62 HydrophobicContact CE1-CB 4.16Å; F58-E62 HydrophobicContact CE1-CG 4.42Å; F58-E62 HydrophobicContact CZ-CB 4.18Å; F58-E62 HydrophobicContact CZ-CG 4.35Å; F58-E62 VanDerWaalsContact O-CB 3.31Å; F58-E62 WeakPolarHBondContact O-CB 3.43Å; F58-E62 PolarHBondContact O-N 3.28Å; E62-C64 VanDerWaalsContact C-N 3.28Å; E62-C64 PolarHBondContact O-N 3.13Å; E62-I65 PolarHBondContact O-N 3.13Å; E62-I65 VanDerWaalsContact O-N 3.1Å; E62-D66 PolarHBondContact O-N 2.91Å
63	W	96.7	Very high	97.2	Very high	48 Å²	48	41.6 Å²	41.6	18%	0.182	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-41.5	176.4	-172.6	87.3	0	0	0	112.1	L25 V28 Q29 C32 I38 P59 I60 N67	L25-W63 HydrophobicContact CD1-CB 4.02Å; L25-W63 HydrophobicContact CD1-CG 4.12Å; V28-W63 HydrophobicContact CG1-CE3 4.01Å; V28-W63 HydrophobicContact CG1-CZ3 4.08Å; Q29-W63 HydrophobicContact CG-CD2 4.16Å; Q29-W63 HydrophobicContact CG-CG 4.42Å; Q29-W63 HydrophobicContact CG-CZ2 4.08Å; C32-W63 HydrophobicContact CB-CH2 3.35Å; C32-W63 HydrophobicContact CB-CZ2 4.49Å; C32-W63 HydrophobicContact CB-CZ3 3.7Å; I38-W63 HydrophobicContact CD1-CZ3 3.97Å; P59-W63 WeakPolarHBondContact O-CB 3.48Å; P59-W63 PolarHBondContact O-N 3.03Å; I60-W63 PolarHBondContact O-N 3.29Å; W63-N67 HydrophobicContact CH2-CB 4.2Å; W63-N67 HydrophobicContact CZ2-CB 4.41Å; W63-N67 HydrophobicContact CZ3-CB 4.33Å; W63-N67 PolarHBondContact NE1-ND2 3.1Å; W63-N67 WeakPolarHBondContact O-CB 3.42Å; W63-N67 PolarHBondContact O-N 2.72Å; W63-N67 VanDerWaalsContact O-N 3.12Å; W63-N67 PolarHBondContact O-ND2 2.98Å
64	C	96.9	Very high	97.2	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-43.7	176.6	-74.6	0	0	0	0	112.1	I38 L49 I60 A61 E62 N67 G68 A69	I38-C64 HydrophobicContact CD1-CB 3.9Å; L49-C64 HydrophobicContact CB-CB 4.4Å; L49-C64 HydrophobicContact CD1-CB 4.08Å; I60-C64 WeakPolarHBondContact O-CB 3.42Å; I60-C64 PolarHBondContact O-N 3.41Å; I60-C64 PolarHBondContact O-SG 3.47Å; A61-C64 WeakPolarHBondContact O-CB 3.46Å; A61-C64 PolarHBondContact O-N 3.02Å; E62-C64 VanDerWaalsContact C-N 3.28Å; E62-C64 PolarHBondContact O-N 3.13Å; C64-N67 PolarHBondContact O-N 2.85Å; C64-G68 PolarHBondContact O-N 3.45Å; C64-A69 HydrophobicContact CB-CB 4.03Å; C64-A69 WeakPolarHBondContact O-CB 3.39Å; C64-A69 PolarHBondContact O-N 2.98Å
65	I	97.3	Very high	97.2	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-50.2	178.5	-68	164.9	0	0	0	110.3	L49 A61 E62 N67 G68 L71 T96 L97 Y100	L49-I65 HydrophobicContact CD1-CD1 4.21Å; L49-I65 HydrophobicContact CD1-CG1 3.81Å; L49-I65 HydrophobicContact CD2-CG1 4.07Å; A61-I65 VanDerWaalsContact O-CG1 3.26Å; A61-I65 WeakPolarHBondContact O-CG1 3.49Å; A61-I65 PolarHBondContact O-N 2.89Å; E62-I65 PolarHBondContact O-N 3.13Å; E62-I65 VanDerWaalsContact O-N 3.1Å; I65-N67 PolarHBondContact O-N 2.87Å; I65-N67 VanDerWaalsContact O-N 3.16Å; I65-G68 PolarHBondContact O-N 3.13Å; I65-L71 HydrophobicContact CB-CD2 4.46Å; I65-L71 HydrophobicContact CG1-CD2 3.94Å; I65-L71 HydrophobicContact CG2-CD2 4.19Å; I65-T96 HydrophobicContact CD1-CG2 3.78Å; I65-T96 HydrophobicContact CG2-CG2 4.46Å; I65-L97 HydrophobicContact CD1-CD2 3.75Å; I65-L97 HydrophobicContact CD1-CG 4.14Å; I65-L97 HydrophobicContact CG1-CD2 4.16Å; I65-Y100 HydrophobicContact CG2-CD1 3.59Å; I65-Y100 HydrophobicContact CG2-CD2 3.56Å; I65-Y100 HydrophobicContact CG2-CE1 3.76Å; I65-Y100 HydrophobicContact CG2-CE2 3.71Å; I65-Y100 HydrophobicContact CG2-CG 3.49Å; I65-Y100 VanDerWaalsContact CG2-CG 3.49Å
66	D	96.3	Very high	97.2	Very high	89 Å²	89	43.5 Å²	43.5	48%	0.476	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-27.4	179.4	-74.1	-8.5	0	0	0	113.1	E62 Y100	E62-D66 PolarHBondContact O-N 2.91Å; D66-Y100 PolarHBondContact OD1-OH 2.88Å
67	N	95.3	Very high	97.2	Very high	81 Å²	81	49.1 Å²	49.1	43%	0.433	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	13.6	178.9	-73.5	-91.5	0	0	0	113.5	W63 C64 I65	W63-N67 HydrophobicContact CH2-CB 4.2Å; W63-N67 HydrophobicContact CZ2-CB 4.41Å; W63-N67 HydrophobicContact CZ3-CB 4.33Å; W63-N67 PolarHBondContact NE1-ND2 3.1Å; W63-N67 WeakPolarHBondContact O-CB 3.42Å; W63-N67 PolarHBondContact O-N 2.72Å; W63-N67 VanDerWaalsContact O-N 3.12Å; W63-N67 PolarHBondContact O-ND2 2.98Å; C64-N67 PolarHBondContact O-N 2.85Å; I65-N67 PolarHBondContact O-N 2.87Å; I65-N67 VanDerWaalsContact O-N 3.16Å
68	G	94.7	Very high	97.3	Very high	55 Å²	55	52 Å²	52	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	29	171.1	0	0	0	0	0	114.3	C64 I65	C64-G68 PolarHBondContact O-N 3.45Å; I65-G68 PolarHBondContact O-N 3.13Å
69	A	96.7	Very high	97.3	Very high	5 Å²	5	50 Å²	50	4%	0.041	27%	0.266	C	S	.	.			trans	-56.3	137.9	168.3	0	0	0	0	0	110.5	I38 L49 C64 L71	I38-A69 HydrophobicContact CD1-CB 4.24Å; I38-A69 HydrophobicContact CG1-CB 3.88Å; L49-A69 HydrophobicContact CB-CB 3.93Å; L49-A69 HydrophobicContact CD2-CB 3.84Å; L49-A69 HydrophobicContact CG-CB 4.43Å; C64-A69 HydrophobicContact CB-CB 4.03Å; C64-A69 WeakPolarHBondContact O-CB 3.39Å; C64-A69 PolarHBondContact O-N 2.98Å; A69-L71 WeakPolarHBondContact O-CD2 3.32Å; A69-L71 PolarHBondContact O-N 2.79Å; A69-L71 VanDerWaalsContact O-N 3.1Å
70	P	97	Very high	97.3	Very high	45 Å²	45	47 Å²	47	29%	0.292	25%	0.246	S	C	.	.			trans	-71.1	110.7	179.5	30.3	-35.7	0	0	0	110.3	T47 K73	T47-P70 HydrophobicContact CG2-CG 4.11Å; P70-K73 HydrophobicContact CB-CB 3.96Å; P70-K73 HydrophobicContact CG-CB 3.89Å; P70-K73 HydrophobicContact CG-CG 4.46Å
71	L	97.8	Very high	97.3	Very high	26 Å²	26	47 Å²	47	14%	0.136	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-40	-171.7	-49.9	-177.3	0	0	0	113.2	L49 I65 A69 P81 L97 C102	L49-L71 HydrophobicContact CD2-CD2 3.75Å; I65-L71 HydrophobicContact CB-CD2 4.46Å; I65-L71 HydrophobicContact CG1-CD2 3.94Å; I65-L71 HydrophobicContact CG2-CD2 4.19Å; A69-L71 WeakPolarHBondContact O-CD2 3.32Å; A69-L71 PolarHBondContact O-N 2.79Å; A69-L71 VanDerWaalsContact O-N 3.1Å; L71-P81 WeakPolarHBondContact O-CD 3.33Å; L71-L97 HydrophobicContact CB-CD2 4.49Å; L71-L97 HydrophobicContact CD2-CD2 3.98Å; L71-C102 HydrophobicContact CB-CB 4.14Å; L71-C102 HydrophobicContact CD1-CB 4.33Å
72	D	98	Very high	97.4	Very high	69 Å²	69	46.9 Å²	46.9	37%	0.369	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	12.5	-175.3	-62	-51.6	0	0	0	113.4	K74 C102 D103	D72-K74 PolarHBondContact O-N 2.9Å; D72-C102 PolarHBondContact OD1-SG 3.21Å; D72-D103 PolarHBondContact OD1-N 3.17Å; D72-D103 PolarHBondContact OD2-N 2.73Å
73	K	97.9	Very high	97.4	Very high	72 Å²	72	43.3 Å²	43.3	31%	0.313	23%	0.229	S	C	.	.			trans	-60.4	136.3	176.9	-178.9	65.3	177.2	-163.9	0	109.1	E41 T47 H50 P70 T80	E41-K73 VanDerWaalsContact CD-NZ 3.27Å; E41-K73 WeakPolarHBondContact OE1-CE 3.3Å; E41-K73 IonicContact OE1-NZ 2.64Å; E41-K73 PolarHBondContact OE1-NZ 3.25Å; E41-K73 WeakPolarHBondContact OE2-CE 3.5Å; E41-K73 IonicContact OE2-NZ 3.28Å; E41-K73 PolarHBondContact OE2-NZ 2.86Å; T47-K73 HydrophobicContact CG2-CB 4.1Å; T47-K73 HydrophobicContact CG2-CG 3.68Å; H50-K73 PolarHBondContact CE1-O 3.38Å; H50-K73 PolarHBondContact NE2-O 2.71Å; P70-K73 HydrophobicContact CB-CB 3.96Å; P70-K73 HydrophobicContact CG-CB 3.89Å; P70-K73 HydrophobicContact CG-CG 4.46Å; K73-T80 WeakPolarHBondContact O-CA 3.31Å
74	K	98.1	Very high	97.5	Very high	72 Å²	72	42.7 Å²	42.7	31%	0.313	23%	0.227	S	C	.	.			trans	-104	132.4	-179.8	-73.7	-167.8	-179.1	-166.8	0	110.9	D72 Q78 L79 T80 T107	D72-K74 PolarHBondContact O-N 2.9Å; K74-Q78 HydrophobicContact CD-CB 4.01Å; K74-L79 CarbonylContact C-O 3.59Å; K74-L79 WeakPolarHBondContact CA-O 3.14Å; K74-T80 HydrophobicContact CG-CG2 3.87Å; K74-T107 PolarHBondContact NZ-O 3.35Å
75	D	97.8	Very high	97.6	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.027	23%	0.227	C	C	.	.			trans	-75.8	-176	172.2	75	9.2	0	0	0	112.3	G45 Q46 R77 Q78 L79 R84	G45-D75 WeakPolarHBondContact O-CA 3.26Å; Q46-D75 HydrophobicContact CG-CB 3.92Å; D75-R77 PolarHBondContact O-N 2.85Å; D75-R77 VanDerWaalsContact O-N 3.1Å; D75-R77 WeakPolarHBondContact OD1-CA 3.25Å; D75-R77 WeakPolarHBondContact OD1-CB 3.39Å; D75-R77 PolarHBondContact OD1-N 3.01Å; D75-Q78 WeakPolarHBondContact O-CA 3.19Å; D75-Q78 PolarHBondContact O-N 2.8Å; D75-Q78 PolarHBondContact OD1-N 2.87Å; D75-Q78 VanDerWaalsContact OD1-N 3.13Å; D75-L79 PolarHBondContact N-O 2.93Å; D75-L79 WeakPolarHBondContact OD1-CB 3.31Å; D75-L79 PolarHBondContact OD1-N 3.05Å; D75-R84 IonicContact OD2-CZ 2.69Å; D75-R84 IonicContact OD2-NE 2.68Å; D75-R84 IonicContact OD2-NH2 2.76Å; D75-R84 PolarHBondContact OD2-NH2 3.5Å
76	C	97.5	Very high	97.6	Very high	86 Å²	86	42.3 Å²	42.3	58%	0.581	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20	-179.7	69.5	0	0	0	0	113.9	N44	N44-C76 VanDerWaalsContact O-CB 3.25Å; N44-C76 WeakPolarHBondContact O-CB 3.35Å; N44-C76 PolarHBondContact O-N 3.14Å; N44-C76 PolarHBondContact O-SG 3.38Å
77	R	97.1	Very high	97.7	Very high	142 Å²	142	43.7 Å²	43.7	54%	0.536	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	5.7	175.2	-63.3	-176.8	62.5	179.2	-2.7	112.8	D75 L79 S109	D75-R77 PolarHBondContact O-N 2.85Å; D75-R77 VanDerWaalsContact O-N 3.1Å; D75-R77 WeakPolarHBondContact OD1-CA 3.25Å; D75-R77 WeakPolarHBondContact OD1-CB 3.39Å; D75-R77 PolarHBondContact OD1-N 3.01Å; R77-L79 HydrophobicContact CB-CD1 4.07Å; R77-L79 HydrophobicContact CB-CG 4.15Å; R77-L79 PolarHBondContact O-N 3.4Å; R77-S109 WeakPolarHBondContact O-CB 3.24Å; R77-S109 PolarHBondContact O-N 3.31Å; R77-S109 PolarHBondContact O-OG 3.06Å; R77-S109 VanDerWaalsContact O-OG 3.13Å
78	Q	98.1	Very high	97.8	Very high	87 Å²	87	44 Å²	44	41%	0.407	22%	0.222	S	C	.	.	S	Bend	trans	67	18.8	-175	-56	-76.3	-31.7	0	0	113.9	K74 D75 D108	K74-Q78 HydrophobicContact CD-CB 4.01Å; D75-Q78 WeakPolarHBondContact O-CA 3.19Å; D75-Q78 PolarHBondContact O-N 2.8Å; D75-Q78 PolarHBondContact OD1-N 2.87Å; D75-Q78 VanDerWaalsContact OD1-N 3.13Å; Q78-D108 WeakPolarHBondContact O-CA 3.39Å
79	L	98.3	Very high	98	Very high	18 Å²	18	43.5 Å²	43.5	9%	0.094	21%	0.207	C	C	.	.			trans	-81.7	145.5	175.7	-61.5	165.2	0	0	0	109.5	H50 K74 D75 R77 H83 D108	H50-L79 PolarHBondContact NE2-O 3.09Å; K74-L79 CarbonylContact C-O 3.59Å; K74-L79 WeakPolarHBondContact CA-O 3.14Å; D75-L79 PolarHBondContact N-O 2.93Å; D75-L79 WeakPolarHBondContact OD1-CB 3.31Å; D75-L79 PolarHBondContact OD1-N 3.05Å; R77-L79 HydrophobicContact CB-CD1 4.07Å; R77-L79 HydrophobicContact CB-CG 4.15Å; R77-L79 PolarHBondContact O-N 3.4Å; L79-H83 HydrophobicContact CB-CB 4.19Å; L79-H83 HydrophobicContact CD2-CB 3.8Å; L79-D108 HydrophobicContact CD2-CB 3.57Å; L79-D108 HydrophobicContact CG-CB 4.2Å
80	T	98.5	Very high	98.1	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.			trans	-102.1	167.4	173.3	61.4	0	0	0	0	110.4	K73 K74 L82 H83 R84 P106	K73-T80 WeakPolarHBondContact O-CA 3.31Å; K74-T80 HydrophobicContact CG-CG2 3.87Å; T80-L82 PolarHBondContact O-N 3.13Å; T80-H83 PolarHBondContact N-ND1 2.82Å; T80-H83 WeakPolarHBondContact O-CB 3.47Å; T80-H83 PolarHBondContact O-N 3.42Å; T80-H83 PolarHBondContact OG1-ND1 3.41Å; T80-R84 PolarHBondContact O-N 3.21Å; T80-P106 HydrophobicContact CG2-CB 3.68Å; T80-P106 HydrophobicContact CG2-CG 4.01Å; T80-P106 WeakPolarHBondContact OG1-CG 3.26Å
81	P	98.5	Very high	98.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.4	-35.3	169.7	-25.1	34.6	0	0	0	113.1	L49 H50 A53 L71 H83 R84 A85 L97	L49-P81 HydrophobicContact CB-CB 4.48Å; L49-P81 HydrophobicContact CB-CG 4.17Å; L49-P81 HydrophobicContact CD2-CB 4.19Å; L49-P81 HydrophobicContact CD2-CG 3.99Å; L49-P81 HydrophobicContact CG-CB 3.76Å; L49-P81 HydrophobicContact CG-CG 3.82Å; H50-P81 VanDerWaalsContact CE1-CD 3.49Å; H50-P81 WeakPolarHBondContact CE1-CD 3.37Å; H50-P81 WeakPolarHBondContact NE2-CD 3.08Å; A53-P81 HydrophobicContact CB-CB 4.08Å; A53-P81 WeakPolarHBondContact CB-O 3.31Å; L71-P81 WeakPolarHBondContact O-CD 3.33Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.79Å; P81-R84 WeakPolarHBondContact O-CA 3.49Å; P81-R84 WeakPolarHBondContact O-CB 3.41Å; P81-R84 PolarHBondContact O-N 3.11Å; P81-A85 PolarHBondContact O-N 3.25Å; P81-L97 HydrophobicContact CB-CD1 4.43Å
82	L	98.6	Very high	98.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-41.8	175.3	-176.7	59.4	0	0	0	112.3	T80 R84 C86 V94 L97 D103 P106 P114 L130	T80-L82 PolarHBondContact O-N 3.13Å; L82-R84 VanDerWaalsContact C-N 3.3Å; L82-R84 PolarHBondContact O-N 3.29Å; L82-C86 VanDerWaalsContact O-CB 3.31Å; L82-C86 WeakPolarHBondContact O-CB 3.48Å; L82-C86 PolarHBondContact O-N 3.09Å; L82-C86 PolarHBondContact O-SG 2.96Å; L82-V94 HydrophobicContact CD1-CB 4.26Å; L82-V94 HydrophobicContact CD1-CG1 3.84Å; L82-V94 HydrophobicContact CD1-CG2 4.04Å; L82-L97 HydrophobicContact CB-CD1 4.19Å; L82-L97 HydrophobicContact CD1-CD1 4.2Å; L82-D103 VanDerWaalsContact CD2-O 3.3Å; L82-D103 WeakPolarHBondContact CD2-O 3.47Å; L82-P106 HydrophobicContact CD2-CG 4.42Å; L82-P114 HydrophobicContact CB-CG 4.44Å; L82-P114 HydrophobicContact CD2-CB 4.27Å; L82-P114 HydrophobicContact CD2-CG 3.76Å; L82-P114 HydrophobicContact CG-CB 4.02Å; L82-P114 HydrophobicContact CG-CG 3.8Å; L82-L130 HydrophobicContact CD2-CD2 4.26Å
83	H	98.6	Very high	98.2	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-38.9	174	-70.2	90.9	0	0	0	112.1	L79 T80 P81 C86 R87 P106 L112	L79-H83 HydrophobicContact CB-CB 4.19Å; L79-H83 HydrophobicContact CD2-CB 3.8Å; T80-H83 PolarHBondContact N-ND1 2.82Å; T80-H83 WeakPolarHBondContact O-CB 3.47Å; T80-H83 PolarHBondContact O-N 3.42Å; T80-H83 PolarHBondContact OG1-ND1 3.41Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.79Å; H83-C86 PolarHBondContact O-N 3.42Å; H83-R87 PolarHBondContact O-N 3.4Å; H83-P106 PolarHBondContact CE1-O 3.13Å; H83-P106 VanDerWaalsContact CE1-O 3.27Å; H83-P106 PolarHBondContact NE2-O 3.24Å; H83-L112 PolarHBondContact NE2-O 3.09Å; H83-L112 VanDerWaalsContact NE2-O 3.13Å
84	R	98.2	Very high	98.2	Very high	34 Å²	34	43.5 Å²	43.5	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-68.4	-45.9	-179.3	-61.7	-63.4	179.4	154	0.1	111.7	Q46 H50 A53 F54 D75 T80 P81 L82 C86 R87 Q88	Q46-R84 VanDerWaalsContact NE2-NH2 3.19Å; H50-R84 HydrophobicContact CB-CG 4.45Å; A53-R84 HydrophobicContact CB-CB 4.09Å; F54-R84 HydrophobicContact CB-CB 4.09Å; D75-R84 IonicContact OD2-CZ 2.69Å; D75-R84 IonicContact OD2-NE 2.68Å; D75-R84 IonicContact OD2-NH2 2.76Å; D75-R84 PolarHBondContact OD2-NH2 3.5Å; T80-R84 PolarHBondContact O-N 3.21Å; P81-R84 WeakPolarHBondContact O-CA 3.49Å; P81-R84 WeakPolarHBondContact O-CB 3.41Å; P81-R84 PolarHBondContact O-N 3.11Å; L82-R84 VanDerWaalsContact C-N 3.3Å; L82-R84 PolarHBondContact O-N 3.29Å; R84-C86 VanDerWaalsContact C-N 3.34Å; R84-R87 PolarHBondContact O-N 3.42Å; R84-Q88 PolarHBondContact O-N 2.92Å
85	A	98.6	Very high	98.3	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-43.1	174.2	0	0	0	0	0	111.6	A53 P81 Q88 N89 N90 I93 V94	A53-A85 HydrophobicContact CB-CB 4.04Å; A53-A85 WeakPolarHBondContact O-CA 3.49Å; P81-A85 PolarHBondContact O-N 3.25Å; A85-Q88 PolarHBondContact O-N 3.02Å; A85-N89 PolarHBondContact O-N 3.37Å; A85-N89 VanDerWaalsContact O-N 3.08Å; A85-N90 HydrophobicContact CB-CB 4.3Å; A85-N90 PolarHBondContact O-N 2.9Å; A85-I93 HydrophobicContact CB-CB 4.18Å; A85-I93 HydrophobicContact CB-CG2 3.95Å; A85-V94 HydrophobicContact CB-CG2 3.67Å
86	C	98.7	Very high	98.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-48.1	177.2	-73.4	0	0	0	0	112.1	L82 H83 R84 Q88 N89 P114 V117 C118 S123	L82-C86 VanDerWaalsContact O-CB 3.31Å; L82-C86 WeakPolarHBondContact O-CB 3.48Å; L82-C86 PolarHBondContact O-N 3.09Å; L82-C86 PolarHBondContact O-SG 2.96Å; H83-C86 PolarHBondContact O-N 3.42Å; R84-C86 VanDerWaalsContact C-N 3.34Å; C86-Q88 PolarHBondContact O-N 2.95Å; C86-Q88 VanDerWaalsContact O-N 3.12Å; C86-N89 PolarHBondContact O-N 3.4Å; C86-P114 HydrophobicContact CB-CB 4.41Å; C86-V117 HydrophobicContact CB-CB 4.47Å; C86-V117 HydrophobicContact CB-CG1 4.22Å; C86-C118 VanDerWaalsContact CB-SG 3.56Å; C86-C118 VanDerWaalsContact SG-SG 3.7Å; C86-S123 WeakPolarHBondContact O-CB 3.36Å; C86-S123 PolarHBondContact O-OG 2.88Å
87	R	98.4	Very high	98.3	Very high	118 Å²	118	40.7 Å²	40.7	45%	0.445	18%	0.18	S	C	.	.	H	α-helix	trans	-54.2	-35.8	-179.9	-175.7	175.4	179	-157.1	-3.7	113.1	H83 R84 V117	H83-R87 PolarHBondContact O-N 3.4Å; R84-R87 PolarHBondContact O-N 3.42Å; R87-V117 HydrophobicContact CB-CG1 3.66Å; R87-V117 HydrophobicContact CG-CG1 4.36Å
88	Q	97.6	Very high	98.4	Very high	87 Å²	87	35.5 Å²	35.5	41%	0.407	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.8	-176.5	-60.3	-67.2	111	0	0	112.7	F54 R84 A85 C86 N90	F54-Q88 HydrophobicContact CD2-CG 3.69Å; F54-Q88 HydrophobicContact CE2-CG 3.83Å; F54-Q88 HydrophobicContact CG-CG 4.47Å; F54-Q88 WeakPolarHBondContact O-CG 3.49Å; R84-Q88 PolarHBondContact O-N 2.92Å; A85-Q88 PolarHBondContact O-N 3.02Å; C86-Q88 PolarHBondContact O-N 2.95Å; C86-Q88 VanDerWaalsContact O-N 3.12Å; Q88-N90 VanDerWaalsContact C-N 3.27Å; Q88-N90 WeakPolarHBondContact CB-ND2 3.48Å; Q88-N90 PolarHBondContact O-N 2.88Å
89	N	98.1	Very high	98.4	Very high	45 Å²	45	37.6 Å²	37.6	24%	0.241	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	33.3	-176.9	-159.7	37.5	0	0	0	114.8	A85 C86 H91 S123 L124 E125 C126	A85-N89 PolarHBondContact O-N 3.37Å; A85-N89 VanDerWaalsContact O-N 3.08Å; C86-N89 PolarHBondContact O-N 3.4Å; N89-H91 VanDerWaalsContact C-N 3.26Å; N89-H91 PolarHBondContact O-N 2.94Å; N89-S123 WeakPolarHBondContact OD1-CA 3.02Å; N89-S123 WeakPolarHBondContact OD1-CB 3.09Å; N89-L124 PolarHBondContact OD1-N 3.22Å; N89-E125 PolarHBondContact ND2-OE2 3.41Å; N89-E125 PolarHBondContact OD1-OE2 3.45Å; N89-C126 VanDerWaalsContact C-SG 3.57Å; N89-C126 PolarHBondContact OD1-N 2.92Å
90	N	98.1	Very high	98.3	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.193	20%	0.196	C	C	.	.			trans	-80.2	70.3	179.5	-65.8	-35	0	0	0	111.1	A53 G56 A85 Q88 F92 I93 V94	A53-N90 PolarHBondContact O-ND2 3.22Å; G56-N90 VanDerWaalsContact CA-CG 3.4Å; G56-N90 WeakPolarHBondContact CA-ND2 3.47Å; G56-N90 PolarHBondContact N-ND2 3.44Å; A85-N90 HydrophobicContact CB-CB 4.3Å; A85-N90 PolarHBondContact O-N 2.9Å; Q88-N90 VanDerWaalsContact C-N 3.27Å; Q88-N90 WeakPolarHBondContact CB-ND2 3.48Å; Q88-N90 PolarHBondContact O-N 2.88Å; N90-F92 VanDerWaalsContact C-N 3.35Å; N90-F92 PolarHBondContact O-N 3.37Å; N90-I93 HydrophobicContact CB-CB 4.33Å; N90-I93 HydrophobicContact CB-CD1 4.04Å; N90-I93 HydrophobicContact CB-CG1 4.33Å; N90-I93 PolarHBondContact O-N 3.27Å; N90-V94 PolarHBondContact O-N 3.35Å; N90-V94 VanDerWaalsContact O-N 3.09Å
91	H	98.1	Very high	98.2	Very high	61 Å²	61	45.4 Å²	45.4	28%	0.282	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-33	-169.8	63.8	-81.2	0	0	0	114.7	N89 I93 V94 E95 E125 L129	N89-H91 VanDerWaalsContact C-N 3.26Å; N89-H91 PolarHBondContact O-N 2.94Å; H91-I93 VanDerWaalsContact C-N 3.31Å; H91-I93 PolarHBondContact O-N 3.13Å; H91-V94 PolarHBondContact O-N 3.03Å; H91-E95 WeakPolarHBondContact O-CB 3.43Å; H91-E95 PolarHBondContact O-N 3.05Å; H91-E125 HydrophobicContact CB-CB 3.58Å; H91-L129 HydrophobicContact CB-CD1 4.07Å; H91-L129 WeakPolarHBondContact O-CD1 3.43Å
92	F	98.5	Very high	98.1	Very high	117 Å²	117	45.6 Å²	45.6	51%	0.513	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-41.7	172.9	-66	-66.8	0	0	0	112	F58 N90 E95 T96	F58-F92 HydrophobicContact CD2-CB 3.5Å; F58-F92 VanDerWaalsContact CD2-CB 3.5Å; F58-F92 HydrophobicContact CE2-CB 3.79Å; F58-F92 HydrophobicContact CG-CB 4.27Å; N90-F92 VanDerWaalsContact C-N 3.35Å; N90-F92 PolarHBondContact O-N 3.37Å; F92-E95 PolarHBondContact O-N 3.17Å; F92-T96 PolarHBondContact O-N 3.47Å; F92-T96 PolarHBondContact O-OG1 3.15Å; F92-T96 VanDerWaalsContact O-OG1 3.06Å
93	I	98.7	Very high	98.1	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-68.3	-40.3	177	-59.1	177.6	0	0	0	110.1	A53 F58 A61 A85 N90 H91 T96 L97	A53-I93 HydrophobicContact CB-CG2 4.23Å; F58-I93 HydrophobicContact CB-CG1 4.47Å; F58-I93 HydrophobicContact CD2-CG1 4.06Å; A61-I93 HydrophobicContact CB-CD1 3.66Å; A61-I93 HydrophobicContact CB-CG1 3.86Å; A61-I93 HydrophobicContact CB-CG2 4.03Å; A85-I93 HydrophobicContact CB-CB 4.18Å; A85-I93 HydrophobicContact CB-CG2 3.95Å; N90-I93 HydrophobicContact CB-CB 4.33Å; N90-I93 HydrophobicContact CB-CD1 4.04Å; N90-I93 HydrophobicContact CB-CG1 4.33Å; N90-I93 PolarHBondContact O-N 3.27Å; H91-I93 VanDerWaalsContact C-N 3.31Å; H91-I93 PolarHBondContact O-N 3.13Å; I93-T96 PolarHBondContact O-N 2.99Å; I93-L97 HydrophobicContact CG2-CD1 3.98Å; I93-L97 HydrophobicContact CG2-CG 4.28Å; I93-L97 WeakPolarHBondContact O-CB 3.4Å; I93-L97 WeakPolarHBondContact O-CG 3.34Å; I93-L97 PolarHBondContact O-N 3.48Å
94	V	98.7	Very high	98	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-46	175.1	171.8	0	0	0	0	111.2	L82 A85 N90 H91 L97 L98 C126 L129	L82-V94 HydrophobicContact CD1-CB 4.26Å; L82-V94 HydrophobicContact CD1-CG1 3.84Å; L82-V94 HydrophobicContact CD1-CG2 4.04Å; A85-V94 HydrophobicContact CB-CG2 3.67Å; N90-V94 PolarHBondContact O-N 3.35Å; N90-V94 VanDerWaalsContact O-N 3.09Å; H91-V94 PolarHBondContact O-N 3.03Å; V94-L97 PolarHBondContact O-N 3.33Å; V94-L98 HydrophobicContact CG1-CD1 3.95Å; V94-L98 HydrophobicContact CG1-CG 4.46Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.45Å; V94-L98 PolarHBondContact O-N 3.17Å; V94-C126 HydrophobicContact CG2-CB 4.21Å; V94-C126 VanDerWaalsContact CG2-SG 3.53Å; V94-L129 HydrophobicContact CB-CD1 4.19Å; V94-L129 HydrophobicContact CG1-CB 4.21Å; V94-L129 HydrophobicContact CG1-CD1 3.96Å
95	E	98.5	Very high	97.9	Very high	83 Å²	83	53 Å²	53	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-51.8	177.8	-170.9	165.9	-136.5	0	0	111	H91 F92 L97 L98 D99 L129	H91-E95 WeakPolarHBondContact O-CB 3.43Å; H91-E95 PolarHBondContact O-N 3.05Å; F92-E95 PolarHBondContact O-N 3.17Å; E95-L97 PolarHBondContact O-N 2.85Å; E95-L98 PolarHBondContact O-N 2.84Å; E95-L98 VanDerWaalsContact O-N 3.14Å; E95-D99 PolarHBondContact O-N 2.84Å; E95-L129 HydrophobicContact CB-CD1 3.91Å; E95-L129 HydrophobicContact CG-CD2 4.49Å
96	T	98.4	Very high	97.8	Very high	21 Å²	21	53.2 Å²	53.2	13%	0.129	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-41.5	177.9	-54.5	0	0	0	0	112.8	F58 I65 F92 I93 L98 D99 Y100	F58-T96 WeakPolarHBondContact CE2-OG1 3.39Å; I65-T96 HydrophobicContact CD1-CG2 3.78Å; I65-T96 HydrophobicContact CG2-CG2 4.46Å; F92-T96 PolarHBondContact O-N 3.47Å; F92-T96 PolarHBondContact O-OG1 3.15Å; F92-T96 VanDerWaalsContact O-OG1 3.06Å; I93-T96 PolarHBondContact O-N 2.99Å; T96-L98 VanDerWaalsContact C-N 3.31Å; T96-L98 PolarHBondContact O-N 3.27Å; T96-D99 PolarHBondContact O-N 3.23Å; T96-Y100 HydrophobicContact CG2-CD2 3.95Å; T96-Y100 HydrophobicContact CG2-CE2 4.07Å; T96-Y100 WeakPolarHBondContact O-CD2 3.32Å; T96-Y100 PolarHBondContact O-N 3.11Å
97	L	98.5	Very high	97.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-44.1	175.9	-74.9	171	0	0	0	111.4	L49 I65 L71 P81 L82 I93 V94 E95 Y100 G101 C102	L49-L97 HydrophobicContact CD2-CD2 3.99Å; I65-L97 HydrophobicContact CD1-CD2 3.75Å; I65-L97 HydrophobicContact CD1-CG 4.14Å; I65-L97 HydrophobicContact CG1-CD2 4.16Å; L71-L97 HydrophobicContact CB-CD2 4.49Å; L71-L97 HydrophobicContact CD2-CD2 3.98Å; P81-L97 HydrophobicContact CB-CD1 4.43Å; L82-L97 HydrophobicContact CB-CD1 4.19Å; L82-L97 HydrophobicContact CD1-CD1 4.2Å; I93-L97 HydrophobicContact CG2-CD1 3.98Å; I93-L97 HydrophobicContact CG2-CG 4.28Å; I93-L97 WeakPolarHBondContact O-CB 3.4Å; I93-L97 WeakPolarHBondContact O-CG 3.34Å; I93-L97 PolarHBondContact O-N 3.48Å; V94-L97 PolarHBondContact O-N 3.33Å; E95-L97 PolarHBondContact O-N 2.85Å; L97-Y100 PolarHBondContact O-N 3.43Å; L97-G101 PolarHBondContact O-N 3.02Å; L97-C102 HydrophobicContact CB-CB 4.07Å; L97-C102 WeakPolarHBondContact O-CB 3.45Å; L97-C102 PolarHBondContact O-N 2.76Å
98	L	98	Very high	97.7	Very high	34 Å²	34	50.6 Å²	50.6	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-67.6	-40.4	178.9	-67.8	173.9	0	0	0	112	V94 E95 T96 Y100 G101 P104 L129 L130 A133	V94-L98 HydrophobicContact CG1-CD1 3.95Å; V94-L98 HydrophobicContact CG1-CG 4.46Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.45Å; V94-L98 PolarHBondContact O-N 3.17Å; E95-L98 PolarHBondContact O-N 2.84Å; E95-L98 VanDerWaalsContact O-N 3.14Å; T96-L98 VanDerWaalsContact C-N 3.31Å; T96-L98 PolarHBondContact O-N 3.27Å; L98-Y100 VanDerWaalsContact C-N 3.26Å; L98-Y100 PolarHBondContact O-N 2.7Å; L98-G101 WeakPolarHBondContact O-CA 3.32Å; L98-G101 PolarHBondContact O-N 2.97Å; L98-P104 HydrophobicContact CD2-CB 3.69Å; L98-L129 HydrophobicContact CD1-CB 4.25Å; L98-L130 HydrophobicContact CD1-CD2 4.45Å; L98-A133 HydrophobicContact CD1-CB 4.2Å; L98-A133 HydrophobicContact CD2-CB 4.3Å
99	D	97.9	Very high	97.7	Very high	130 Å²	130	48.9 Å²	48.9	70%	0.695	26%	0.26	S	S	*	.	H	α-helix	trans	-62.8	-34.1	177	-75.7	-15.9	0	0	0	112.3	E95 T96 G101	E95-D99 PolarHBondContact O-N 2.84Å; T96-D99 PolarHBondContact O-N 3.23Å; D99-G101 PolarHBondContact O-N 2.73Å
100	Y	97.7	Very high	97.7	Very high	125 Å²	125	49.5 Å²	49.5	49%	0.49	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	2.8	173	-88	-99.3	0	0	0	114	I65 D66 T96 L97 L98	I65-Y100 HydrophobicContact CG2-CD1 3.59Å; I65-Y100 HydrophobicContact CG2-CD2 3.56Å; I65-Y100 HydrophobicContact CG2-CE1 3.76Å; I65-Y100 HydrophobicContact CG2-CE2 3.71Å; I65-Y100 HydrophobicContact CG2-CG 3.49Å; I65-Y100 VanDerWaalsContact CG2-CG 3.49Å; D66-Y100 PolarHBondContact OD1-OH 2.88Å; T96-Y100 HydrophobicContact CG2-CD2 3.95Å; T96-Y100 HydrophobicContact CG2-CE2 4.07Å; T96-Y100 WeakPolarHBondContact O-CD2 3.32Å; T96-Y100 PolarHBondContact O-N 3.11Å; L97-Y100 PolarHBondContact O-N 3.43Å; L98-Y100 VanDerWaalsContact C-N 3.26Å; L98-Y100 PolarHBondContact O-N 2.7Å
101	G	95.9	Very high	97.7	Very high	58 Å²	58	54.3 Å²	54.3	60%	0.598	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	23.5	173.9	0	0	0	0	0	115.2	L97 L98 D99	L97-G101 PolarHBondContact O-N 3.02Å; L98-G101 WeakPolarHBondContact O-CA 3.32Å; L98-G101 PolarHBondContact O-N 2.97Å; D99-G101 PolarHBondContact O-N 2.73Å
102	C	96.5	Very high	97.7	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.027	28%	0.275	C	S	.	.			trans	-54.4	141.5	167.6	178.7	0	0	0	0	110.4	L71 D72 L97 P104	L71-C102 HydrophobicContact CB-CB 4.14Å; L71-C102 HydrophobicContact CD1-CB 4.33Å; D72-C102 PolarHBondContact OD1-SG 3.21Å; L97-C102 HydrophobicContact CB-CB 4.07Å; L97-C102 WeakPolarHBondContact O-CB 3.45Å; L97-C102 PolarHBondContact O-N 2.76Å; C102-P104 VanDerWaalsContact O-CD 3.3Å; C102-P104 WeakPolarHBondContact O-CD 3.48Å
103	D	97.3	Very high	97.7	Very high	68 Å²	68	47.7 Å²	47.7	36%	0.364	25%	0.254	S	S	.	.			trans	-59.3	124.1	172.1	178	14.4	0	0	0	108.9	D72 L82 K105 P106	D72-D103 PolarHBondContact OD1-N 3.17Å; D72-D103 PolarHBondContact OD2-N 2.73Å; L82-D103 VanDerWaalsContact CD2-O 3.3Å; L82-D103 WeakPolarHBondContact CD2-O 3.47Å; D103-K105 VanDerWaalsContact C-N 3.3Å; D103-K105 PolarHBondContact OD1-N 3.01Å; D103-P106 WeakPolarHBondContact O-CD 3.43Å
104	P	96.9	Very high	97.6	Very high	24 Å²	24	47.6 Å²	47.6	16%	0.156	25%	0.253	C	S	.	.	S	Bend	trans	-81.4	-9.3	177.6	33.1	-37.1	0	0	0	113.1	L98 C102 L130 A133 V134	L98-P104 HydrophobicContact CD2-CB 3.69Å; C102-P104 VanDerWaalsContact O-CD 3.3Å; C102-P104 WeakPolarHBondContact O-CD 3.48Å; P104-L130 HydrophobicContact CB-CD2 4.43Å; P104-A133 HydrophobicContact CB-CB 3.97Å; P104-A133 HydrophobicContact CG-CB 4.45Å; P104-V134 HydrophobicContact CB-CG1 3.83Å; P104-V134 HydrophobicContact CG-CG1 4.27Å
105	K	96.1	Very high	97.6	Very high	99 Å²	99	47.8 Å²	47.8	43%	0.43	25%	0.254	S	S	.	.			trans	-120.1	37.4	-177.8	-61.9	-173.7	-61	-61.5	0	115	D103 V134	D103-K105 VanDerWaalsContact C-N 3.3Å; D103-K105 PolarHBondContact OD1-N 3.01Å; K105-V134 HydrophobicContact CD-CB 4.01Å; K105-V134 HydrophobicContact CD-CG1 4.2Å; K105-V134 HydrophobicContact CG-CB 3.87Å; K105-V134 HydrophobicContact CG-CG1 3.48Å; K105-V134 VanDerWaalsContact CG-CG1 3.48Å
106	P	96.7	Very high	97.7	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.039	24%	0.236	C	C	.	.			trans	-65.9	144.9	176.3	28.7	-34	0	0	0	108.4	T80 L82 H83 D103 T113 P114	T80-P106 HydrophobicContact CG2-CB 3.68Å; T80-P106 HydrophobicContact CG2-CG 4.01Å; T80-P106 WeakPolarHBondContact OG1-CG 3.26Å; L82-P106 HydrophobicContact CD2-CG 4.42Å; H83-P106 PolarHBondContact CE1-O 3.13Å; H83-P106 VanDerWaalsContact CE1-O 3.27Å; H83-P106 PolarHBondContact NE2-O 3.24Å; D103-P106 WeakPolarHBondContact O-CD 3.43Å; P106-T113 WeakPolarHBondContact O-CA 3.39Å; P106-P114 HydrophobicContact CG-CG 3.76Å; P106-P114 VanDerWaalsContact O-CD 3.32Å; P106-P114 WeakPolarHBondContact O-CD 3.24Å
107	T	97.6	Very high	97.7	Very high	54 Å²	54	43.8 Å²	43.8	33%	0.331	24%	0.235	S	C	.	.			trans	-110.3	137	176.1	57.7	0	0	0	0	111.2	K74 L112 T113	K74-T107 PolarHBondContact NZ-O 3.35Å; T107-L112 WeakPolarHBondContact CA-O 3.4Å; T107-T113 HydrophobicContact CG2-CG2 4.19Å
108	D	97.5	Very high	97.7	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.048	24%	0.235	C	C	.	.			trans	-75.6	-174.5	169.7	89.6	-15.7	0	0	0	112.5	Q78 L79 T110 W111 L112	Q78-D108 WeakPolarHBondContact O-CA 3.39Å; L79-D108 HydrophobicContact CD2-CB 3.57Å; L79-D108 HydrophobicContact CG-CB 4.2Å; D108-T110 PolarHBondContact O-N 3.49Å; D108-T110 VanDerWaalsContact O-N 3.13Å; D108-T110 VanDerWaalsContact OD1-C 3.24Å; D108-T110 VanDerWaalsContact OD1-CA 3.24Å; D108-T110 WeakPolarHBondContact OD1-CA 3.39Å; D108-T110 PolarHBondContact OD1-N 2.86Å; D108-T110 PolarHBondContact OD1-OG1 2.94Å; D108-T110 PolarHBondContact OD2-OG1 3.48Å; D108-W111 PolarHBondContact O-N 3.31Å; D108-W111 PolarHBondContact OD1-N 3.23Å; D108-L112 PolarHBondContact N-O 3.44Å; D108-L112 WeakPolarHBondContact OD1-CB 3.34Å; D108-L112 PolarHBondContact OD1-N 3.41Å
109	S	97.5	Very high	97.7	Very high	50 Å²	50	42.2 Å²	42.2	35%	0.35	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.5	-178.7	56.9	0	0	0	0	113.4	R77 K142	R77-S109 WeakPolarHBondContact O-CB 3.24Å; R77-S109 PolarHBondContact O-N 3.31Å; R77-S109 PolarHBondContact O-OG 3.06Å; R77-S109 VanDerWaalsContact O-OG 3.13Å; S109-K142 WeakPolarHBondContact O-CE 3.41Å; S109-K142 PolarHBondContact O-NZ 2.98Å
110	T	97.8	Very high	97.7	Very high	59 Å²	59	37 Å²	37	36%	0.362	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	10.8	176	57.8	0	0	0	0	113.5	D108 L112 K142	D108-T110 PolarHBondContact O-N 3.49Å; D108-T110 VanDerWaalsContact O-N 3.13Å; D108-T110 VanDerWaalsContact OD1-C 3.24Å; D108-T110 VanDerWaalsContact OD1-CA 3.24Å; D108-T110 WeakPolarHBondContact OD1-CA 3.39Å; D108-T110 PolarHBondContact OD1-N 2.86Å; D108-T110 PolarHBondContact OD1-OG1 2.94Å; D108-T110 PolarHBondContact OD2-OG1 3.48Å; T110-L112 PolarHBondContact O-N 3.23Å; T110-L112 WeakPolarHBondContact OG1-CD1 3.46Å; T110-K142 WeakPolarHBondContact O-CB 3.32Å; T110-K142 WeakPolarHBondContact O-CG 3.37Å; T110-K142 PolarHBondContact O-N 3.31Å
111	W	98.1	Very high	97.8	Very high	137 Å²	137	34.7 Å²	34.7	52%	0.519	20%	0.198	S	C	.	.			trans	68.4	14.8	-177.3	-54.7	-11.3	0	0	0	115.6	D108 T113 K142	D108-W111 PolarHBondContact O-N 3.31Å; D108-W111 PolarHBondContact OD1-N 3.23Å; W111-T113 PolarHBondContact O-N 3.06Å; W111-K142 HydrophobicContact CB-CG 4.16Å; W111-K142 HydrophobicContact CD2-CB 4.48Å; W111-K142 HydrophobicContact CD2-CG 3.45Å; W111-K142 VanDerWaalsContact CD2-CG 3.45Å; W111-K142 HydrophobicContact CE3-CB 4.45Å; W111-K142 HydrophobicContact CE3-CG 3.82Å; W111-K142 HydrophobicContact CG-CG 3.6Å; W111-K142 HydrophobicContact CZ2-CG 4.46Å; W111-K142 HydrophobicContact CZ3-CG 4.45Å
112	L	98.2	Very high	97.9	Very high	29 Å²	29	35.7 Å²	35.7	15%	0.152	19%	0.19	C	C	.	.			trans	-69.1	133.3	172.8	-65.6	169.2	0	0	0	109.6	H83 T107 D108 T110 H116 D141 Y150	H83-L112 PolarHBondContact NE2-O 3.09Å; H83-L112 VanDerWaalsContact NE2-O 3.13Å; T107-L112 WeakPolarHBondContact CA-O 3.4Å; D108-L112 PolarHBondContact N-O 3.44Å; D108-L112 WeakPolarHBondContact OD1-CB 3.34Å; D108-L112 PolarHBondContact OD1-N 3.41Å; T110-L112 PolarHBondContact O-N 3.23Å; T110-L112 WeakPolarHBondContact OG1-CD1 3.46Å; L112-H116 HydrophobicContact CB-CB 4.25Å; L112-H116 HydrophobicContact CD2-CB 3.6Å; L112-D141 HydrophobicContact CD2-CB 3.65Å; L112-D141 HydrophobicContact CG-CB 4.24Å; L112-Y150 HydrophobicContact CD2-CE1 4.49Å; L112-Y150 HydrophobicContact CD2-CE2 3.76Å; L112-Y150 WeakPolarHBondContact CD2-OH 3.35Å
113	T	98.3	Very high	98	Very high	10 Å²	10	35.6 Å²	35.6	6%	0.061	19%	0.189	C	C	.	.			trans	-92.9	165.2	170	69.2	0	0	0	0	110.5	P106 T107 W111 L115 H116 V117 A139	P106-T113 WeakPolarHBondContact O-CA 3.39Å; T107-T113 HydrophobicContact CG2-CG2 4.19Å; W111-T113 PolarHBondContact O-N 3.06Å; T113-L115 PolarHBondContact O-N 2.99Å; T113-L115 VanDerWaalsContact O-N 3.12Å; T113-L115 PolarHBondContact OG1-N 2.93Å; T113-H116 PolarHBondContact N-ND1 3.31Å; T113-H116 WeakPolarHBondContact O-CB 3.23Å; T113-H116 PolarHBondContact O-N 3.19Å; T113-H116 PolarHBondContact OG1-N 3.5Å; T113-H116 PolarHBondContact OG1-ND1 3.08Å; T113-V117 PolarHBondContact O-N 2.94Å; T113-V117 VanDerWaalsContact O-N 3.16Å; T113-A139 HydrophobicContact CG2-CB 3.98Å
114	P	98.5	Very high	98.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.3	-30.5	172.8	-28.4	36.5	0	0	0	113.4	L82 C86 P106 V117 C118 L130	L82-P114 HydrophobicContact CB-CG 4.44Å; L82-P114 HydrophobicContact CD2-CB 4.27Å; L82-P114 HydrophobicContact CD2-CG 3.76Å; L82-P114 HydrophobicContact CG-CB 4.02Å; L82-P114 HydrophobicContact CG-CG 3.8Å; C86-P114 HydrophobicContact CB-CB 4.41Å; P106-P114 HydrophobicContact CG-CG 3.76Å; P106-P114 VanDerWaalsContact O-CD 3.32Å; P106-P114 WeakPolarHBondContact O-CD 3.24Å; P114-V117 WeakPolarHBondContact O-CB 3.29Å; P114-V117 PolarHBondContact O-N 2.94Å; P114-C118 PolarHBondContact O-N 3.07Å; P114-C118 PolarHBondContact O-SG 2.74Å; P114-L130 HydrophobicContact CB-CD1 3.62Å; P114-L130 HydrophobicContact CB-CD2 4.33Å
115	L	98.6	Very high	98.2	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-34.5	176.7	-172.3	58.8	0	0	0	112.4	T113 V117 C118 A119 A127 L130 V134 V137 P147 L163	T113-L115 PolarHBondContact O-N 2.99Å; T113-L115 VanDerWaalsContact O-N 3.12Å; T113-L115 PolarHBondContact OG1-N 2.93Å; L115-V117 VanDerWaalsContact C-N 3.34Å; L115-C118 PolarHBondContact O-N 3.46Å; L115-A119 WeakPolarHBondContact O-CB 3.38Å; L115-A119 PolarHBondContact O-N 3.12Å; L115-A127 HydrophobicContact CD1-CB 4.05Å; L115-L130 HydrophobicContact CB-CD1 4.34Å; L115-L130 HydrophobicContact CD1-CB 4.21Å; L115-V134 HydrophobicContact CD2-CG2 4.34Å; L115-V137 HydrophobicContact CD2-CB 3.77Å; L115-V137 HydrophobicContact CD2-CG1 3.79Å; L115-P147 HydrophobicContact CB-CG 4.23Å; L115-P147 HydrophobicContact CD2-CB 4.38Å; L115-P147 HydrophobicContact CD2-CG 4.04Å; L115-P147 HydrophobicContact CG-CB 3.97Å; L115-P147 HydrophobicContact CG-CG 3.85Å; L115-L163 HydrophobicContact CD1-CD2 4.34Å; L115-L163 HydrophobicContact CD2-CD2 4.01Å; L115-L163 HydrophobicContact CG-CD2 4.32Å
116	H	98.7	Very high	98.3	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-43.3	169.5	-68.1	86.7	0	0	0	111.1	L112 T113 C118 A119 A120 A139 Y145 P147 Y150	L112-H116 HydrophobicContact CB-CB 4.25Å; L112-H116 HydrophobicContact CD2-CB 3.6Å; T113-H116 PolarHBondContact N-ND1 3.31Å; T113-H116 WeakPolarHBondContact O-CB 3.23Å; T113-H116 PolarHBondContact O-N 3.19Å; T113-H116 PolarHBondContact OG1-N 3.5Å; T113-H116 PolarHBondContact OG1-ND1 3.08Å; H116-C118 VanDerWaalsContact C-N 3.32Å; H116-C118 PolarHBondContact O-N 3.41Å; H116-A119 CarbonylContact O-C 3.6Å; H116-A119 PolarHBondContact O-N 3.48Å; H116-A120 WeakPolarHBondContact O-CB 3.25Å; H116-A120 PolarHBondContact O-N 2.94Å; H116-A139 PolarHBondContact CE1-O 3.45Å; H116-A139 PolarHBondContact NE2-O 3.29Å; H116-A139 VanDerWaalsContact NE2-O 3.16Å; H116-Y145 PolarHBondContact NE2-O 3.32Å; H116-P147 WeakPolarHBondContact NE2-CD 3.28Å; H116-Y150 AromaticContact CD2-CD2 3.67Å; H116-Y150 AromaticContact CD2-CE2 3.71Å
117	V	98.6	Very high	98.4	Very high	19 Å²	19	31.3 Å²	31.3	12%	0.115	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-45	177.2	176.5	0	0	0	0	110.6	C86 R87 T113 P114 L115 A119 A120 N121	C86-V117 HydrophobicContact CB-CB 4.47Å; C86-V117 HydrophobicContact CB-CG1 4.22Å; R87-V117 HydrophobicContact CB-CG1 3.66Å; R87-V117 HydrophobicContact CG-CG1 4.36Å; T113-V117 PolarHBondContact O-N 2.94Å; T113-V117 VanDerWaalsContact O-N 3.16Å; P114-V117 WeakPolarHBondContact O-CB 3.29Å; P114-V117 PolarHBondContact O-N 2.94Å; L115-V117 VanDerWaalsContact C-N 3.34Å; V117-A119 PolarHBondContact O-N 3.16Å; V117-A120 PolarHBondContact O-N 2.84Å; V117-N121 WeakPolarHBondContact O-CB 3.47Å; V117-N121 PolarHBondContact O-N 2.99Å; V117-N121 PolarHBondContact O-ND2 2.9Å
118	C	98.8	Very high	98.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-45.8	175.8	-62.2	0	0	0	0	111.9	C86 P114 L115 H116 A120 N121 N122 S123 C126 A127 I159	C86-C118 VanDerWaalsContact CB-SG 3.56Å; C86-C118 VanDerWaalsContact SG-SG 3.7Å; P114-C118 PolarHBondContact O-N 3.07Å; P114-C118 PolarHBondContact O-SG 2.74Å; L115-C118 PolarHBondContact O-N 3.46Å; H116-C118 VanDerWaalsContact C-N 3.32Å; H116-C118 PolarHBondContact O-N 3.41Å; C118-A120 PolarHBondContact O-N 3.49Å; C118-N121 PolarHBondContact O-N 3.16Å; C118-N122 PolarHBondContact O-N 3.41Å; C118-S123 PolarHBondContact O-N 3.24Å; C118-C126 VanDerWaalsContact SG-CB 3.5Å; C118-A127 HydrophobicContact CB-CB 3.86Å; C118-I159 VanDerWaalsContact O-CD1 3.27Å; C118-I159 WeakPolarHBondContact O-CD1 3.46Å
119	A	98.8	Very high	98.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.8	-22.7	178.9	0	0	0	0	0	114.1	L115 H116 V117 P147 Y150 A151 H156 I159	L115-A119 WeakPolarHBondContact O-CB 3.38Å; L115-A119 PolarHBondContact O-N 3.12Å; H116-A119 CarbonylContact O-C 3.6Å; H116-A119 PolarHBondContact O-N 3.48Å; V117-A119 PolarHBondContact O-N 3.16Å; A119-P147 HydrophobicContact CB-CB 3.95Å; A119-P147 WeakPolarHBondContact CB-O 3.38Å; A119-Y150 CarbonylContact O-C 3.51Å; A119-A151 HydrophobicContact CB-CB 4.08Å; A119-A151 WeakPolarHBondContact O-CA 3.1Å; A119-A151 PolarHBondContact O-N 3.31Å; A119-H156 PolarHBondContact O-CD2 3.06Å; A119-I159 HydrophobicContact CB-CG2 4.15Å
120	A	98.7	Very high	98.4	Very high	22 Å²	22	30.3 Å²	30.3	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-85.9	-33.1	173.3	0	0	0	0	0	112.7	H116 V117 C118 Y150 F154 H156	H116-A120 WeakPolarHBondContact O-CB 3.25Å; H116-A120 PolarHBondContact O-N 2.94Å; V117-A120 PolarHBondContact O-N 2.84Å; C118-A120 PolarHBondContact O-N 3.49Å; A120-Y150 HydrophobicContact CB-CD1 3.74Å; A120-Y150 HydrophobicContact CB-CE1 4.43Å; A120-F154 HydrophobicContact CB-CD2 4.14Å; A120-F154 HydrophobicContact CB-CE2 4.13Å; A120-H156 PolarHBondContact O-NE2 3.43Å
121	N	98.6	Very high	98.4	Very high	75 Å²	75	27.6 Å²	27.6	40%	0.401	14%	0.139	S	C	.	.	H	α-helix	trans	-107.4	13	-169.9	-63.7	-89.8	0	0	0	114.2	V117 C118 S123	V117-N121 WeakPolarHBondContact O-CB 3.47Å; V117-N121 PolarHBondContact O-N 2.99Å; V117-N121 PolarHBondContact O-ND2 2.9Å; C118-N121 PolarHBondContact O-N 3.16Å; N121-S123 PolarHBondContact O-N 2.93Å
122	N	98.6	Very high	98.2	Very high	80 Å²	80	30 Å²	30	43%	0.428	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	36.1	-177.5	-162	35.6	0	0	0	113.9	C118 L124 H156	C118-N122 PolarHBondContact O-N 3.41Å; N122-L124 VanDerWaalsContact C-N 3.31Å; N122-L124 PolarHBondContact O-N 3Å; N122-H156 HydrophobicContact CB-CB 4.47Å; N122-H156 PolarHBondContact N-CD2 3.21Å; N122-H156 PolarHBondContact N-NE2 2.81Å
123	S	98.7	Very high	98.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	16%	0.157	C	C	.	.			trans	-87.9	71.7	-175.8	-39.3	0	0	0	0	110.2	C86 N89 C118 N121 C126 A127	C86-S123 WeakPolarHBondContact O-CB 3.36Å; C86-S123 PolarHBondContact O-OG 2.88Å; N89-S123 WeakPolarHBondContact OD1-CA 3.02Å; N89-S123 WeakPolarHBondContact OD1-CB 3.09Å; C118-S123 PolarHBondContact O-N 3.24Å; N121-S123 PolarHBondContact O-N 2.93Å; S123-C126 PolarHBondContact O-N 2.91Å; S123-A127 WeakPolarHBondContact O-CB 3.4Å; S123-A127 PolarHBondContact O-N 3.15Å
124	L	98.5	Very high	97.9	Very high	28 Å²	28	30.8 Å²	30.8	15%	0.147	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-46.3	-167.5	177.3	64.2	0	0	0	113	N89 N122 C126 A127 L128 Q158 I159 L162	N89-L124 PolarHBondContact OD1-N 3.22Å; N122-L124 VanDerWaalsContact C-N 3.31Å; N122-L124 PolarHBondContact O-N 3Å; L124-C126 VanDerWaalsContact C-N 3.34Å; L124-A127 WeakPolarHBondContact O-CB 3.38Å; L124-A127 PolarHBondContact O-N 2.82Å; L124-L128 HydrophobicContact CG-CD1 4.26Å; L124-L128 WeakPolarHBondContact O-CG 3.36Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-Q158 HydrophobicContact CD1-CB 3.97Å; L124-Q158 HydrophobicContact CD2-CB 4.09Å; L124-I159 HydrophobicContact CD1-CG1 3.98Å; L124-L162 HydrophobicContact CD1-CD2 4.38Å
125	E	98.5	Very high	97.2	Very high	80 Å²	80	39.9 Å²	39.9	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-63.8	-43.1	-178.2	-68.6	76.3	-175.9	0	0	110.4	N89 H91 L128 L129	N89-E125 PolarHBondContact ND2-OE2 3.41Å; N89-E125 PolarHBondContact OD1-OE2 3.45Å; H91-E125 HydrophobicContact CB-CB 3.58Å; E125-L128 WeakPolarHBondContact O-CB 3.27Å; E125-L128 PolarHBondContact O-N 3.27Å; E125-L129 PolarHBondContact O-N 2.95Å
126	C	98.6	Very high	97	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-40.9	172.6	-63.8	0	0	0	0	112.1	N89 V94 C118 S123 L124 L128 L129 L130	N89-C126 VanDerWaalsContact C-SG 3.57Å; N89-C126 PolarHBondContact OD1-N 2.92Å; V94-C126 HydrophobicContact CG2-CB 4.21Å; V94-C126 VanDerWaalsContact CG2-SG 3.53Å; C118-C126 VanDerWaalsContact SG-CB 3.5Å; S123-C126 PolarHBondContact O-N 2.91Å; L124-C126 VanDerWaalsContact C-N 3.34Å; C126-L128 VanDerWaalsContact C-N 3.3Å; C126-L128 PolarHBondContact O-N 2.81Å; C126-L129 PolarHBondContact O-N 3.44Å; C126-L130 WeakPolarHBondContact O-CB 3.35Å; C126-L130 WeakPolarHBondContact O-CG 3.48Å; C126-L130 PolarHBondContact O-N 3.12Å
127	A	98.5	Very high	97	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-38	176.5	0	0	0	0	0	112	L115 C118 S123 L124 L130 A131 I159 L162	L115-A127 HydrophobicContact CD1-CB 4.05Å; C118-A127 HydrophobicContact CB-CB 3.86Å; S123-A127 WeakPolarHBondContact O-CB 3.4Å; S123-A127 PolarHBondContact O-N 3.15Å; L124-A127 WeakPolarHBondContact O-CB 3.38Å; L124-A127 PolarHBondContact O-N 2.82Å; A127-L130 PolarHBondContact O-N 3.36Å; A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 3.32Å; A127-A131 PolarHBondContact O-N 3.41Å; A127-I159 HydrophobicContact CB-CD1 4.45Å; A127-I159 HydrophobicContact CB-CG1 4.5Å; A127-L162 HydrophobicContact CB-CD2 3.79Å
128	L	98	Very high	97	Very high	61 Å²	61	44.6 Å²	44.6	32%	0.319	22%	0.222	S	C	.	.	H	α-helix	trans	-61.5	-46.4	175.9	-78.7	163.5	0	0	0	111.8	L124 E125 C126 R132 L162	L124-L128 HydrophobicContact CG-CD1 4.26Å; L124-L128 WeakPolarHBondContact O-CG 3.36Å; L124-L128 PolarHBondContact O-N 2.87Å; E125-L128 WeakPolarHBondContact O-CB 3.27Å; E125-L128 PolarHBondContact O-N 3.27Å; C126-L128 VanDerWaalsContact C-N 3.3Å; C126-L128 PolarHBondContact O-N 2.81Å; L128-R132 WeakPolarHBondContact O-CG 3.36Å; L128-R132 PolarHBondContact O-N 2.84Å; L128-L162 HydrophobicContact CD2-CD1 3.5Å; L128-L162 VanDerWaalsContact CD2-CD1 3.5Å; L128-L162 HydrophobicContact CD2-CD2 3.96Å; L128-L162 HydrophobicContact CD2-CG 4.34Å; L128-L162 HydrophobicContact CG-CD1 4.39Å; L128-L162 HydrophobicContact CG-CD2 3.93Å
129	L	98	Very high	96.9	Very high	30 Å²	30	46.2 Å²	46.2	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-48.3	176.8	-67.4	171.9	0	0	0	111.1	H91 V94 E95 L98 E125 C126 R132 A133	H91-L129 HydrophobicContact CB-CD1 4.07Å; H91-L129 WeakPolarHBondContact O-CD1 3.43Å; V94-L129 HydrophobicContact CB-CD1 4.19Å; V94-L129 HydrophobicContact CG1-CB 4.21Å; V94-L129 HydrophobicContact CG1-CD1 3.96Å; E95-L129 HydrophobicContact CB-CD1 3.91Å; E95-L129 HydrophobicContact CG-CD2 4.49Å; L98-L129 HydrophobicContact CD1-CB 4.25Å; E125-L129 PolarHBondContact O-N 2.95Å; C126-L129 PolarHBondContact O-N 3.44Å; L129-R132 PolarHBondContact O-N 3.01Å; L129-A133 PolarHBondContact O-N 3.36Å; L129-A133 VanDerWaalsContact O-N 3.13Å
130	L	98.2	Very high	96.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-41.7	-178.2	-72.6	173.4	0	0	0	112.9	L82 L98 P104 P114 L115 C126 A127 R132 A133 V134	L82-L130 HydrophobicContact CD2-CD2 4.26Å; L98-L130 HydrophobicContact CD1-CD2 4.45Å; P104-L130 HydrophobicContact CB-CD2 4.43Å; P114-L130 HydrophobicContact CB-CD1 3.62Å; P114-L130 HydrophobicContact CB-CD2 4.33Å; L115-L130 HydrophobicContact CB-CD1 4.34Å; L115-L130 HydrophobicContact CD1-CB 4.21Å; C126-L130 WeakPolarHBondContact O-CB 3.35Å; C126-L130 WeakPolarHBondContact O-CG 3.48Å; C126-L130 PolarHBondContact O-N 3.12Å; A127-L130 PolarHBondContact O-N 3.36Å; L130-R132 PolarHBondContact O-N 3.1Å; L130-A133 PolarHBondContact O-N 3.4Å; L130-V134 WeakPolarHBondContact O-CG2 3.44Å; L130-V134 PolarHBondContact O-N 3.35Å
131	A	96.6	Very high	96.9	Very high	3 Å²	3	48.9 Å²	48.9	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-57.1	-36.8	178.2	0	0	0	0	0	111.8	A127 V137 N166	A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 3.32Å; A127-A131 PolarHBondContact O-N 3.41Å; A131-V137 HydrophobicContact CB-CG1 4.31Å; A131-N166 HydrophobicContact CB-CB 4.5Å
132	R	94.9	Very high	96.9	Very high	187 Å²	187	50.4 Å²	50.4	71%	0.706	25%	0.252	S	S	*	.	H	α-helix	trans	-70.8	-38.8	174.5	-64.8	171.2	-176.4	174.3	2.8	112.3	L128 L129 L130	L128-R132 WeakPolarHBondContact O-CG 3.36Å; L128-R132 PolarHBondContact O-N 2.84Å; L129-R132 PolarHBondContact O-N 3.01Å; L130-R132 PolarHBondContact O-N 3.1Å
133	A	96.3	Very high	96.8	Very high	42 Å²	42	48 Å²	48	35%	0.347	24%	0.243	S	C	.	.	H	α-helix	trans	-75.8	-41.3	-176.3	0	0	0	0	0	113.6	L98 P104 L129 L130	L98-A133 HydrophobicContact CD1-CB 4.2Å; L98-A133 HydrophobicContact CD2-CB 4.3Å; P104-A133 HydrophobicContact CB-CB 3.97Å; P104-A133 HydrophobicContact CG-CB 4.45Å; L129-A133 PolarHBondContact O-N 3.36Å; L129-A133 VanDerWaalsContact O-N 3.13Å; L130-A133 PolarHBondContact O-N 3.4Å
134	V	92.7	Very high	96.8	Very high	14 Å²	14	48.5 Å²	48.5	9%	0.085	25%	0.249	C	C	.	.	H	α-helix	trans	-82.9	-21.5	-171.1	-57.9	0	0	0	0	114.4	P104 K105 L115 L130 D136 V137	P104-V134 HydrophobicContact CB-CG1 3.83Å; P104-V134 HydrophobicContact CG-CG1 4.27Å; K105-V134 HydrophobicContact CD-CB 4.01Å; K105-V134 HydrophobicContact CD-CG1 4.2Å; K105-V134 HydrophobicContact CG-CB 3.87Å; K105-V134 HydrophobicContact CG-CG1 3.48Å; K105-V134 VanDerWaalsContact CG-CG1 3.48Å; L115-V134 HydrophobicContact CD2-CG2 4.34Å; L130-V134 WeakPolarHBondContact O-CG2 3.44Å; L130-V134 PolarHBondContact O-N 3.35Å; V134-D136 VanDerWaalsContact CG2-O 3.32Å; V134-D136 WeakPolarHBondContact CG2-O 3.3Å; V134-D136 PolarHBondContact O-N 2.89Å; V134-V137 HydrophobicContact CG2-CG1 4.29Å
135	K	84.4	Confident	96.8	Very high	191 Å²	191	49.1 Å²	49.1	83%	0.83	25%	0.249	S	C	*	.	S	Bend	trans	60.7	-44.2	-171.4	-58.5	-178.4	-179.3	178.9	0	115.6
136	D	94.8	Very high	96.8	Very high	91 Å²	91	45.4 Å²	45.4	49%	0.487	23%	0.233	S	C	.	.			trans	-103.8	113.5	174.3	-177.8	14.2	0	0	0	110.6	V134 N138	V134-D136 VanDerWaalsContact CG2-O 3.32Å; V134-D136 WeakPolarHBondContact CG2-O 3.3Å; V134-D136 PolarHBondContact O-N 2.89Å; D136-N138 VanDerWaalsContact C-N 3.33Å; D136-N138 VanDerWaalsContact OD1-CB 3.25Å; D136-N138 WeakPolarHBondContact OD1-CB 3.25Å; D136-N138 PolarHBondContact OD1-N 3.18Å; D136-N138 PolarHBondContact OD1-ND2 3.43Å
137	V	97.8	Very high	96.8	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.233	C	C	.	.			trans	-90.4	4.5	-179.9	-58.5	0	0	0	0	113.1	L115 A131 V134 P147 L163 N166 A168	L115-V137 HydrophobicContact CD2-CB 3.77Å; L115-V137 HydrophobicContact CD2-CG1 3.79Å; A131-V137 HydrophobicContact CB-CG1 4.31Å; V134-V137 HydrophobicContact CG2-CG1 4.29Å; V137-P147 VanDerWaalsContact O-CD 3.29Å; V137-P147 WeakPolarHBondContact O-CD 3.39Å; V137-P147 WeakPolarHBondContact O-CG 3.4Å; V137-L163 HydrophobicContact CB-CD2 3.93Å; V137-L163 HydrophobicContact CG1-CD2 4.28Å; V137-L163 HydrophobicContact CG2-CD2 4.28Å; V137-N166 HydrophobicContact CG1-CB 4.05Å; V137-N166 VanDerWaalsContact CG2-O 3.25Å; V137-N166 WeakPolarHBondContact CG2-O 3.45Å; V137-A168 HydrophobicContact CG2-CB 3.76Å
138	N	98.3	Very high	96.9	Very high	29 Å²	29	45.5 Å²	45.5	16%	0.155	23%	0.233	C	C	.	.			trans	-101.6	14.2	-170.4	-58.8	-66.2	0	0	0	114.8	D136 T140 N167 A168 L169	D136-N138 VanDerWaalsContact C-N 3.33Å; D136-N138 VanDerWaalsContact OD1-CB 3.25Å; D136-N138 WeakPolarHBondContact OD1-CB 3.25Å; D136-N138 PolarHBondContact OD1-N 3.18Å; D136-N138 PolarHBondContact OD1-ND2 3.43Å; N138-T140 PolarHBondContact O-N 2.89Å; N138-N167 PolarHBondContact ND2-O 3.43Å; N138-N167 VanDerWaalsContact ND2-O 3.12Å; N138-A168 VanDerWaalsContact OD1-CA 3.28Å; N138-A168 WeakPolarHBondContact OD1-CA 3.3Å; N138-L169 HydrophobicContact CB-CD1 4.12Å; N138-L169 HydrophobicContact CB-CG 4.32Å; N138-L169 PolarHBondContact OD1-N 3.05Å
139	A	97.8	Very high	96.9	Very high	34 Å²	34	42.6 Å²	42.6	28%	0.281	22%	0.218	S	C	.	.			trans	-52.4	142.8	169.6	0	0	0	0	0	110	T113 H116 P147	T113-A139 HydrophobicContact CG2-CB 3.98Å; H116-A139 PolarHBondContact CE1-O 3.45Å; H116-A139 PolarHBondContact NE2-O 3.29Å; H116-A139 VanDerWaalsContact NE2-O 3.16Å; A139-P147 WeakPolarHBondContact O-CD 3.4Å
140	T	98.3	Very high	96.9	Very high	67 Å²	67	43.2 Å²	43.2	41%	0.411	22%	0.218	S	C	.	.			trans	-112.5	145.6	178.5	57.9	0	0	0	0	111.2	N138 Y145 T146	N138-T140 PolarHBondContact O-N 2.89Å; T140-Y145 CarbonylContact C-O 3.57Å; T140-Y145 VanDerWaalsContact CA-O 3.27Å; T140-Y145 WeakPolarHBondContact CA-O 3.46Å; T140-T146 HydrophobicContact CG2-CG2 3.77Å
141	D	98.3	Very high	97	Very high	12 Å²	12	43.2 Å²	43.2	6%	0.064	22%	0.218	C	C	.	.			trans	-69.7	-177.2	164.3	84.3	-13.6	0	0	0	111.9	L112 A143 G144 Y145 Y150	L112-D141 HydrophobicContact CD2-CB 3.65Å; L112-D141 HydrophobicContact CG-CB 4.24Å; D141-A143 PolarHBondContact O-N 3.31Å; D141-A143 VanDerWaalsContact OD1-C 3.3Å; D141-A143 VanDerWaalsContact OD1-CA 3.32Å; D141-A143 WeakPolarHBondContact OD1-CA 3.13Å; D141-A143 PolarHBondContact OD1-N 3.09Å; D141-G144 PolarHBondContact O-N 2.77Å; D141-G144 VanDerWaalsContact O-N 3.11Å; D141-G144 PolarHBondContact OD1-N 2.79Å; D141-Y145 PolarHBondContact N-O 3.36Å; D141-Y145 WeakPolarHBondContact OD1-CB 3.23Å; D141-Y145 PolarHBondContact OD1-N 3.12Å; D141-Y150 PolarHBondContact OD2-OH 3.07Å
142	K	98.1	Very high	97.1	Very high	106 Å²	106	43 Å²	43	46%	0.461	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.4	177.9	-84	-172.3	-179.7	171.8	0	114	S109 T110 W111 Q175	S109-K142 WeakPolarHBondContact O-CE 3.41Å; S109-K142 PolarHBondContact O-NZ 2.98Å; T110-K142 WeakPolarHBondContact O-CB 3.32Å; T110-K142 WeakPolarHBondContact O-CG 3.37Å; T110-K142 PolarHBondContact O-N 3.31Å; W111-K142 HydrophobicContact CB-CG 4.16Å; W111-K142 HydrophobicContact CD2-CB 4.48Å; W111-K142 HydrophobicContact CD2-CG 3.45Å; W111-K142 VanDerWaalsContact CD2-CG 3.45Å; W111-K142 HydrophobicContact CE3-CB 4.45Å; W111-K142 HydrophobicContact CE3-CG 3.82Å; W111-K142 HydrophobicContact CG-CG 3.6Å; W111-K142 HydrophobicContact CZ2-CG 4.46Å; W111-K142 HydrophobicContact CZ3-CG 4.45Å; K142-Q175 PolarHBondContact O-NE2 3.49Å
143	A	98.1	Very high	97.3	Very high	29 Å²	29	38.8 Å²	38.8	24%	0.24	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	2.4	179.4	0	0	0	0	0	112.5	D141 Y145 Q175	D141-A143 PolarHBondContact O-N 3.31Å; D141-A143 VanDerWaalsContact OD1-C 3.3Å; D141-A143 VanDerWaalsContact OD1-CA 3.32Å; D141-A143 WeakPolarHBondContact OD1-CA 3.13Å; D141-A143 PolarHBondContact OD1-N 3.09Å; A143-Y145 VanDerWaalsContact C-N 3.35Å; A143-Y145 HydrophobicContact CB-CD2 3.73Å; A143-Y145 HydrophobicContact CB-CE2 4.06Å; A143-Q175 WeakPolarHBondContact O-CB 3.5Å; A143-Q175 VanDerWaalsContact O-CG 3.3Å; A143-Q175 WeakPolarHBondContact O-CG 3.34Å; A143-Q175 PolarHBondContact O-N 3.4Å
144	G	98.3	Very high	97.4	Very high	12 Å²	12	41.3 Å²	41.3	12%	0.124	21%	0.205	C	C	.	.	S	Bend	trans	83.9	6.6	-179	0	0	0	0	0	114.2	D141	D141-G144 PolarHBondContact O-N 2.77Å; D141-G144 VanDerWaalsContact O-N 3.11Å; D141-G144 PolarHBondContact OD1-N 2.79Å
145	Y	98.7	Very high	97.7	Very high	41 Å²	41	41.9 Å²	41.9	16%	0.161	21%	0.214	C	C	.	.			trans	-74.1	131.2	176.7	-77.4	-112.7	0	0	0	109.5	H116 T140 D141 A143 H149 Y150 D174 R178 L183	H116-Y145 PolarHBondContact NE2-O 3.32Å; T140-Y145 CarbonylContact C-O 3.57Å; T140-Y145 VanDerWaalsContact CA-O 3.27Å; T140-Y145 WeakPolarHBondContact CA-O 3.46Å; D141-Y145 PolarHBondContact N-O 3.36Å; D141-Y145 WeakPolarHBondContact OD1-CB 3.23Å; D141-Y145 PolarHBondContact OD1-N 3.12Å; A143-Y145 VanDerWaalsContact C-N 3.35Å; A143-Y145 HydrophobicContact CB-CD2 3.73Å; A143-Y145 HydrophobicContact CB-CE2 4.06Å; Y145-H149 HydrophobicContact CD1-CB 3.53Å; Y145-H149 HydrophobicContact CE1-CB 4.31Å; Y145-H149 HydrophobicContact CG-CB 4.19Å; Y145-Y150 VanDerWaalsContact CB-CE2 3.46Å; Y145-Y150 HydrophobicContact CD1-CD2 4.43Å; Y145-Y150 HydrophobicContact CD1-CE2 4.26Å; Y145-Y150 HydrophobicContact CG-CE2 4.16Å; Y145-D174 HydrophobicContact CD2-CB 3.85Å; Y145-D174 HydrophobicContact CE2-CB 3.83Å; Y145-D174 VanDerWaalsContact CE2-OD2 3.26Å; Y145-D174 WeakPolarHBondContact CE2-OD2 3.42Å; Y145-D174 HydrophobicContact CG-CB 4.47Å; Y145-D174 PolarHBondContact OH-OD2 3.29Å; Y145-R178 PolarHBondContact OH-NH2 2.96Å; Y145-L183 HydrophobicContact CD1-CD1 4.05Å; Y145-L183 HydrophobicContact CE1-CD1 3.48Å; Y145-L183 VanDerWaalsContact CE1-CD1 3.48Å
146	T	98.7	Very high	98.4	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.018	18%	0.182	C	C	.	.			trans	-91.5	167.3	168.4	66.5	0	0	0	0	110.5	T140 L148 H149 Y150 A172	T140-T146 HydrophobicContact CG2-CG2 3.77Å; T146-L148 PolarHBondContact O-N 3.5Å; T146-L148 VanDerWaalsContact O-N 3.12Å; T146-L148 PolarHBondContact OG1-N 3.41Å; T146-H149 PolarHBondContact N-ND1 3.01Å; T146-H149 VanDerWaalsContact N-ND1 3.12Å; T146-H149 WeakPolarHBondContact O-CB 3.46Å; T146-H149 PolarHBondContact O-N 2.88Å; T146-H149 PolarHBondContact OG1-N 3.26Å; T146-H149 PolarHBondContact OG1-ND1 3.32Å; T146-Y150 WeakPolarHBondContact O-CD2 3.45Å; T146-Y150 PolarHBondContact O-N 3.23Å; T146-A172 HydrophobicContact CG2-CB 3.91Å
147	P	98.8	Very high	98.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-54	-32.1	170.8	-27.1	36.6	0	0	0	113.1	L115 H116 A119 V137 A139 H149 Y150 A151 L163	L115-P147 HydrophobicContact CB-CG 4.23Å; L115-P147 HydrophobicContact CD2-CB 4.38Å; L115-P147 HydrophobicContact CD2-CG 4.04Å; L115-P147 HydrophobicContact CG-CB 3.97Å; L115-P147 HydrophobicContact CG-CG 3.85Å; H116-P147 WeakPolarHBondContact NE2-CD 3.28Å; A119-P147 HydrophobicContact CB-CB 3.95Å; A119-P147 WeakPolarHBondContact CB-O 3.38Å; V137-P147 VanDerWaalsContact O-CD 3.29Å; V137-P147 WeakPolarHBondContact O-CD 3.39Å; V137-P147 WeakPolarHBondContact O-CG 3.4Å; A139-P147 WeakPolarHBondContact O-CD 3.4Å; P147-H149 PolarHBondContact O-N 3.12Å; P147-Y150 PolarHBondContact O-N 3.46Å; P147-A151 PolarHBondContact O-N 2.97Å; P147-L163 HydrophobicContact CB-CD1 3.87Å; P147-L163 HydrophobicContact CB-CD2 4.08Å
148	L	98.9	Very high	98.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-66.9	-36.2	176.8	-175.1	59.9	0	0	0	112.1	T146 A152 V160 L163 L164 A168 P180 L196	T146-L148 PolarHBondContact O-N 3.5Å; T146-L148 VanDerWaalsContact O-N 3.12Å; T146-L148 PolarHBondContact OG1-N 3.41Å; L148-A152 WeakPolarHBondContact O-CB 3.17Å; L148-A152 PolarHBondContact O-N 3.12Å; L148-V160 HydrophobicContact CD1-CB 4.34Å; L148-V160 HydrophobicContact CD1-CG1 3.97Å; L148-V160 HydrophobicContact CD1-CG2 4.29Å; L148-L163 HydrophobicContact CB-CD1 4.2Å; L148-L163 HydrophobicContact CD1-CB 4.3Å; L148-L163 HydrophobicContact CD1-CD1 4.38Å; L148-L164 HydrophobicContact CD1-CG 4.41Å; L148-L164 HydrophobicContact CD2-CD2 3.94Å; L148-A168 HydrophobicContact CB-CB 4.3Å; L148-A168 HydrophobicContact CD2-CB 3.97Å; L148-P180 HydrophobicContact CB-CG 4.22Å; L148-P180 HydrophobicContact CD2-CB 4.3Å; L148-P180 HydrophobicContact CD2-CG 3.87Å; L148-P180 HydrophobicContact CG-CB 3.91Å; L148-P180 HydrophobicContact CG-CG 3.72Å; L148-L196 HydrophobicContact CD1-CD2 4.42Å; L148-L196 HydrophobicContact CD2-CD2 4.48Å
149	H	98.9	Very high	98.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-46.4	172.6	-70.5	91.7	0	0	0	111.5	Y145 T146 P147 A152 Y153 A172 R178 P180 L183	Y145-H149 HydrophobicContact CD1-CB 3.53Å; Y145-H149 HydrophobicContact CE1-CB 4.31Å; Y145-H149 HydrophobicContact CG-CB 4.19Å; T146-H149 PolarHBondContact N-ND1 3.01Å; T146-H149 VanDerWaalsContact N-ND1 3.12Å; T146-H149 WeakPolarHBondContact O-CB 3.46Å; T146-H149 PolarHBondContact O-N 2.88Å; T146-H149 PolarHBondContact OG1-N 3.26Å; T146-H149 PolarHBondContact OG1-ND1 3.32Å; P147-H149 PolarHBondContact O-N 3.12Å; H149-A152 PolarHBondContact O-N 3.24Å; H149-Y153 WeakPolarHBondContact O-CB 3.25Å; H149-Y153 PolarHBondContact O-N 2.93Å; H149-A172 PolarHBondContact CE1-O 2.97Å; H149-A172 PolarHBondContact NE2-O 3.09Å; H149-R178 PolarHBondContact NE2-O 2.92Å; H149-P180 WeakPolarHBondContact NE2-CD 3.35Å; H149-L183 HydrophobicContact CB-CD1 3.75Å
150	Y	98.9	Very high	98.7	Very high	42 Å²	42	33.2 Å²	33.2	17%	0.165	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-52.1	177.8	-83.7	-90.9	0	0	0	111.7	L112 H116 A119 A120 D141 Y145 T146 P147 A152 Y153 F154	L112-Y150 HydrophobicContact CD2-CE1 4.49Å; L112-Y150 HydrophobicContact CD2-CE2 3.76Å; L112-Y150 WeakPolarHBondContact CD2-OH 3.35Å; H116-Y150 AromaticContact CD2-CD2 3.67Å; H116-Y150 AromaticContact CD2-CE2 3.71Å; A119-Y150 CarbonylContact O-C 3.51Å; A120-Y150 HydrophobicContact CB-CD1 3.74Å; A120-Y150 HydrophobicContact CB-CE1 4.43Å; D141-Y150 PolarHBondContact OD2-OH 3.07Å; Y145-Y150 VanDerWaalsContact CB-CE2 3.46Å; Y145-Y150 HydrophobicContact CD1-CD2 4.43Å; Y145-Y150 HydrophobicContact CD1-CE2 4.26Å; Y145-Y150 HydrophobicContact CG-CE2 4.16Å; T146-Y150 WeakPolarHBondContact O-CD2 3.45Å; T146-Y150 PolarHBondContact O-N 3.23Å; P147-Y150 PolarHBondContact O-N 3.46Å; Y150-A152 VanDerWaalsContact C-N 3.27Å; Y150-A152 PolarHBondContact O-N 3.02Å; Y150-Y153 PolarHBondContact O-N 3.31Å; Y150-F154 HydrophobicContact CD1-CD2 4.12Å; Y150-F154 AromaticContact CD1-CE2 3.71Å; Y150-F154 HydrophobicContact CD1-CE2 3.71Å; Y150-F154 HydrophobicContact CE1-CE2 4.23Å; Y150-F154 WeakPolarHBondContact O-CB 3.39Å; Y150-F154 VanDerWaalsContact O-CD2 3.29Å; Y150-F154 WeakPolarHBondContact O-CD2 3.48Å; Y150-F154 PolarHBondContact O-N 3.26Å
151	A	98.9	Very high	98.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-37.9	-179.8	0	0	0	0	0	112	A119 P147 G155 H156 I159 V160 L163	A119-A151 HydrophobicContact CB-CB 4.08Å; A119-A151 WeakPolarHBondContact O-CA 3.1Å; A119-A151 PolarHBondContact O-N 3.31Å; P147-A151 PolarHBondContact O-N 2.97Å; A151-G155 PolarHBondContact O-N 2.97Å; A151-G155 VanDerWaalsContact O-N 3.09Å; A151-H156 PolarHBondContact O-N 3.41Å; A151-I159 HydrophobicContact CB-CB 4.16Å; A151-I159 HydrophobicContact CB-CG2 3.88Å; A151-V160 HydrophobicContact CB-CG2 3.69Å; A151-L163 HydrophobicContact CB-CD1 4.22Å
152	A	98.9	Very high	98.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.1	-42.3	177.3	0	0	0	0	0	112.7	L148 H149 Y150 P180 A184 H189 I192 L196	L148-A152 WeakPolarHBondContact O-CB 3.17Å; L148-A152 PolarHBondContact O-N 3.12Å; H149-A152 PolarHBondContact O-N 3.24Å; Y150-A152 VanDerWaalsContact C-N 3.27Å; Y150-A152 PolarHBondContact O-N 3.02Å; A152-P180 HydrophobicContact CB-CB 3.88Å; A152-P180 WeakPolarHBondContact CB-O 3.35Å; A152-A184 HydrophobicContact CB-CB 4.17Å; A152-H189 PolarHBondContact O-CD2 3.32Å; A152-I192 HydrophobicContact CB-CG2 4.24Å; A152-L196 HydrophobicContact CB-CD1 4.45Å
153	Y	98.8	Very high	98.7	Very high	98 Å²	98	29.7 Å²	29.7	38%	0.384	15%	0.146	S	C	.	.	H	α-helix	trans	-70.2	-40.7	178.6	-177.3	-103.1	0	0	0	112.7	H149 Y150 L183 F186 A187 H189	H149-Y153 WeakPolarHBondContact O-CB 3.25Å; H149-Y153 PolarHBondContact O-N 2.93Å; Y150-Y153 PolarHBondContact O-N 3.31Å; Y153-L183 HydrophobicContact CD2-CB 4.18Å; Y153-F186 HydrophobicContact CE2-CD1 4.25Å; Y153-A187 HydrophobicContact CD2-CB 4.16Å; Y153-A187 HydrophobicContact CE2-CB 4.4Å; Y153-A187 WeakPolarHBondContact O-CB 3.43Å; Y153-H189 PolarHBondContact O-CD2 3.19Å; Y153-H189 PolarHBondContact O-NE2 3.08Å
154	F	98.7	Very high	98.7	Very high	95 Å²	95	30.2 Å²	30.2	42%	0.417	15%	0.145	S	C	.	.	H	α-helix	trans	-86.2	-7.4	-176.9	-74.1	-71.4	0	0	0	114.6	A120 Y150 H156	A120-F154 HydrophobicContact CB-CD2 4.14Å; A120-F154 HydrophobicContact CB-CE2 4.13Å; Y150-F154 HydrophobicContact CD1-CD2 4.12Å; Y150-F154 AromaticContact CD1-CE2 3.71Å; Y150-F154 HydrophobicContact CD1-CE2 3.71Å; Y150-F154 HydrophobicContact CE1-CE2 4.23Å; Y150-F154 WeakPolarHBondContact O-CB 3.39Å; Y150-F154 VanDerWaalsContact O-CD2 3.29Å; Y150-F154 WeakPolarHBondContact O-CD2 3.48Å; Y150-F154 PolarHBondContact O-N 3.26Å; F154-H156 PolarHBondContact O-CE1 3.04Å
155	G	98.7	Very high	98.6	Very high	26 Å²	26	36.9 Å²	36.9	27%	0.268	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	17.8	172.9	0	0	0	0	0	115.2	A151 G157 H189	A151-G155 PolarHBondContact O-N 2.97Å; A151-G155 VanDerWaalsContact O-N 3.09Å; G155-G157 PolarHBondContact O-N 2.99Å; G155-H189 VanDerWaalsContact CA-CD2 3.49Å; G155-H189 WeakPolarHBondContact CA-CD2 3.35Å; G155-H189 WeakPolarHBondContact CA-CE1 3.2Å; G155-H189 WeakPolarHBondContact CA-ND1 3.49Å; G155-H189 WeakPolarHBondContact CA-NE2 3.35Å; G155-H189 PolarHBondContact N-CD2 2.91Å; G155-H189 PolarHBondContact N-NE2 3.49Å
156	H	98.7	Very high	98.6	Very high	33 Å²	33	37.1 Å²	37.1	15%	0.153	18%	0.177	C	C	.	.			trans	-89.4	71.7	-173.1	-57.6	-22.9	0	0	0	111.3	A119 A120 N122 A151 F154 Q158 I159 V160	A119-H156 PolarHBondContact O-CD2 3.06Å; A120-H156 PolarHBondContact O-NE2 3.43Å; N122-H156 HydrophobicContact CB-CB 4.47Å; N122-H156 PolarHBondContact N-CD2 3.21Å; N122-H156 PolarHBondContact N-NE2 2.81Å; A151-H156 PolarHBondContact O-N 3.41Å; F154-H156 PolarHBondContact O-CE1 3.04Å; H156-Q158 VanDerWaalsContact C-N 3.28Å; H156-Q158 PolarHBondContact O-N 3.05Å; H156-I159 HydrophobicContact CB-CB 4.25Å; H156-I159 HydrophobicContact CB-CD1 4.24Å; H156-I159 HydrophobicContact CB-CG1 4.37Å; H156-I159 PolarHBondContact O-N 3.03Å; H156-V160 PolarHBondContact O-N 2.79Å
157	G	98.7	Very high	98.5	Very high	14 Å²	14	43.4 Å²	43.4	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-30	-170.6	0	0	0	0	0	115.3	G155 V160 R161	G155-G157 PolarHBondContact O-N 2.99Å; G157-V160 PolarHBondContact O-N 3.36Å; G157-R161 PolarHBondContact O-N 3.14Å; G157-R161 VanDerWaalsContact O-N 3.08Å; G157-R161 PolarHBondContact O-NE 2.72Å
158	Q	98.7	Very high	98.4	Very high	117 Å²	117	44 Å²	44	55%	0.547	22%	0.215	S	C	.	.	H	α-helix	trans	-66.8	-39.4	174.1	-62	-168.3	40.3	0	0	111.6	L124 H156 R161 L162	L124-Q158 HydrophobicContact CD1-CB 3.97Å; L124-Q158 HydrophobicContact CD2-CB 4.09Å; H156-Q158 VanDerWaalsContact C-N 3.28Å; H156-Q158 PolarHBondContact O-N 3.05Å; Q158-R161 PolarHBondContact O-N 2.92Å; Q158-L162 WeakPolarHBondContact O-CB 3.5Å; Q158-L162 PolarHBondContact O-N 2.83Å
159	I	98.8	Very high	98.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.6	-38.5	175.8	-61.1	-178.3	0	0	0	110.7	C118 A119 L124 A127 A151 H156 R161 L162 L163	C118-I159 VanDerWaalsContact O-CD1 3.27Å; C118-I159 WeakPolarHBondContact O-CD1 3.46Å; A119-I159 HydrophobicContact CB-CG2 4.15Å; L124-I159 HydrophobicContact CD1-CG1 3.98Å; A127-I159 HydrophobicContact CB-CD1 4.45Å; A127-I159 HydrophobicContact CB-CG1 4.5Å; A151-I159 HydrophobicContact CB-CB 4.16Å; A151-I159 HydrophobicContact CB-CG2 3.88Å; H156-I159 HydrophobicContact CB-CB 4.25Å; H156-I159 HydrophobicContact CB-CD1 4.24Å; H156-I159 HydrophobicContact CB-CG1 4.37Å; H156-I159 PolarHBondContact O-N 3.03Å; I159-R161 VanDerWaalsContact C-N 3.34Å; I159-R161 PolarHBondContact O-N 2.7Å; I159-L162 WeakPolarHBondContact O-CB 3.37Å; I159-L162 PolarHBondContact O-N 2.74Å; I159-L163 HydrophobicContact CG2-CD1 3.76Å; I159-L163 HydrophobicContact CG2-CG 4.04Å; I159-L163 WeakPolarHBondContact O-CB 3.49Å; I159-L163 VanDerWaalsContact O-CG 3.25Å; I159-L163 WeakPolarHBondContact O-CG 3.3Å; I159-L163 PolarHBondContact O-N 2.83Å
160	V	98.9	Very high	98.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-54.2	-51.7	172.4	168.8	0	0	0	0	110.8	L148 A151 H156 G157 L162 L163 L164 I192 L196	L148-V160 HydrophobicContact CD1-CB 4.34Å; L148-V160 HydrophobicContact CD1-CG1 3.97Å; L148-V160 HydrophobicContact CD1-CG2 4.29Å; A151-V160 HydrophobicContact CB-CG2 3.69Å; H156-V160 PolarHBondContact O-N 2.79Å; G157-V160 PolarHBondContact O-N 3.36Å; V160-L162 PolarHBondContact O-N 3.34Å; V160-L163 PolarHBondContact O-N 3.27Å; V160-L164 HydrophobicContact CG1-CD1 3.86Å; V160-L164 HydrophobicContact CG1-CG 4.48Å; V160-L164 VanDerWaalsContact O-CG 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.26Å; V160-L164 PolarHBondContact O-N 3.44Å; V160-I192 HydrophobicContact CG1-CG2 4.28Å; V160-I192 HydrophobicContact CG2-CD1 4.01Å; V160-I192 HydrophobicContact CG2-CG1 4.34Å; V160-I192 HydrophobicContact CG2-CG2 4Å; V160-L196 HydrophobicContact CG1-CD2 4.29Å
161	R	98.7	Very high	98.4	Very high	99 Å²	99	52.1 Å²	52.1	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-41.9	179.1	-73.6	-179.6	-71.9	-102.4	5.3	112.3	G157 Q158 I159 L164 Q165 D195	G157-R161 PolarHBondContact O-N 3.14Å; G157-R161 VanDerWaalsContact O-N 3.08Å; G157-R161 PolarHBondContact O-NE 2.72Å; Q158-R161 PolarHBondContact O-N 2.92Å; I159-R161 VanDerWaalsContact C-N 3.34Å; I159-R161 PolarHBondContact O-N 2.7Å; R161-L164 PolarHBondContact O-N 2.99Å; R161-Q165 WeakPolarHBondContact O-CB 3.47Å; R161-Q165 VanDerWaalsContact O-CG 3.24Å; R161-Q165 WeakPolarHBondContact O-CG 3.49Å; R161-Q165 PolarHBondContact O-N 3.31Å; R161-D195 IonicContact CZ-OD2 3.65Å; R161-D195 IonicContact NE-OD2 2.72Å; R161-D195 IonicContact NH1-OD2 2.69Å; R161-D195 PolarHBondContact NH1-OD2 3.42Å
162	L	98.3	Very high	98.3	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.063	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-48.4	175.4	172.9	63.7	0	0	0	111.9	L124 A127 L128 Q158 I159 V160 Q165 N166	L124-L162 HydrophobicContact CD1-CD2 4.38Å; A127-L162 HydrophobicContact CB-CD2 3.79Å; L128-L162 HydrophobicContact CD2-CD1 3.5Å; L128-L162 VanDerWaalsContact CD2-CD1 3.5Å; L128-L162 HydrophobicContact CD2-CD2 3.96Å; L128-L162 HydrophobicContact CD2-CG 4.34Å; L128-L162 HydrophobicContact CG-CD1 4.39Å; L128-L162 HydrophobicContact CG-CD2 3.93Å; Q158-L162 WeakPolarHBondContact O-CB 3.5Å; Q158-L162 PolarHBondContact O-N 2.83Å; I159-L162 WeakPolarHBondContact O-CB 3.37Å; I159-L162 PolarHBondContact O-N 2.74Å; V160-L162 PolarHBondContact O-N 3.34Å; L162-Q165 WeakPolarHBondContact O-CB 3.24Å; L162-Q165 PolarHBondContact O-N 2.86Å; L162-N166 WeakPolarHBondContact CD1-ND2 3.5Å; L162-N166 PolarHBondContact O-N 3Å; L162-N166 VanDerWaalsContact O-N 3.1Å; L162-N166 PolarHBondContact O-ND2 3.45Å
163	L	98.6	Very high	98.3	Very high	1 Å²	1	60 Å²	60	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-44.6	-179.6	-72.1	172.1	0	0	0	110.9	L115 V137 P147 L148 A151 I159 V160 Q165 N166 N167 A168	L115-L163 HydrophobicContact CD1-CD2 4.34Å; L115-L163 HydrophobicContact CD2-CD2 4.01Å; L115-L163 HydrophobicContact CG-CD2 4.32Å; V137-L163 HydrophobicContact CB-CD2 3.93Å; V137-L163 HydrophobicContact CG1-CD2 4.28Å; V137-L163 HydrophobicContact CG2-CD2 4.28Å; P147-L163 HydrophobicContact CB-CD1 3.87Å; P147-L163 HydrophobicContact CB-CD2 4.08Å; L148-L163 HydrophobicContact CB-CD1 4.2Å; L148-L163 HydrophobicContact CD1-CB 4.3Å; L148-L163 HydrophobicContact CD1-CD1 4.38Å; A151-L163 HydrophobicContact CB-CD1 4.22Å; I159-L163 HydrophobicContact CG2-CD1 3.76Å; I159-L163 HydrophobicContact CG2-CG 4.04Å; I159-L163 WeakPolarHBondContact O-CB 3.49Å; I159-L163 VanDerWaalsContact O-CG 3.25Å; I159-L163 WeakPolarHBondContact O-CG 3.3Å; I159-L163 PolarHBondContact O-N 2.83Å; V160-L163 PolarHBondContact O-N 3.27Å; L163-Q165 VanDerWaalsContact C-N 3.31Å; L163-Q165 PolarHBondContact O-N 2.98Å; L163-N166 CarbonylContact O-C 3.57Å; L163-N166 VanDerWaalsContact O-C 3.28Å; L163-N166 WeakPolarHBondContact O-CA 3.47Å; L163-N166 PolarHBondContact O-N 3.26Å; L163-N167 PolarHBondContact O-N 2.69Å; L163-A168 VanDerWaalsContact C-CB 3.43Å; L163-A168 HydrophobicContact CB-CB 3.79Å; L163-A168 WeakPolarHBondContact O-CB 3.49Å; L163-A168 PolarHBondContact O-N 3.44Å
164	L	98.1	Very high	98.3	Very high	40 Å²	40	55.7 Å²	55.7	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-38.3	176	-68.8	170.6	0	0	0	112.3	L148 V160 R161 N166 N167 I170 L196 A199	L148-L164 HydrophobicContact CD1-CG 4.41Å; L148-L164 HydrophobicContact CD2-CD2 3.94Å; V160-L164 HydrophobicContact CG1-CD1 3.86Å; V160-L164 HydrophobicContact CG1-CG 4.48Å; V160-L164 VanDerWaalsContact O-CG 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.26Å; V160-L164 PolarHBondContact O-N 3.44Å; R161-L164 PolarHBondContact O-N 2.99Å; L164-N166 PolarHBondContact O-N 3.46Å; L164-N167 PolarHBondContact O-N 3.41Å; L164-I170 HydrophobicContact CD2-CB 4.26Å; L164-I170 HydrophobicContact CD2-CD1 4.13Å; L164-I170 HydrophobicContact CD2-CG1 4.24Å; L164-L196 HydrophobicContact CD1-CD2 4.28Å; L164-L196 HydrophobicContact CD2-CD2 4.5Å; L164-A199 HydrophobicContact CD1-CB 3.89Å; L164-A199 HydrophobicContact CD2-CB 4.33Å
165	Q	97.1	Very high	98.3	Very high	151 Å²	151	57.6 Å²	57.6	71%	0.706	29%	0.287	S	S	*	.	H	α-helix	trans	-65.7	-24.5	173.8	-73.6	170.3	-6.5	0	0	113	R161 L162 L163	R161-Q165 WeakPolarHBondContact O-CB 3.47Å; R161-Q165 VanDerWaalsContact O-CG 3.24Å; R161-Q165 WeakPolarHBondContact O-CG 3.49Å; R161-Q165 PolarHBondContact O-N 3.31Å; L162-Q165 WeakPolarHBondContact O-CB 3.24Å; L162-Q165 PolarHBondContact O-N 2.86Å; L163-Q165 VanDerWaalsContact C-N 3.31Å; L163-Q165 PolarHBondContact O-N 2.98Å
166	N	97.4	Very high	98.2	Very high	46 Å²	46	60.4 Å²	60.4	25%	0.246	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	36.4	177.8	-70.4	-90.9	0	0	0	111.9	A131 V137 L162 L163 L164 A168	A131-N166 HydrophobicContact CB-CB 4.5Å; V137-N166 HydrophobicContact CG1-CB 4.05Å; V137-N166 VanDerWaalsContact CG2-O 3.25Å; V137-N166 WeakPolarHBondContact CG2-O 3.45Å; L162-N166 WeakPolarHBondContact CD1-ND2 3.5Å; L162-N166 PolarHBondContact O-N 3Å; L162-N166 VanDerWaalsContact O-N 3.1Å; L162-N166 PolarHBondContact O-ND2 3.45Å; L163-N166 CarbonylContact O-C 3.57Å; L163-N166 VanDerWaalsContact O-C 3.28Å; L163-N166 WeakPolarHBondContact O-CA 3.47Å; L163-N166 PolarHBondContact O-N 3.26Å; L164-N166 PolarHBondContact O-N 3.46Å; N166-A168 VanDerWaalsContact C-N 3.31Å; N166-A168 PolarHBondContact O-N 3Å
167	N	96.5	Very high	98.2	Very high	136 Å²	136	59.5 Å²	59.5	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	33.7	172.7	-55.8	101	0	0	0	114.6	N138 L163 L164 L169	N138-N167 PolarHBondContact ND2-O 3.43Å; N138-N167 VanDerWaalsContact ND2-O 3.12Å; L163-N167 PolarHBondContact O-N 2.69Å; L164-N167 PolarHBondContact O-N 3.41Å; N167-L169 PolarHBondContact O-N 3.08Å
168	A	98.4	Very high	98.2	Very high	12 Å²	12	61.9 Å²	61.9	10%	0.099	30%	0.298	C	S	.	.			trans	-62.6	134	167.8	0	0	0	0	0	111.1	V137 N138 L148 L163 N166 I170	V137-A168 HydrophobicContact CG2-CB 3.76Å; N138-A168 VanDerWaalsContact OD1-CA 3.28Å; N138-A168 WeakPolarHBondContact OD1-CA 3.3Å; L148-A168 HydrophobicContact CB-CB 4.3Å; L148-A168 HydrophobicContact CD2-CB 3.97Å; L163-A168 VanDerWaalsContact C-CB 3.43Å; L163-A168 HydrophobicContact CB-CB 3.79Å; L163-A168 WeakPolarHBondContact O-CB 3.49Å; L163-A168 PolarHBondContact O-N 3.44Å; N166-A168 VanDerWaalsContact C-N 3.31Å; N166-A168 PolarHBondContact O-N 3Å; A168-I170 PolarHBondContact O-N 2.97Å; A168-I170 VanDerWaalsContact O-N 3.09Å
169	L	98.5	Very high	98.2	Very high	90 Å²	90	56.7 Å²	56.7	47%	0.471	27%	0.273	S	S	.	.			trans	-68.9	104	177.3	-66.8	176.6	0	0	0	109.4	N138 N167 D171 A172	N138-L169 HydrophobicContact CB-CD1 4.12Å; N138-L169 HydrophobicContact CB-CG 4.32Å; N138-L169 PolarHBondContact OD1-N 3.05Å; N167-L169 PolarHBondContact O-N 3.08Å; L169-D171 PolarHBondContact O-N 2.98Å; L169-A172 HydrophobicContact CB-CB 3.9Å; L169-A172 WeakPolarHBondContact O-CB 3.27Å; L169-A172 PolarHBondContact O-N 3.31Å
170	I	98.2	Very high	98.2	Very high	30 Å²	30	56.7 Å²	56.7	15%	0.154	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26	-178.3	-165.9	162.8	0	0	0	113.2	L164 A168 L196 A199 A201	L164-I170 HydrophobicContact CD2-CB 4.26Å; L164-I170 HydrophobicContact CD2-CD1 4.13Å; L164-I170 HydrophobicContact CD2-CG1 4.24Å; A168-I170 PolarHBondContact O-N 2.97Å; A168-I170 VanDerWaalsContact O-N 3.09Å; I170-L196 HydrophobicContact CD1-CD2 4.39Å; I170-L196 WeakPolarHBondContact CD1-O 3.41Å; I170-L196 HydrophobicContact CG1-CD2 4.14Å; I170-A199 HydrophobicContact CD1-CB 3.49Å; I170-A199 VanDerWaalsContact CD1-CB 3.49Å; I170-A201 HydrophobicContact CD1-CB 3.79Å; I170-A201 HydrophobicContact CG1-CB 3.83Å
171	D	98	Very high	98.2	Very high	94 Å²	94	56.7 Å²	56.7	50%	0.503	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	10	-176.5	66.5	-24.7	0	0	0	113.1	L169 Q179	L169-D171 PolarHBondContact O-N 2.98Å; D171-Q179 PolarHBondContact O-NE2 3.42Å
172	A	98.5	Very high	98.2	Very high	14 Å²	14	52.1 Å²	52.1	12%	0.116	26%	0.256	C	S	.	.			trans	-51.6	143.6	173.4	0	0	0	0	0	110.6	T146 H149 L169 Q179	T146-A172 HydrophobicContact CG2-CB 3.91Å; H149-A172 PolarHBondContact CE1-O 2.97Å; H149-A172 PolarHBondContact NE2-O 3.09Å; L169-A172 HydrophobicContact CB-CB 3.9Å; L169-A172 WeakPolarHBondContact O-CB 3.27Å; L169-A172 PolarHBondContact O-N 3.31Å; A172-Q179 WeakPolarHBondContact O-CA 3.47Å; A172-Q179 WeakPolarHBondContact O-CG 3.13Å
173	R	98.5	Very high	98.2	Very high	151 Å²	151	51.9 Å²	51.9	57%	0.57	26%	0.255	S	S	*	.			trans	-121.5	131.4	-176.4	-67.9	-176.8	179.7	-177.2	-2.2	110.7	R178 Q179	R173-R178 WeakPolarHBondContact CA-O 3.49Å; R173-Q179 HydrophobicContact CG-CG 3.97Å
174	D	98.5	Very high	98.2	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.043	26%	0.255	C	S	.	.			trans	-72.7	-178.9	166.6	78.8	-0.9	0	0	0	111.7	Y145 Q176 G177 R178	Y145-D174 HydrophobicContact CD2-CB 3.85Å; Y145-D174 HydrophobicContact CE2-CB 3.83Å; Y145-D174 VanDerWaalsContact CE2-OD2 3.26Å; Y145-D174 WeakPolarHBondContact CE2-OD2 3.42Å; Y145-D174 HydrophobicContact CG-CB 4.47Å; Y145-D174 PolarHBondContact OH-OD2 3.29Å; D174-Q176 PolarHBondContact O-N 3.38Å; D174-Q176 VanDerWaalsContact O-N 3.14Å; D174-Q176 VanDerWaalsContact OD1-C 3.28Å; D174-Q176 VanDerWaalsContact OD1-CA 3.3Å; D174-Q176 WeakPolarHBondContact OD1-CA 3.37Å; D174-Q176 WeakPolarHBondContact OD1-CB 3.29Å; D174-Q176 PolarHBondContact OD1-N 3.19Å; D174-G177 PolarHBondContact O-N 2.93Å; D174-G177 PolarHBondContact OD1-N 2.93Å; D174-R178 PolarHBondContact N-O 3.23Å; D174-R178 WeakPolarHBondContact OD1-CB 3.34Å; D174-R178 PolarHBondContact OD1-N 3.18Å; D174-R178 IonicContact OD1-NE 3.11Å; D174-R178 IonicContact OD2-CZ 3.62Å; D174-R178 IonicContact OD2-NE 3.8Å; D174-R178 PolarHBondContact OD2-NE 2.95Å; D174-R178 IonicContact OD2-NH2 3.76Å; D174-R178 PolarHBondContact OD2-NH2 3.34Å
175	Q	97.9	Very high	98.2	Very high	135 Å²	135	49.9 Å²	49.9	63%	0.631	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.8	178.3	-80.9	178.5	-5.5	0	0	114.6	K142 A143	K142-Q175 PolarHBondContact O-NE2 3.49Å; A143-Q175 WeakPolarHBondContact O-CB 3.5Å; A143-Q175 VanDerWaalsContact O-CG 3.3Å; A143-Q175 WeakPolarHBondContact O-CG 3.34Å; A143-Q175 PolarHBondContact O-N 3.4Å
176	Q	97.7	Very high	98.3	Very high	85 Å²	85	47.2 Å²	47.2	40%	0.397	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7.5	176.3	-69.6	70.7	52.4	0	0	111.5	D174 R178 G208	D174-Q176 PolarHBondContact O-N 3.38Å; D174-Q176 VanDerWaalsContact O-N 3.14Å; D174-Q176 VanDerWaalsContact OD1-C 3.28Å; D174-Q176 VanDerWaalsContact OD1-CA 3.3Å; D174-Q176 WeakPolarHBondContact OD1-CA 3.37Å; D174-Q176 WeakPolarHBondContact OD1-CB 3.29Å; D174-Q176 PolarHBondContact OD1-N 3.19Å; Q176-R178 HydrophobicContact CB-CG 4.24Å; Q176-R178 PolarHBondContact O-N 3.03Å; Q176-G208 WeakPolarHBondContact O-CA 3.49Å; Q176-G208 PolarHBondContact O-N 3.33Å
177	G	98.1	Very high	98.4	Very high	14 Å²	14	46.4 Å²	46.4	14%	0.144	23%	0.231	C	C	.	.			trans	75.8	5.3	-178.6	0	0	0	0	0	114	D174 D207	D174-G177 PolarHBondContact O-N 2.93Å; D174-G177 PolarHBondContact OD1-N 2.93Å; G177-D207 WeakPolarHBondContact O-CA 3.35Å
178	R	98.6	Very high	98.5	Very high	65 Å²	65	41.1 Å²	41.1	25%	0.245	21%	0.208	C	C	.	.			trans	-75.2	140.2	-178.8	-60.5	175.1	-63.8	-154.6	-12.5	109.2	Y145 H149 R173 D174 Q176 H182 L183 D207	Y145-R178 PolarHBondContact OH-NH2 2.96Å; H149-R178 PolarHBondContact NE2-O 2.92Å; R173-R178 WeakPolarHBondContact CA-O 3.49Å; D174-R178 PolarHBondContact N-O 3.23Å; D174-R178 WeakPolarHBondContact OD1-CB 3.34Å; D174-R178 PolarHBondContact OD1-N 3.18Å; D174-R178 IonicContact OD1-NE 3.11Å; D174-R178 IonicContact OD2-CZ 3.62Å; D174-R178 IonicContact OD2-NE 3.8Å; D174-R178 PolarHBondContact OD2-NE 2.95Å; D174-R178 IonicContact OD2-NH2 3.76Å; D174-R178 PolarHBondContact OD2-NH2 3.34Å; Q176-R178 HydrophobicContact CB-CG 4.24Å; Q176-R178 PolarHBondContact O-N 3.03Å; R178-H182 HydrophobicContact CB-CB 4.29Å; R178-L183 HydrophobicContact CB-CD2 4.36Å; R178-D207 HydrophobicContact CG-CB 3.9Å
179	Q	98.6	Very high	98.5	Very high	7 Å²	7	43.1 Å²	43.1	3%	0.033	22%	0.215	C	C	.	.			trans	-103.7	164.4	174.6	-57.6	-176.7	-25.4	0	0	110.4	D171 A172 R173 L181 H182 L183 A205	D171-Q179 PolarHBondContact O-NE2 3.42Å; A172-Q179 WeakPolarHBondContact O-CA 3.47Å; A172-Q179 WeakPolarHBondContact O-CG 3.13Å; R173-Q179 HydrophobicContact CG-CG 3.97Å; Q179-L181 PolarHBondContact O-N 3.05Å; Q179-L181 VanDerWaalsContact O-N 3.08Å; Q179-H182 WeakPolarHBondContact CB-ND1 3.28Å; Q179-H182 PolarHBondContact N-ND1 2.87Å; Q179-H182 WeakPolarHBondContact O-CB 3.46Å; Q179-H182 PolarHBondContact O-N 2.85Å; Q179-L183 PolarHBondContact O-N 2.95Å; Q179-A205 VanDerWaalsContact OE1-CB 3.28Å
180	P	98.8	Very high	98.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-52.1	-35.3	176.8	-28.5	36.6	0	0	0	113.9	L148 H149 A152 H182 L183 A184 L196	L148-P180 HydrophobicContact CB-CG 4.22Å; L148-P180 HydrophobicContact CD2-CB 4.3Å; L148-P180 HydrophobicContact CD2-CG 3.87Å; L148-P180 HydrophobicContact CG-CB 3.91Å; L148-P180 HydrophobicContact CG-CG 3.72Å; H149-P180 WeakPolarHBondContact NE2-CD 3.35Å; A152-P180 HydrophobicContact CB-CB 3.88Å; A152-P180 WeakPolarHBondContact CB-O 3.35Å; P180-H182 PolarHBondContact O-N 3.25Å; P180-L183 PolarHBondContact O-N 3.42Å; P180-A184 PolarHBondContact O-N 3.09Å; P180-L196 HydrophobicContact CB-CD1 4.22Å; P180-L196 HydrophobicContact CB-CD2 4.42Å
181	L	98.5	Very high	98.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-40.7	176.3	-176.7	64.6	0	0	0	112.7	Q179 L183 A185 V193 L196 L197 A201 P203 A213	Q179-L181 PolarHBondContact O-N 3.05Å; Q179-L181 VanDerWaalsContact O-N 3.08Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 2.92Å; L181-A185 VanDerWaalsContact O-CB 3.22Å; L181-A185 WeakPolarHBondContact O-CB 3.34Å; L181-A185 PolarHBondContact O-N 2.94Å; L181-V193 HydrophobicContact CD1-CB 4.38Å; L181-V193 HydrophobicContact CD1-CG1 3.89Å; L181-V193 HydrophobicContact CD1-CG2 4.42Å; L181-L196 HydrophobicContact CB-CD1 4.3Å; L181-L196 HydrophobicContact CD1-CB 4.12Å; L181-L196 HydrophobicContact CD1-CD1 4.33Å; L181-L197 HydrophobicContact CD1-CD2 4.31Å; L181-L197 HydrophobicContact CD1-CG 4.25Å; L181-L197 HydrophobicContact CD2-CD2 3.95Å; L181-A201 HydrophobicContact CB-CB 4.26Å; L181-A201 HydrophobicContact CD2-CB 3.93Å; L181-P203 HydrophobicContact CD2-CB 4.25Å; L181-A213 HydrophobicContact CD2-CB 3.92Å; L181-A213 HydrophobicContact CG-CB 3.91Å
182	H	98.7	Very high	98.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-44.5	176.6	-62.8	91.7	0	0	0	110.8	R178 Q179 P180 A185 F186 A205 Y211 C216	R178-H182 HydrophobicContact CB-CB 4.29Å; Q179-H182 WeakPolarHBondContact CB-ND1 3.28Å; Q179-H182 PolarHBondContact N-ND1 2.87Å; Q179-H182 WeakPolarHBondContact O-CB 3.46Å; Q179-H182 PolarHBondContact O-N 2.85Å; P180-H182 PolarHBondContact O-N 3.25Å; H182-A185 PolarHBondContact O-N 3.2Å; H182-F186 WeakPolarHBondContact O-CB 3.27Å; H182-F186 PolarHBondContact O-N 3.13Å; H182-A205 PolarHBondContact NE2-O 3.25Å; H182-A205 VanDerWaalsContact NE2-O 3.1Å; H182-Y211 PolarHBondContact NE2-O 3.4Å; H182-C216 WeakPolarHBondContact O-CB 3.45Å
183	L	98.8	Very high	98.5	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-69.3	-43.4	-178.5	-60.2	-176.4	0	0	0	112.4	Y145 H149 Y153 R178 Q179 P180 L181 A185 F186 A187	Y145-L183 HydrophobicContact CD1-CD1 4.05Å; Y145-L183 HydrophobicContact CE1-CD1 3.48Å; Y145-L183 VanDerWaalsContact CE1-CD1 3.48Å; H149-L183 HydrophobicContact CB-CD1 3.75Å; Y153-L183 HydrophobicContact CD2-CB 4.18Å; R178-L183 HydrophobicContact CB-CD2 4.36Å; Q179-L183 PolarHBondContact O-N 2.95Å; P180-L183 PolarHBondContact O-N 3.42Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 2.92Å; L183-A185 VanDerWaalsContact C-N 3.34Å; L183-F186 PolarHBondContact O-N 3.42Å; L183-A187 VanDerWaalsContact O-CB 3.26Å; L183-A187 WeakPolarHBondContact O-CB 3.26Å; L183-A187 PolarHBondContact O-N 3.06Å
184	A	98.8	Very high	98.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-41	175.3	0	0	0	0	0	112.1	A152 P180 A187 G188 H189 I192 V193 L196	A152-A184 HydrophobicContact CB-CB 4.17Å; P180-A184 PolarHBondContact O-N 3.09Å; A184-A187 PolarHBondContact O-N 3.42Å; A184-G188 PolarHBondContact O-N 3.31Å; A184-H189 PolarHBondContact O-N 3.37Å; A184-I192 HydrophobicContact CB-CB 4.34Å; A184-I192 HydrophobicContact CB-CG2 3.71Å; A184-V193 HydrophobicContact CB-CG2 3.88Å; A184-L196 HydrophobicContact CB-CD1 4.18Å
185	A	98.7	Very high	98.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-44.2	177.1	0	0	0	0	0	111.9	L181 H182 L183 G188 V193 A213 C216 A217 H222 I225	L181-A185 VanDerWaalsContact O-CB 3.22Å; L181-A185 WeakPolarHBondContact O-CB 3.34Å; L181-A185 PolarHBondContact O-N 2.94Å; H182-A185 PolarHBondContact O-N 3.2Å; L183-A185 VanDerWaalsContact C-N 3.34Å; A185-G188 PolarHBondContact O-N 3.17Å; A185-V193 HydrophobicContact CB-CG2 4.25Å; A185-A213 HydrophobicContact CB-CB 4.41Å; A185-A213 WeakPolarHBondContact CB-O 3.3Å; A185-C216 HydrophobicContact CB-CB 4.14Å; A185-A217 HydrophobicContact CB-CB 4.25Å; A185-A217 WeakPolarHBondContact O-CA 3.34Å; A185-H222 PolarHBondContact O-CD2 3.41Å; A185-H222 VanDerWaalsContact O-CD2 3.22Å; A185-I225 HydrophobicContact CB-CG2 4.26Å
186	F	98.7	Very high	98.2	Very high	94 Å²	94	29.5 Å²	29.5	41%	0.412	16%	0.156	S	C	.	.	H	α-helix	trans	-64.7	-37	176.2	177.8	-98.2	0	0	0	113	Y153 H182 L183 C216 A219 H222	Y153-F186 HydrophobicContact CE2-CD1 4.25Å; H182-F186 WeakPolarHBondContact O-CB 3.27Å; H182-F186 PolarHBondContact O-N 3.13Å; L183-F186 PolarHBondContact O-N 3.42Å; F186-C216 HydrophobicContact CB-CB 4.08Å; F186-A219 HydrophobicContact CD2-CB 4.2Å; F186-A219 HydrophobicContact CE2-CB 4.22Å; F186-H222 PolarHBondContact O-CD2 3.46Å; F186-H222 PolarHBondContact O-NE2 2.88Å
187	A	98.6	Very high	98.1	Very high	30 Å²	30	27 Å²	27	25%	0.248	15%	0.145	C	C	.	.	H	α-helix	trans	-84.9	-10	-178.7	0	0	0	0	0	114	Y153 L183 A184	Y153-A187 HydrophobicContact CD2-CB 4.16Å; Y153-A187 HydrophobicContact CE2-CB 4.4Å; Y153-A187 WeakPolarHBondContact O-CB 3.43Å; L183-A187 VanDerWaalsContact O-CB 3.26Å; L183-A187 WeakPolarHBondContact O-CB 3.26Å; L183-A187 PolarHBondContact O-N 3.06Å; A184-A187 PolarHBondContact O-N 3.42Å
188	G	98.6	Very high	97.9	Very high	24 Å²	24	32.7 Å²	32.7	25%	0.247	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	89	17.2	173.9	0	0	0	0	0	115.8	A184 A185 Q190 H222	A184-G188 PolarHBondContact O-N 3.31Å; A185-G188 PolarHBondContact O-N 3.17Å; G188-Q190 PolarHBondContact O-N 3.45Å; G188-H222 WeakPolarHBondContact CA-CD2 3.46Å; G188-H222 WeakPolarHBondContact CA-CE1 3.39Å; G188-H222 VanDerWaalsContact CA-CG 3.43Å; G188-H222 WeakPolarHBondContact CA-ND1 3.48Å; G188-H222 VanDerWaalsContact CA-NE2 3.34Å; G188-H222 WeakPolarHBondContact CA-NE2 3.39Å; G188-H222 PolarHBondContact N-CD2 3.03Å; G188-H222 PolarHBondContact N-NE2 2.97Å
189	H	98.7	Very high	97.7	Very high	54 Å²	54	32.2 Å²	32.2	25%	0.25	17%	0.172	C	C	.	.			trans	-86.3	75.1	-176.5	-60.2	-54.5	0	0	0	111.8	A152 Y153 G155 A184 T191 I192 V193	A152-H189 PolarHBondContact O-CD2 3.32Å; Y153-H189 PolarHBondContact O-CD2 3.19Å; Y153-H189 PolarHBondContact O-NE2 3.08Å; G155-H189 VanDerWaalsContact CA-CD2 3.49Å; G155-H189 WeakPolarHBondContact CA-CD2 3.35Å; G155-H189 WeakPolarHBondContact CA-CE1 3.2Å; G155-H189 WeakPolarHBondContact CA-ND1 3.49Å; G155-H189 WeakPolarHBondContact CA-NE2 3.35Å; G155-H189 PolarHBondContact N-CD2 2.91Å; G155-H189 PolarHBondContact N-NE2 3.49Å; A184-H189 PolarHBondContact O-N 3.37Å; H189-T191 PolarHBondContact O-N 3.25Å; H189-I192 HydrophobicContact CB-CB 3.99Å; H189-I192 HydrophobicContact CB-CD1 3.98Å; H189-I192 HydrophobicContact CB-CG1 4.23Å; H189-I192 WeakPolarHBondContact O-CB 3.49Å; H189-I192 PolarHBondContact O-N 3.49Å; H189-V193 PolarHBondContact O-N 3.48Å
190	Q	98	Very high	97.5	Very high	77 Å²	77	34.3 Å²	34.3	36%	0.36	20%	0.196	S	C	.	.	H	α-helix	trans	-52.2	-47.9	-173.7	-175.8	-175.3	-35.2	0	0	113.6	G188 I192 V193 E194 I225 L228	G188-Q190 PolarHBondContact O-N 3.45Å; Q190-I192 PolarHBondContact O-N 3.1Å; Q190-V193 WeakPolarHBondContact O-CB 3.41Å; Q190-V193 PolarHBondContact O-N 3.29Å; Q190-V193 VanDerWaalsContact O-N 3.11Å; Q190-E194 PolarHBondContact NE2-OE1 3.49Å; Q190-E194 VanDerWaalsContact NE2-OE1 3.08Å; Q190-E194 PolarHBondContact O-N 2.92Å; Q190-I225 HydrophobicContact CB-CD1 4.29Å; Q190-I225 HydrophobicContact CB-CG1 3.93Å; Q190-I225 HydrophobicContact CG-CG1 4.22Å; Q190-L228 HydrophobicContact CG-CD1 4.11Å
191	T	98	Very high	97.4	Very high	86 Å²	86	34.7 Å²	34.7	53%	0.528	20%	0.199	S	C	.	.	H	α-helix	trans	-61.4	-33.5	179.6	-50.8	0	0	0	0	112.4	H189 D195	H189-T191 PolarHBondContact O-N 3.25Å; T191-D195 VanDerWaalsContact O-CG 3.31Å; T191-D195 PolarHBondContact O-N 3.48Å
192	I	98.7	Very high	97.2	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-73.5	-39.3	176.2	-68.4	178.4	0	0	0	110.7	A152 V160 A184 H189 Q190 E194 D195 L196	A152-I192 HydrophobicContact CB-CG2 4.24Å; V160-I192 HydrophobicContact CG1-CG2 4.28Å; V160-I192 HydrophobicContact CG2-CD1 4.01Å; V160-I192 HydrophobicContact CG2-CG1 4.34Å; V160-I192 HydrophobicContact CG2-CG2 4Å; A184-I192 HydrophobicContact CB-CB 4.34Å; A184-I192 HydrophobicContact CB-CG2 3.71Å; H189-I192 HydrophobicContact CB-CB 3.99Å; H189-I192 HydrophobicContact CB-CD1 3.98Å; H189-I192 HydrophobicContact CB-CG1 4.23Å; H189-I192 WeakPolarHBondContact O-CB 3.49Å; H189-I192 PolarHBondContact O-N 3.49Å; Q190-I192 PolarHBondContact O-N 3.1Å; I192-E194 VanDerWaalsContact C-N 3.3Å; I192-E194 PolarHBondContact O-N 3.23Å; I192-D195 PolarHBondContact O-N 2.98Å; I192-L196 HydrophobicContact CG2-CD1 3.83Å; I192-L196 HydrophobicContact CG2-CG 4.21Å; I192-L196 WeakPolarHBondContact O-CB 3.26Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.22Å; I192-L196 PolarHBondContact O-N 2.89Å
193	V	98	Very high	96.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.6	-47.6	172.1	172.5	0	0	0	0	110	L181 A184 A185 H189 Q190 D195 L196 L197 I225 L228 L229	L181-V193 HydrophobicContact CD1-CB 4.38Å; L181-V193 HydrophobicContact CD1-CG1 3.89Å; L181-V193 HydrophobicContact CD1-CG2 4.42Å; A184-V193 HydrophobicContact CB-CG2 3.88Å; A185-V193 HydrophobicContact CB-CG2 4.25Å; H189-V193 PolarHBondContact O-N 3.48Å; Q190-V193 WeakPolarHBondContact O-CB 3.41Å; Q190-V193 PolarHBondContact O-N 3.29Å; Q190-V193 VanDerWaalsContact O-N 3.11Å; V193-D195 PolarHBondContact O-N 2.94Å; V193-L196 PolarHBondContact O-N 3.34Å; V193-L197 HydrophobicContact CG1-CD1 3.79Å; V193-L197 HydrophobicContact CG1-CG 4.35Å; V193-L197 WeakPolarHBondContact O-CB 3.26Å; V193-L197 WeakPolarHBondContact O-CG 3.36Å; V193-L197 PolarHBondContact O-N 3.12Å; V193-I225 HydrophobicContact CG1-CG2 4.21Å; V193-I225 HydrophobicContact CG2-CD1 4.17Å; V193-I225 HydrophobicContact CG2-CG2 4.2Å; V193-L228 HydrophobicContact CG1-CD2 3.67Å; V193-L229 HydrophobicContact CG1-CD2 4.31Å
194	E	96	Very high	96.7	Very high	51 Å²	51	41.2 Å²	41.2	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-45.8	174.9	-76.1	173.8	-150.7	0	0	113	Q190 I192 L197 R198 L228	Q190-E194 PolarHBondContact NE2-OE1 3.49Å; Q190-E194 VanDerWaalsContact NE2-OE1 3.08Å; Q190-E194 PolarHBondContact O-N 2.92Å; I192-E194 VanDerWaalsContact C-N 3.3Å; I192-E194 PolarHBondContact O-N 3.23Å; E194-L197 PolarHBondContact O-N 3.16Å; E194-R198 VanDerWaalsContact O-CB 3.23Å; E194-R198 WeakPolarHBondContact O-CB 3.29Å; E194-R198 PolarHBondContact O-N 3.08Å; E194-L228 HydrophobicContact CG-CD1 3.37Å; E194-L228 VanDerWaalsContact OE1-CD1 3.31Å; E194-L228 WeakPolarHBondContact OE1-CD1 3.31Å
195	D	96.4	Very high	96.5	Very high	17 Å²	17	41.7 Å²	41.7	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-43.9	179.2	-76	-9.8	0	0	0	112	R161 T191 I192 V193 R198 A199	R161-D195 IonicContact CZ-OD2 3.65Å; R161-D195 IonicContact NE-OD2 2.72Å; R161-D195 IonicContact NH1-OD2 2.69Å; R161-D195 PolarHBondContact NH1-OD2 3.42Å; T191-D195 VanDerWaalsContact O-CG 3.31Å; T191-D195 PolarHBondContact O-N 3.48Å; I192-D195 PolarHBondContact O-N 2.98Å; V193-D195 PolarHBondContact O-N 2.94Å; D195-R198 PolarHBondContact O-N 2.94Å; D195-R198 IonicContact OD1-CZ 2.7Å; D195-R198 IonicContact OD1-NH1 3.12Å; D195-R198 PolarHBondContact OD1-NH1 3.46Å; D195-A199 WeakPolarHBondContact O-CB 3.49Å; D195-A199 PolarHBondContact O-N 3.41Å
196	L	97.7	Very high	96.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-45.6	176.9	-70.8	171	0	0	0	111	L148 A152 V160 L164 I170 P180 L181 A184 I192 V193 R198 A199 G200 A201	L148-L196 HydrophobicContact CD1-CD2 4.42Å; L148-L196 HydrophobicContact CD2-CD2 4.48Å; A152-L196 HydrophobicContact CB-CD1 4.45Å; V160-L196 HydrophobicContact CG1-CD2 4.29Å; L164-L196 HydrophobicContact CD1-CD2 4.28Å; L164-L196 HydrophobicContact CD2-CD2 4.5Å; I170-L196 HydrophobicContact CD1-CD2 4.39Å; I170-L196 WeakPolarHBondContact CD1-O 3.41Å; I170-L196 HydrophobicContact CG1-CD2 4.14Å; P180-L196 HydrophobicContact CB-CD1 4.22Å; P180-L196 HydrophobicContact CB-CD2 4.42Å; L181-L196 HydrophobicContact CB-CD1 4.3Å; L181-L196 HydrophobicContact CD1-CB 4.12Å; L181-L196 HydrophobicContact CD1-CD1 4.33Å; A184-L196 HydrophobicContact CB-CD1 4.18Å; I192-L196 HydrophobicContact CG2-CD1 3.83Å; I192-L196 HydrophobicContact CG2-CG 4.21Å; I192-L196 WeakPolarHBondContact O-CB 3.26Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.22Å; I192-L196 PolarHBondContact O-N 2.89Å; V193-L196 PolarHBondContact O-N 3.34Å; L196-R198 VanDerWaalsContact C-N 3.31Å; L196-R198 PolarHBondContact O-N 3.18Å; L196-A199 CarbonylContact O-C 3.59Å; L196-A199 PolarHBondContact O-N 3.39Å; L196-A199 VanDerWaalsContact O-N 3.13Å; L196-G200 PolarHBondContact O-N 3.13Å; L196-G200 VanDerWaalsContact O-N 3.09Å; L196-A201 HydrophobicContact CB-CB 3.98Å; L196-A201 VanDerWaalsContact O-CB 3.27Å; L196-A201 WeakPolarHBondContact O-CB 3.35Å; L196-A201 PolarHBondContact O-N 3.01Å
197	L	95.1	Very high	96.4	Very high	34 Å²	34	43.9 Å²	43.9	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-40.2	175.1	-67.4	170.2	0	0	0	111.6	L181 V193 E194 A199 G200 P203 L228 L229	L181-L197 HydrophobicContact CD1-CD2 4.31Å; L181-L197 HydrophobicContact CD1-CG 4.25Å; L181-L197 HydrophobicContact CD2-CD2 3.95Å; V193-L197 HydrophobicContact CG1-CD1 3.79Å; V193-L197 HydrophobicContact CG1-CG 4.35Å; V193-L197 WeakPolarHBondContact O-CB 3.26Å; V193-L197 WeakPolarHBondContact O-CG 3.36Å; V193-L197 PolarHBondContact O-N 3.12Å; E194-L197 PolarHBondContact O-N 3.16Å; L197-A199 VanDerWaalsContact C-N 3.26Å; L197-A199 PolarHBondContact O-N 2.76Å; L197-G200 PolarHBondContact O-N 2.88Å; L197-P203 HydrophobicContact CD2-CB 3.96Å; L197-P203 HydrophobicContact CD2-CG 4.12Å; L197-L228 HydrophobicContact CD1-CD2 3.69Å; L197-L229 HydrophobicContact CD1-CD2 3.96Å; L197-L229 HydrophobicContact CD2-CD2 4.43Å
198	R	93.8	Very high	96.3	Very high	132 Å²	132	44.9 Å²	44.9	50%	0.498	26%	0.259	S	S	.	.	H	α-helix	trans	-66.9	-28.5	175.8	-164.9	-177.8	-55.3	106.5	2.6	112.4	E194 D195 L196 G200 R235	E194-R198 VanDerWaalsContact O-CB 3.23Å; E194-R198 WeakPolarHBondContact O-CB 3.29Å; E194-R198 PolarHBondContact O-N 3.08Å; D195-R198 PolarHBondContact O-N 2.94Å; D195-R198 IonicContact OD1-CZ 2.7Å; D195-R198 IonicContact OD1-NH1 3.12Å; D195-R198 PolarHBondContact OD1-NH1 3.46Å; L196-R198 VanDerWaalsContact C-N 3.31Å; L196-R198 PolarHBondContact O-N 3.18Å; R198-G200 VanDerWaalsContact C-N 3.3Å; R198-R235 PolarHBondContact O-NH1 3.38Å
199	A	95.3	Very high	96.1	Very high	55 Å²	55	49.1 Å²	49.1	46%	0.455	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.7	173.2	0	0	0	0	0	113.5	L164 I170 D195 L196 L197	L164-A199 HydrophobicContact CD1-CB 3.89Å; L164-A199 HydrophobicContact CD2-CB 4.33Å; I170-A199 HydrophobicContact CD1-CB 3.49Å; I170-A199 VanDerWaalsContact CD1-CB 3.49Å; D195-A199 WeakPolarHBondContact O-CB 3.49Å; D195-A199 PolarHBondContact O-N 3.41Å; L196-A199 CarbonylContact O-C 3.59Å; L196-A199 PolarHBondContact O-N 3.39Å; L196-A199 VanDerWaalsContact O-N 3.13Å; L197-A199 VanDerWaalsContact C-N 3.26Å; L197-A199 PolarHBondContact O-N 2.76Å
200	G	93.8	Very high	96	Very high	52 Å²	52	48.3 Å²	48.3	54%	0.536	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	101	16.6	173.7	0	0	0	0	0	115.3	L196 L197 R198 N202	L196-G200 PolarHBondContact O-N 3.13Å; L196-G200 VanDerWaalsContact O-N 3.09Å; L197-G200 PolarHBondContact O-N 2.88Å; R198-G200 VanDerWaalsContact C-N 3.3Å; G200-N202 PolarHBondContact O-N 3.18Å
201	A	95.5	Very high	95.9	Very high	8 Å²	8	46.7 Å²	46.7	7%	0.066	26%	0.262	C	S	.	.			trans	-58.9	134.3	172.2	0	0	0	0	0	110	I170 L181 L196 P203	I170-A201 HydrophobicContact CD1-CB 3.79Å; I170-A201 HydrophobicContact CG1-CB 3.83Å; L181-A201 HydrophobicContact CB-CB 4.26Å; L181-A201 HydrophobicContact CD2-CB 3.93Å; L196-A201 HydrophobicContact CB-CB 3.98Å; L196-A201 VanDerWaalsContact O-CB 3.27Å; L196-A201 WeakPolarHBondContact O-CB 3.35Å; L196-A201 PolarHBondContact O-N 3.01Å; A201-P203 VanDerWaalsContact O-CD 3.26Å; A201-P203 WeakPolarHBondContact O-CD 3.11Å
202	N	94.7	Very high	95.9	Very high	81 Å²	81	42.6 Å²	42.6	43%	0.433	24%	0.237	S	C	.	.			trans	-83.5	111.7	178.6	179.3	8.6	0	0	0	110.3	G200 D204 A205	G200-N202 PolarHBondContact O-N 3.18Å; N202-D204 PolarHBondContact O-N 3.2Å; N202-D204 WeakPolarHBondContact OD1-CB 3.39Å; N202-D204 PolarHBondContact OD1-N 3.4Å; N202-A205 HydrophobicContact CB-CB 4.32Å; N202-A205 VanDerWaalsContact O-CB 3.28Å; N202-A205 WeakPolarHBondContact O-CB 3.46Å; N202-A205 PolarHBondContact O-N 3.38Å
203	P	93.6	Very high	95.8	Very high	18 Å²	18	42.4 Å²	42.4	12%	0.117	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-21.6	178.8	29.7	-35.9	0	0	0	113.9	L181 L197 A201 A205 N212 A213 L229 L239	L181-P203 HydrophobicContact CD2-CB 4.25Å; L197-P203 HydrophobicContact CD2-CB 3.96Å; L197-P203 HydrophobicContact CD2-CG 4.12Å; A201-P203 VanDerWaalsContact O-CD 3.26Å; A201-P203 WeakPolarHBondContact O-CD 3.11Å; P203-A205 VanDerWaalsContact C-N 3.32Å; P203-N212 WeakPolarHBondContact O-CB 3.23Å; P203-A213 PolarHBondContact O-N 2.99Å; P203-L229 HydrophobicContact CB-CD2 4.08Å; P203-L239 HydrophobicContact CB-CD1 3.59Å; P203-L239 HydrophobicContact CB-CD2 4.49Å; P203-L239 HydrophobicContact CB-CG 3.96Å; P203-L239 HydrophobicContact CG-CD1 4.36Å; P203-L239 HydrophobicContact CG-CG 4.32Å
204	D	93.7	Very high	95.8	Very high	48 Å²	48	42.4 Å²	42.4	26%	0.257	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.9	176.2	-68.5	-69.2	0	0	0	113.7	N202 R206 S237 L239	N202-D204 PolarHBondContact O-N 3.2Å; N202-D204 WeakPolarHBondContact OD1-CB 3.39Å; N202-D204 PolarHBondContact OD1-N 3.4Å; D204-R206 WeakPolarHBondContact O-CG 3.45Å; D204-S237 WeakPolarHBondContact OD2-CB 3.38Å; D204-S237 PolarHBondContact OD2-OG 2.96Å; D204-L239 VanDerWaalsContact OD1-CD2 3.23Å; D204-L239 WeakPolarHBondContact OD1-CD2 3.4Å
205	A	95.7	Very high	95.9	Very high	9 Å²	9	40 Å²	40	7%	0.074	23%	0.225	C	C	.	.			trans	-55.8	144	173.5	0	0	0	0	0	109.8	Q179 H182 N202 P203 N212	Q179-A205 VanDerWaalsContact OE1-CB 3.28Å; H182-A205 PolarHBondContact NE2-O 3.25Å; H182-A205 VanDerWaalsContact NE2-O 3.1Å; N202-A205 HydrophobicContact CB-CB 4.32Å; N202-A205 VanDerWaalsContact O-CB 3.28Å; N202-A205 WeakPolarHBondContact O-CB 3.46Å; N202-A205 PolarHBondContact O-N 3.38Å; P203-A205 VanDerWaalsContact C-N 3.32Å; A205-N212 VanDerWaalsContact O-CA 3.26Å; A205-N212 WeakPolarHBondContact O-CA 3.39Å; A205-N212 VanDerWaalsContact O-CB 3.31Å; A205-N212 WeakPolarHBondContact O-CB 3.21Å
206	R	97	Very high	96	Very high	119 Å²	119	39.6 Å²	39.6	45%	0.449	22%	0.223	S	C	.	.			trans	-121.7	133	-174.2	-64.4	-166	-173	-176.4	-1.7	110.7	D204 Y211	D204-R206 WeakPolarHBondContact O-CG 3.45Å; R206-Y211 CarbonylContact C-O 3.54Å; R206-Y211 VanDerWaalsContact CA-O 3.29Å; R206-Y211 WeakPolarHBondContact CA-O 3.4Å
207	D	97.4	Very high	96	Very high	22 Å²	22	39.6 Å²	39.6	12%	0.118	22%	0.223	C	C	.	.			trans	-78.5	-172.9	172.2	80.7	-0.3	0	0	0	112.2	G177 R178 E209 T210 Y211	G177-D207 WeakPolarHBondContact O-CA 3.35Å; R178-D207 HydrophobicContact CG-CB 3.9Å; D207-E209 VanDerWaalsContact C-N 3.27Å; D207-E209 PolarHBondContact O-N 2.68Å; D207-E209 PolarHBondContact OD1-N 2.85Å; D207-T210 WeakPolarHBondContact O-CA 3.23Å; D207-T210 PolarHBondContact O-N 3.12Å; D207-T210 PolarHBondContact OD1-N 3.45Å; D207-Y211 PolarHBondContact N-O 2.68Å; D207-Y211 WeakPolarHBondContact OD1-CB 3.38Å; D207-Y211 PolarHBondContact OD1-N 2.93Å
208	G	95.7	Very high	96.2	Very high	51 Å²	51	38 Å²	38	53%	0.526	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.1	-178.2	0	0	0	0	0	114.6	Q176 T210	Q176-G208 WeakPolarHBondContact O-CA 3.49Å; Q176-G208 PolarHBondContact O-N 3.33Å; G208-T210 VanDerWaalsContact C-N 3.29Å
209	E	94.4	Very high	96.4	Very high	113 Å²	113	32 Å²	32	53%	0.528	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	10.4	173.9	-63.8	-58.1	137	0	0	111.9	D207 Y211 S246	D207-E209 VanDerWaalsContact C-N 3.27Å; D207-E209 PolarHBondContact O-N 2.68Å; D207-E209 PolarHBondContact OD1-N 2.85Å; E209-Y211 VanDerWaalsContact C-N 3.25Å; E209-Y211 HydrophobicContact CB-CD2 3.94Å; E209-Y211 HydrophobicContact CB-CE2 4.28Å; E209-Y211 PolarHBondContact O-N 2.69Å; E209-S246 PolarHBondContact O-N 3.21Å; E209-S246 VanDerWaalsContact O-N 3.13Å; E209-S246 PolarHBondContact O-OG 3.04Å
210	T	96.6	Very high	96.5	Very high	37 Å²	37	30 Å²	30	23%	0.227	18%	0.179	C	C	.	.			trans	61	25.5	-177	65.7	0	0	0	0	115.2	D207 G208 T245 S246	D207-T210 WeakPolarHBondContact O-CA 3.23Å; D207-T210 PolarHBondContact O-N 3.12Å; D207-T210 PolarHBondContact OD1-N 3.45Å; G208-T210 VanDerWaalsContact C-N 3.29Å; T210-T245 WeakPolarHBondContact OG1-CA 3.42Å; T210-S246 PolarHBondContact OG1-N 3.16Å; T210-S246 PolarHBondContact OG1-OG 3.26Å
211	Y	97.7	Very high	96.7	Very high	42 Å²	42	28.5 Å²	28.5	17%	0.165	16%	0.163	C	C	.	.			trans	-68.5	137.1	167.1	-81.9	-123.7	0	0	0	109.4	H182 R206 D207 E209 H215 T245 V254 R257	H182-Y211 PolarHBondContact NE2-O 3.4Å; R206-Y211 CarbonylContact C-O 3.54Å; R206-Y211 VanDerWaalsContact CA-O 3.29Å; R206-Y211 WeakPolarHBondContact CA-O 3.4Å; D207-Y211 PolarHBondContact N-O 2.68Å; D207-Y211 WeakPolarHBondContact OD1-CB 3.38Å; D207-Y211 PolarHBondContact OD1-N 2.93Å; E209-Y211 VanDerWaalsContact C-N 3.25Å; E209-Y211 HydrophobicContact CB-CD2 3.94Å; E209-Y211 HydrophobicContact CB-CE2 4.28Å; E209-Y211 PolarHBondContact O-N 2.69Å; Y211-H215 HydrophobicContact CD1-CB 3.31Å; Y211-H215 HydrophobicContact CE1-CB 3.85Å; Y211-H215 HydrophobicContact CG-CB 3.8Å; Y211-T245 HydrophobicContact CD2-CG2 3.54Å; Y211-T245 HydrophobicContact CE2-CG2 3.38Å; Y211-T245 HydrophobicContact CG-CG2 4.21Å; Y211-V254 HydrophobicContact CE1-CG1 4.16Å; Y211-V254 HydrophobicContact CE1-CG2 4.22Å; Y211-R257 PolarHBondContact OH-NH2 2.99Å
212	N	97.1	Very high	96.8	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.172	C	C	.	.			trans	-105	-179.6	165	68.4	15.5	0	0	0	110.2	P203 A205 L214 H215 C216 L239 S243	P203-N212 WeakPolarHBondContact O-CB 3.23Å; A205-N212 VanDerWaalsContact O-CA 3.26Å; A205-N212 WeakPolarHBondContact O-CA 3.39Å; A205-N212 VanDerWaalsContact O-CB 3.31Å; A205-N212 WeakPolarHBondContact O-CB 3.21Å; N212-L214 PolarHBondContact O-N 3.46Å; N212-L214 VanDerWaalsContact O-N 3.16Å; N212-L214 WeakPolarHBondContact OD1-CB 3.47Å; N212-L214 PolarHBondContact OD1-N 3.27Å; N212-L214 VanDerWaalsContact OD1-N 3.09Å; N212-H215 VanDerWaalsContact CG-ND1 3.28Å; N212-H215 PolarHBondContact N-ND1 3.24Å; N212-H215 PolarHBondContact O-N 2.52Å; N212-H215 VanDerWaalsContact O-N 3.12Å; N212-H215 PolarHBondContact OD1-N 3Å; N212-H215 PolarHBondContact OD1-ND1 3.28Å; N212-C216 PolarHBondContact O-N 2.93Å; N212-C216 VanDerWaalsContact O-N 3.08Å; N212-C216 PolarHBondContact O-SG 3.11Å; N212-L239 WeakPolarHBondContact ND2-CD2 3.47Å; N212-S243 PolarHBondContact ND2-OG 3.44Å
213	A	96.9	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.1	-33.6	-178.3	0	0	0	0	0	113.4	L181 A185 P203 C216 A217 L229	L181-A213 HydrophobicContact CD2-CB 3.92Å; L181-A213 HydrophobicContact CG-CB 3.91Å; A185-A213 HydrophobicContact CB-CB 4.41Å; A185-A213 WeakPolarHBondContact CB-O 3.3Å; P203-A213 PolarHBondContact O-N 2.99Å; A213-C216 PolarHBondContact O-N 3.44Å; A213-A217 PolarHBondContact O-N 3.24Å; A213-L229 HydrophobicContact CB-CD1 3.86Å; A213-L229 HydrophobicContact CB-CD2 4.2Å
214	L	97.5	Very high	97.1	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.5	-41.6	178.4	-175.4	59.4	0	0	0	111.9	N212 C216 A217 A218 C226 L229 L230 L239 P251 L267	N212-L214 PolarHBondContact O-N 3.46Å; N212-L214 VanDerWaalsContact O-N 3.16Å; N212-L214 WeakPolarHBondContact OD1-CB 3.47Å; N212-L214 PolarHBondContact OD1-N 3.27Å; N212-L214 VanDerWaalsContact OD1-N 3.09Å; L214-C216 VanDerWaalsContact C-N 3.31Å; L214-C216 PolarHBondContact O-N 3.02Å; L214-A217 PolarHBondContact O-N 3.47Å; L214-A218 VanDerWaalsContact O-CB 3.24Å; L214-A218 WeakPolarHBondContact O-CB 3.49Å; L214-A218 PolarHBondContact O-N 2.77Å; L214-C226 HydrophobicContact CD1-CB 3.75Å; L214-L229 HydrophobicContact CB-CD1 4.39Å; L214-L229 HydrophobicContact CD1-CB 4.42Å; L214-L230 HydrophobicContact CD1-CD1 4.12Å; L214-L230 HydrophobicContact CD1-CG 4.19Å; L214-L230 HydrophobicContact CD2-CD1 4.23Å; L214-L230 HydrophobicContact CD2-CD2 3.72Å; L214-L230 HydrophobicContact CD2-CG 4.08Å; L214-L239 HydrophobicContact CB-CD1 4.1Å; L214-P251 HydrophobicContact CB-CG 4.36Å; L214-P251 HydrophobicContact CD2-CB 4.22Å; L214-P251 HydrophobicContact CD2-CG 3.67Å; L214-P251 HydrophobicContact CG-CB 3.93Å; L214-P251 HydrophobicContact CG-CG 3.7Å; L214-L267 HydrophobicContact CD1-CD2 4.1Å; L214-L267 HydrophobicContact CD2-CD2 4.45Å; L214-L267 HydrophobicContact CG-CD2 4.47Å
215	H	98.2	Very high	97.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-39.3	173	-64.6	93.6	0	0	0	111.7	Y211 N212 A218 A219 S243 T245 D249 P251	Y211-H215 HydrophobicContact CD1-CB 3.31Å; Y211-H215 HydrophobicContact CE1-CB 3.85Å; Y211-H215 HydrophobicContact CG-CB 3.8Å; N212-H215 VanDerWaalsContact CG-ND1 3.28Å; N212-H215 PolarHBondContact N-ND1 3.24Å; N212-H215 PolarHBondContact O-N 2.52Å; N212-H215 VanDerWaalsContact O-N 3.12Å; N212-H215 PolarHBondContact OD1-N 3Å; N212-H215 PolarHBondContact OD1-ND1 3.28Å; H215-A218 PolarHBondContact O-N 3.5Å; H215-A219 WeakPolarHBondContact O-CB 3.24Å; H215-A219 PolarHBondContact O-N 3.09Å; H215-S243 PolarHBondContact CE1-O 3.05Å; H215-S243 PolarHBondContact CE1-OG 3.04Å; H215-S243 PolarHBondContact NE2-O 2.95Å; H215-T245 VanDerWaalsContact CD2-CG2 3.46Å; H215-T245 WeakPolarHBondContact CD2-CG2 3.18Å; H215-D249 PolarHBondContact NE2-O 2.94Å; H215-P251 WeakPolarHBondContact NE2-CD 3.43Å
216	C	98.2	Very high	97.4	Very high	9 Å²	9	26.4 Å²	26.4	6%	0.061	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-49	176.6	-68.3	0	0	0	0	112.1	H182 A185 F186 N212 A213 L214 A218 A219 G220	H182-C216 WeakPolarHBondContact O-CB 3.45Å; A185-C216 HydrophobicContact CB-CB 4.14Å; F186-C216 HydrophobicContact CB-CB 4.08Å; N212-C216 PolarHBondContact O-N 2.93Å; N212-C216 VanDerWaalsContact O-N 3.08Å; N212-C216 PolarHBondContact O-SG 3.11Å; A213-C216 PolarHBondContact O-N 3.44Å; L214-C216 VanDerWaalsContact C-N 3.31Å; L214-C216 PolarHBondContact O-N 3.02Å; C216-A218 VanDerWaalsContact C-N 3.28Å; C216-A218 PolarHBondContact O-N 2.75Å; C216-A219 PolarHBondContact O-N 3.43Å; C216-G220 PolarHBondContact O-N 3.45Å
217	A	98.4	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.6	-40	175	0	0	0	0	0	111.8	A185 A213 L214 G220 G221 H222 I225 C226 L229	A185-A217 HydrophobicContact CB-CB 4.25Å; A185-A217 WeakPolarHBondContact O-CA 3.34Å; A213-A217 PolarHBondContact O-N 3.24Å; L214-A217 PolarHBondContact O-N 3.47Å; A217-G220 PolarHBondContact O-N 3.02Å; A217-G221 PolarHBondContact O-N 3.33Å; A217-H222 PolarHBondContact O-N 3Å; A217-I225 HydrophobicContact CB-CB 4.05Å; A217-I225 HydrophobicContact CB-CG2 3.66Å; A217-C226 VanDerWaalsContact CB-SG 3.59Å; A217-L229 HydrophobicContact CB-CD1 4.37Å
218	A	98.3	Very high	97.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-40.1	177.2	0	0	0	0	0	112.7	L214 H215 C216 G221 P251 A255 R260 V263 L267	L214-A218 VanDerWaalsContact O-CB 3.24Å; L214-A218 WeakPolarHBondContact O-CB 3.49Å; L214-A218 PolarHBondContact O-N 2.77Å; H215-A218 PolarHBondContact O-N 3.5Å; C216-A218 VanDerWaalsContact C-N 3.28Å; C216-A218 PolarHBondContact O-N 2.75Å; A218-G221 PolarHBondContact O-N 3.06Å; A218-P251 HydrophobicContact CB-CB 4.21Å; A218-A255 HydrophobicContact CB-CB 4.36Å; A218-R260 WeakPolarHBondContact O-CG 3.36Å; A218-V263 HydrophobicContact CB-CG1 3.74Å; A218-L267 HydrophobicContact CB-CD1 4.49Å
219	A	98.1	Very high	97	Very high	8 Å²	8	23.3 Å²	23.3	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-65.2	-41.7	175	0	0	0	0	0	112.3	F186 H215 C216 G221 V254 N258 R260	F186-A219 HydrophobicContact CD2-CB 4.2Å; F186-A219 HydrophobicContact CE2-CB 4.22Å; H215-A219 WeakPolarHBondContact O-CB 3.24Å; H215-A219 PolarHBondContact O-N 3.09Å; C216-A219 PolarHBondContact O-N 3.43Å; A219-G221 VanDerWaalsContact C-N 3.33Å; A219-V254 HydrophobicContact CB-CG1 3.66Å; A219-N258 WeakPolarHBondContact CA-ND2 3.37Å; A219-N258 PolarHBondContact O-ND2 3.4Å; A219-R260 PolarHBondContact O-NE 2.9Å; A219-R260 VanDerWaalsContact O-NE 3.12Å; A219-R260 PolarHBondContact O-NH2 3.31Å
220	G	98	Very high	97	Very high	13 Å²	13	18.9 Å²	18.9	13%	0.134	11%	0.112	C	C	.	.	H	α-helix	trans	-69	-27.5	177.6	0	0	0	0	0	113.7	C216 A217	C216-G220 PolarHBondContact O-N 3.45Å; A217-G220 PolarHBondContact O-N 3.02Å
221	G	98.2	Very high	96.6	Very high	19 Å²	19	21.5 Å²	21.5	20%	0.196	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	27.7	-179.4	0	0	0	0	0	113.9	A217 A218 A219	A217-G221 PolarHBondContact O-N 3.33Å; A218-G221 PolarHBondContact O-N 3.06Å; A219-G221 VanDerWaalsContact C-N 3.33Å
222	H	98.4	Very high	95.5	Very high	55 Å²	55	24.4 Å²	24.4	26%	0.255	15%	0.146	S	C	.	.			trans	-102.8	84	-172.4	-55.6	-61.4	0	0	0	111.7	A185 F186 G188 A217 A224 I225 C226	A185-H222 PolarHBondContact O-CD2 3.41Å; A185-H222 VanDerWaalsContact O-CD2 3.22Å; F186-H222 PolarHBondContact O-CD2 3.46Å; F186-H222 PolarHBondContact O-NE2 2.88Å; G188-H222 WeakPolarHBondContact CA-CD2 3.46Å; G188-H222 WeakPolarHBondContact CA-CE1 3.39Å; G188-H222 VanDerWaalsContact CA-CG 3.43Å; G188-H222 WeakPolarHBondContact CA-ND1 3.48Å; G188-H222 VanDerWaalsContact CA-NE2 3.34Å; G188-H222 WeakPolarHBondContact CA-NE2 3.39Å; G188-H222 PolarHBondContact N-CD2 3.03Å; G188-H222 PolarHBondContact N-NE2 2.97Å; A217-H222 PolarHBondContact O-N 3Å; H222-A224 PolarHBondContact O-N 2.94Å; H222-I225 HydrophobicContact CB-CB 4.08Å; H222-I225 HydrophobicContact CB-CD1 3.93Å; H222-I225 HydrophobicContact CB-CG1 4.12Å; H222-I225 PolarHBondContact O-N 3.24Å; H222-C226 PolarHBondContact O-N 3.37Å; H222-C226 VanDerWaalsContact O-N 3.1Å; H222-C226 PolarHBondContact O-SG 2.97Å
223	A	97.8	Very high	94	Very high	18 Å²	18	27.8 Å²	27.8	15%	0.149	18%	0.181	C	C	.	.	H	α-helix	trans	-57.1	-47	-177.3	0	0	0	0	0	112.9	I225 C226 E227 V263 A266	A223-I225 PolarHBondContact O-N 2.95Å; A223-C226 WeakPolarHBondContact O-CA 3.45Å; A223-C226 VanDerWaalsContact O-CB 3.31Å; A223-C226 WeakPolarHBondContact O-CB 3.42Å; A223-C226 PolarHBondContact O-N 3.44Å; A223-E227 WeakPolarHBondContact O-CG 3.42Å; A223-E227 PolarHBondContact O-N 2.94Å; A223-V263 HydrophobicContact CB-CG2 4.31Å; A223-A266 HydrophobicContact CB-CB 4.2Å
224	A	96.7	Very high	92.4	Very high	45 Å²	45	33.4 Å²	33.4	37%	0.372	20%	0.202	S	C	.	.	H	α-helix	trans	-58.9	-33.7	178.3	0	0	0	0	0	113.3	H222 L228	H222-A224 PolarHBondContact O-N 2.94Å; A224-L228 WeakPolarHBondContact O-CB 3.49Å; A224-L228 PolarHBondContact O-N 3.41Å
225	I	97.3	Very high	90.5	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-73.5	-36.8	174.7	-63.3	179.2	0	0	0	110.6	A185 Q190 V193 A217 H222 A223 L228 L229	A185-I225 HydrophobicContact CB-CG2 4.26Å; Q190-I225 HydrophobicContact CB-CD1 4.29Å; Q190-I225 HydrophobicContact CB-CG1 3.93Å; Q190-I225 HydrophobicContact CG-CG1 4.22Å; V193-I225 HydrophobicContact CG1-CG2 4.21Å; V193-I225 HydrophobicContact CG2-CD1 4.17Å; V193-I225 HydrophobicContact CG2-CG2 4.2Å; A217-I225 HydrophobicContact CB-CB 4.05Å; A217-I225 HydrophobicContact CB-CG2 3.66Å; H222-I225 HydrophobicContact CB-CB 4.08Å; H222-I225 HydrophobicContact CB-CD1 3.93Å; H222-I225 HydrophobicContact CB-CG1 4.12Å; H222-I225 PolarHBondContact O-N 3.24Å; A223-I225 PolarHBondContact O-N 2.95Å; I225-L228 PolarHBondContact O-N 3.46Å; I225-L229 HydrophobicContact CG2-CD1 3.82Å; I225-L229 HydrophobicContact CG2-CG 4.19Å; I225-L229 VanDerWaalsContact O-CB 3.28Å; I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 WeakPolarHBondContact O-CG 3.31Å; I225-L229 PolarHBondContact O-N 3.06Å
226	C	96.8	Very high	88.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-47.5	174.6	-60.1	0	0	0	0	111.2	L214 A217 H222 A223 L228 L229 L230	L214-C226 HydrophobicContact CD1-CB 3.75Å; A217-C226 VanDerWaalsContact CB-SG 3.59Å; H222-C226 PolarHBondContact O-N 3.37Å; H222-C226 VanDerWaalsContact O-N 3.1Å; H222-C226 PolarHBondContact O-SG 2.97Å; A223-C226 WeakPolarHBondContact O-CA 3.45Å; A223-C226 VanDerWaalsContact O-CB 3.31Å; A223-C226 WeakPolarHBondContact O-CB 3.42Å; A223-C226 PolarHBondContact O-N 3.44Å; C226-L228 VanDerWaalsContact C-N 3.35Å; C226-L228 PolarHBondContact O-N 3.22Å; C226-L229 PolarHBondContact O-N 3.23Å; C226-L230 WeakPolarHBondContact O-CB 3.24Å; C226-L230 VanDerWaalsContact O-CG 3.31Å; C226-L230 WeakPolarHBondContact O-CG 3.31Å; C226-L230 PolarHBondContact O-N 2.95Å
227	E	95	Very high	86.2	Confident	104 Å²	104	48.2 Å²	48.2	49%	0.486	29%	0.292	S	S	.	.	H	α-helix	trans	-57.3	-48.4	174.7	-69.3	164.1	-153.1	0	0	111	A223 L229 L230 E231 A266	A223-E227 WeakPolarHBondContact O-CG 3.42Å; A223-E227 PolarHBondContact O-N 2.94Å; E227-L229 VanDerWaalsContact C-N 3.31Å; E227-L229 PolarHBondContact O-N 3.47Å; E227-L230 CarbonylContact O-C 3.48Å; E227-L230 PolarHBondContact O-N 3.26Å; E227-L230 VanDerWaalsContact O-N 3.16Å; E227-E231 PolarHBondContact O-N 3.24Å; E227-A266 HydrophobicContact CG-CB 4.02Å
228	L	93.8	Very high	84.7	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-40.7	177.6	174.4	136.2	0	0	0	113.3	Q190 V193 E194 L197 A224 I225 C226 L230 R234	Q190-L228 HydrophobicContact CG-CD1 4.11Å; V193-L228 HydrophobicContact CG1-CD2 3.67Å; E194-L228 HydrophobicContact CG-CD1 3.37Å; E194-L228 VanDerWaalsContact OE1-CD1 3.31Å; E194-L228 WeakPolarHBondContact OE1-CD1 3.31Å; L197-L228 HydrophobicContact CD1-CD2 3.69Å; A224-L228 WeakPolarHBondContact O-CB 3.49Å; A224-L228 PolarHBondContact O-N 3.41Å; I225-L228 PolarHBondContact O-N 3.46Å; C226-L228 VanDerWaalsContact C-N 3.35Å; C226-L228 PolarHBondContact O-N 3.22Å; L228-L230 VanDerWaalsContact C-N 3.32Å; L228-R234 VanDerWaalsContact CG-NH2 3.33Å
229	L	94.4	Very high	84.1	Confident	10 Å²	10	52.9 Å²	52.9	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-74.4	-24	-179.7	-77.4	174.5	0	0	0	112.7	V193 L197 P203 A213 L214 A217 I225 C226 E227 L239	V193-L229 HydrophobicContact CG1-CD2 4.31Å; L197-L229 HydrophobicContact CD1-CD2 3.96Å; L197-L229 HydrophobicContact CD2-CD2 4.43Å; P203-L229 HydrophobicContact CB-CD2 4.08Å; A213-L229 HydrophobicContact CB-CD1 3.86Å; A213-L229 HydrophobicContact CB-CD2 4.2Å; L214-L229 HydrophobicContact CB-CD1 4.39Å; L214-L229 HydrophobicContact CD1-CB 4.42Å; A217-L229 HydrophobicContact CB-CD1 4.37Å; I225-L229 HydrophobicContact CG2-CD1 3.82Å; I225-L229 HydrophobicContact CG2-CG 4.19Å; I225-L229 VanDerWaalsContact O-CB 3.28Å; I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 WeakPolarHBondContact O-CG 3.31Å; I225-L229 PolarHBondContact O-N 3.06Å; C226-L229 PolarHBondContact O-N 3.23Å; E227-L229 VanDerWaalsContact C-N 3.31Å; E227-L229 PolarHBondContact O-N 3.47Å; L229-L239 HydrophobicContact CB-CD1 3.65Å; L229-L239 HydrophobicContact CD1-CD1 4.35Å; L229-L239 HydrophobicContact CD2-CD1 3.91Å; L229-L239 HydrophobicContact CG-CD1 4.18Å
230	L	93.4	Very high	83.8	Confident	21 Å²	21	56.4 Å²	56.4	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-94.9	-9	178.3	-69.4	167.8	0	0	0	113.2	L214 C226 E227 L228 P232 L239 V241 L267 A270	L214-L230 HydrophobicContact CD1-CD1 4.12Å; L214-L230 HydrophobicContact CD1-CG 4.19Å; L214-L230 HydrophobicContact CD2-CD1 4.23Å; L214-L230 HydrophobicContact CD2-CD2 3.72Å; L214-L230 HydrophobicContact CD2-CG 4.08Å; C226-L230 WeakPolarHBondContact O-CB 3.24Å; C226-L230 VanDerWaalsContact O-CG 3.31Å; C226-L230 WeakPolarHBondContact O-CG 3.31Å; C226-L230 PolarHBondContact O-N 2.95Å; E227-L230 CarbonylContact O-C 3.48Å; E227-L230 PolarHBondContact O-N 3.26Å; E227-L230 VanDerWaalsContact O-N 3.16Å; L228-L230 VanDerWaalsContact C-N 3.32Å; L230-P232 VanDerWaalsContact O-CD 3.29Å; L230-P232 WeakPolarHBondContact O-CD 3.42Å; L230-L239 HydrophobicContact CD2-CB 4.32Å; L230-L239 WeakPolarHBondContact CD2-O 3.46Å; L230-V241 HydrophobicContact CD1-CG2 4.24Å; L230-V241 HydrophobicContact CD2-CB 3.99Å; L230-V241 HydrophobicContact CD2-CG2 4.36Å; L230-L267 HydrophobicContact CD1-CD2 3.89Å; L230-A270 HydrophobicContact CD1-CB 3.64Å
231	E	87.9	Confident	83.6	Confident	92 Å²	92	56.5 Å²	56.5	43%	0.43	34%	0.335	S	S	.	.			trans	-60.6	117.8	-178.8	-167	-177.5	164.1	0	0	111.7	E227 R234	E227-E231 PolarHBondContact O-N 3.24Å; E231-R234 IonicContact OE1-NH1 3.95Å; E231-R234 IonicContact OE2-CZ 3.72Å; E231-R234 IonicContact OE2-NH1 3.83Å; E231-R234 PolarHBondContact OE2-NH1 2.88Å; E231-R234 IonicContact OE2-NH2 3.65Å; E231-R234 PolarHBondContact OE2-NH2 3.32Å
232	P	74.1	Confident	83.4	Confident	102 Å²	102	58.5 Å²	58.5	66%	0.662	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	138.5	-179.7	-22.7	33.3	0	0	0	112.7	L230	L230-P232 VanDerWaalsContact O-CD 3.29Å; L230-P232 WeakPolarHBondContact O-CD 3.42Å
233	G	67.3	Low	83.3	Confident	72 Å²	72	56.1 Å²	56.1	74%	0.742	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-1.7	165.5	0	0	0	0	0	116.8	R235	G233-R235 VanDerWaalsContact C-N 3.35Å; G233-R235 PolarHBondContact O-N 3.12Å
234	R	62.6	Low	83.1	Confident	118 Å²	118	57.5 Å²	57.5	45%	0.445	34%	0.336	S	S	.	.	S	Bend	trans	-75.3	-8.3	-176.5	-111.1	-129.5	-84.1	-74.4	-11.7	117.2	L228 E231	L228-R234 VanDerWaalsContact CG-NH2 3.33Å; E231-R234 IonicContact OE1-NH1 3.95Å; E231-R234 IonicContact OE2-CZ 3.72Å; E231-R234 IonicContact OE2-NH1 3.83Å; E231-R234 PolarHBondContact OE2-NH1 2.88Å; E231-R234 IonicContact OE2-NH2 3.65Å; E231-R234 PolarHBondContact OE2-NH2 3.32Å
235	R	57.8	Low	83.1	Confident	179 Å²	179	55.7 Å²	55.7	68%	0.675	32%	0.32	S	S	*	.	S	Bend	trans	164.2	56.7	161.1	-93.5	158.7	177.5	-154	2.9	112.5	R198 G233 S237	R198-R235 PolarHBondContact O-NH1 3.38Å; G233-R235 VanDerWaalsContact C-N 3.35Å; G233-R235 PolarHBondContact O-N 3.12Å; R235-S237 VanDerWaalsContact C-N 3.31Å; R235-S237 PolarHBondContact O-N 3.19Å; R235-S237 VanDerWaalsContact O-N 3.12Å
236	G	49.5	Very low	83	Confident	84 Å²	84	58.7 Å²	58.7	87%	0.866	34%	0.341	S	S	*	.	S	Bend	trans	78.3	-6.9	161.4	0	0	0	0	0	118.1
237	S	55.8	Low	82.7	Confident	58 Å²	58	61.5 Å²	61.5	41%	0.406	36%	0.356	S	S	.	.			trans	-116.5	107.7	165.2	-137.8	0	0	0	0	110	D204 R235	D204-S237 WeakPolarHBondContact OD2-CB 3.38Å; D204-S237 PolarHBondContact OD2-OG 2.96Å; R235-S237 VanDerWaalsContact C-N 3.31Å; R235-S237 PolarHBondContact O-N 3.19Å; R235-S237 VanDerWaalsContact O-N 3.12Å
238	V	68.2	Low	82.7	Confident	94 Å²	94	57 Å²	57	57%	0.57	34%	0.337	S	S	*	.			trans	-82.3	111	163.8	178.9	0	0	0	0	105.1	D240	V238-D240 PolarHBondContact O-N 2.78Å
239	L	85.9	Confident	82.8	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.016	34%	0.335	C	S	.	.			trans	-56.9	130.2	174	-97.8	163.7	0	0	0	109.5	P203 D204 N212 L214 L229 L230 V241	P203-L239 HydrophobicContact CB-CD1 3.59Å; P203-L239 HydrophobicContact CB-CD2 4.49Å; P203-L239 HydrophobicContact CB-CG 3.96Å; P203-L239 HydrophobicContact CG-CD1 4.36Å; P203-L239 HydrophobicContact CG-CG 4.32Å; D204-L239 VanDerWaalsContact OD1-CD2 3.23Å; D204-L239 WeakPolarHBondContact OD1-CD2 3.4Å; N212-L239 WeakPolarHBondContact ND2-CD2 3.47Å; L214-L239 HydrophobicContact CB-CD1 4.1Å; L229-L239 HydrophobicContact CB-CD1 3.65Å; L229-L239 HydrophobicContact CD1-CD1 4.35Å; L229-L239 HydrophobicContact CD2-CD1 3.91Å; L229-L239 HydrophobicContact CG-CD1 4.18Å; L230-L239 HydrophobicContact CD2-CB 4.32Å; L230-L239 WeakPolarHBondContact CD2-O 3.46Å; L239-V241 PolarHBondContact O-N 2.76Å
240	D	91.5	Very high	83	Confident	83 Å²	83	56.2 Å²	56.2	44%	0.444	33%	0.333	S	S	.	.			trans	-69.5	114.6	173.3	179.6	11.6	0	0	0	109.8	V238 H242 S243	V238-D240 PolarHBondContact O-N 2.78Å; D240-H242 PolarHBondContact O-N 3.31Å; D240-H242 VanDerWaalsContact O-N 3.11Å; D240-H242 WeakPolarHBondContact OD1-CA 3.4Å; D240-H242 WeakPolarHBondContact OD1-CB 3.21Å; D240-H242 IonicContact OD1-CD2 3.79Å; D240-H242 IonicContact OD1-CG 3.05Å; D240-H242 PolarHBondContact OD1-N 3.11Å; D240-S243 VanDerWaalsContact O-CB 3.24Å; D240-S243 WeakPolarHBondContact O-CB 3.39Å; D240-S243 PolarHBondContact O-N 3.07Å; D240-S243 PolarHBondContact O-OG 3.31Å; D240-S243 PolarHBondContact OD2-N 2.92Å
241	V	93.8	Very high	83.1	Confident	15 Å²	15	55.2 Å²	55.2	9%	0.091	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.3	174.7	72.4	0	0	0	0	112.1	L230 L239 P251 L267 A272	L230-V241 HydrophobicContact CD1-CG2 4.24Å; L230-V241 HydrophobicContact CD2-CB 3.99Å; L230-V241 HydrophobicContact CD2-CG2 4.36Å; L239-V241 PolarHBondContact O-N 2.76Å; V241-P251 WeakPolarHBondContact O-CD 3.22Å; V241-L267 HydrophobicContact CG2-CD2 4.11Å; V241-A272 HydrophobicContact CG2-CB 3.85Å
242	H	94.6	Very high	83.6	Confident	60 Å²	60	50.9 Å²	50.9	28%	0.278	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	12	175.8	-48.3	-62	0	0	0	114	D240 V244 G271 D273 K276	D240-H242 PolarHBondContact O-N 3.31Å; D240-H242 VanDerWaalsContact O-N 3.11Å; D240-H242 WeakPolarHBondContact OD1-CA 3.4Å; D240-H242 WeakPolarHBondContact OD1-CB 3.21Å; D240-H242 IonicContact OD1-CD2 3.79Å; D240-H242 IonicContact OD1-CG 3.05Å; D240-H242 PolarHBondContact OD1-N 3.11Å; H242-V244 WeakPolarHBondContact O-CG1 3.31Å; H242-G271 PolarHBondContact CE1-O 2.88Å; H242-D273 PolarHBondContact CE1-N 3.24Å; H242-D273 VanDerWaalsContact CE1-N 3.3Å; H242-K276 HydrophobicContact CB-CD 4.26Å
243	S	94.3	Very high	84.6	Confident	6 Å²	6	46 Å²	46	4%	0.042	28%	0.276	C	S	.	.			trans	-51.3	146.9	168.3	54.4	0	0	0	0	110.1	N212 H215 D240 T250 P251	N212-S243 PolarHBondContact ND2-OG 3.44Å; H215-S243 PolarHBondContact CE1-O 3.05Å; H215-S243 PolarHBondContact CE1-OG 3.04Å; H215-S243 PolarHBondContact NE2-O 2.95Å; D240-S243 VanDerWaalsContact O-CB 3.24Å; D240-S243 WeakPolarHBondContact O-CB 3.39Å; D240-S243 PolarHBondContact O-N 3.07Å; D240-S243 PolarHBondContact O-OG 3.31Å; D240-S243 PolarHBondContact OD2-N 2.92Å; S243-T250 WeakPolarHBondContact O-CA 3.47Å; S243-P251 VanDerWaalsContact O-CD 3.31Å; S243-P251 WeakPolarHBondContact O-CD 3.39Å
244	V	95.3	Very high	86	Confident	47 Å²	47	42.6 Å²	42.6	29%	0.285	24%	0.241	S	C	.	.			trans	-128.9	145.2	-173.2	-65.1	0	0	0	0	112.6	H242 G248 D249 T250	H242-V244 WeakPolarHBondContact O-CG1 3.31Å; V244-G248 WeakPolarHBondContact CG1-O 3.16Å; V244-D249 VanDerWaalsContact CA-O 3.31Å; V244-D249 WeakPolarHBondContact CA-O 3.41Å; V244-T250 HydrophobicContact CG1-CG2 4Å
245	T	96	Very high	87.6	Confident	7 Å²	7	37 Å²	37	4%	0.043	22%	0.22	C	C	.	.			trans	-76.4	-178	170.2	69.5	0	0	0	0	112.1	T210 Y211 H215 N247 G248 D249	T210-T245 WeakPolarHBondContact OG1-CA 3.42Å; Y211-T245 HydrophobicContact CD2-CG2 3.54Å; Y211-T245 HydrophobicContact CE2-CG2 3.38Å; Y211-T245 HydrophobicContact CG-CG2 4.21Å; H215-T245 VanDerWaalsContact CD2-CG2 3.46Å; H215-T245 WeakPolarHBondContact CD2-CG2 3.18Å; T245-N247 PolarHBondContact O-N 2.69Å; T245-N247 PolarHBondContact OG1-N 2.92Å; T245-G248 WeakPolarHBondContact O-CA 3.28Å; T245-G248 PolarHBondContact O-N 3.08Å; T245-D249 HydrophobicContact CG2-CB 4.32Å; T245-D249 PolarHBondContact N-O 3.1Å; T245-D249 WeakPolarHBondContact OG1-CB 3.31Å; T245-D249 PolarHBondContact OG1-N 3.33Å
246	S	94.2	Very high	89.4	Confident	66 Å²	66	28.9 Å²	28.9	46%	0.462	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.8	179	-61.9	0	0	0	0	112	E209 T210 G248	E209-S246 PolarHBondContact O-N 3.21Å; E209-S246 VanDerWaalsContact O-N 3.13Å; E209-S246 PolarHBondContact O-OG 3.04Å; T210-S246 PolarHBondContact OG1-N 3.16Å; T210-S246 PolarHBondContact OG1-OG 3.26Å; S246-G248 VanDerWaalsContact C-N 3.32Å
247	N	92.6	Very high	91.5	Very high	58 Å²	58	29.4 Å²	29.4	31%	0.31	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.7	175.1	-66.8	-56.6	0	0	0	113.1	T245 D249 S279	T245-N247 PolarHBondContact O-N 2.69Å; T245-N247 PolarHBondContact OG1-N 2.92Å; N247-D249 PolarHBondContact O-N 3.48Å; N247-S279 VanDerWaalsContact C-OG 3.29Å; N247-S279 WeakPolarHBondContact O-CB 3.43Å; N247-S279 PolarHBondContact O-N 3.35Å; N247-S279 PolarHBondContact O-OG 2.95Å
248	G	95	Very high	93.3	Very high	9 Å²	9	29.8 Å²	29.8	9%	0.093	16%	0.164	C	C	.	.			trans	74.4	8.8	-174.6	0	0	0	0	0	113.8	V244 T245 S246 T250 N278 S279	V244-G248 WeakPolarHBondContact CG1-O 3.16Å; T245-G248 WeakPolarHBondContact O-CA 3.28Å; T245-G248 PolarHBondContact O-N 3.08Å; S246-G248 VanDerWaalsContact C-N 3.32Å; G248-T250 PolarHBondContact O-N 3.17Å; G248-N278 WeakPolarHBondContact O-CA 3.29Å; G248-N278 WeakPolarHBondContact O-CB 3.12Å; G248-S279 PolarHBondContact N-OG 2.96Å
249	D	95.8	Very high	94.6	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.016	16%	0.16	C	C	.	.			trans	-71.8	127.9	-179.7	-66.3	-32.3	0	0	0	109.4	H215 V244 T245 N247 H253 V254 R257 N278	H215-D249 PolarHBondContact NE2-O 2.94Å; V244-D249 VanDerWaalsContact CA-O 3.31Å; V244-D249 WeakPolarHBondContact CA-O 3.41Å; T245-D249 HydrophobicContact CG2-CB 4.32Å; T245-D249 PolarHBondContact N-O 3.1Å; T245-D249 WeakPolarHBondContact OG1-CB 3.31Å; T245-D249 PolarHBondContact OG1-N 3.33Å; N247-D249 PolarHBondContact O-N 3.48Å; D249-H253 HydrophobicContact CB-CB 3.81Å; D249-V254 HydrophobicContact CB-CG2 4.1Å; D249-R257 IonicContact OD2-CZ 3.65Å; D249-R257 IonicContact OD2-NH1 2.74Å; D249-R257 PolarHBondContact OD2-NH1 3.02Å; D249-R257 IonicContact OD2-NH2 3.83Å; D249-N278 WeakPolarHBondContact OD1-CB 3.45Å; D249-N278 PolarHBondContact OD1-ND2 3.42Å
250	T	96.7	Very high	95.1	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.018	18%	0.177	C	C	.	.			trans	-78.5	168.7	166.3	68.6	0	0	0	0	111.1	S243 V244 G248 L252 H253 V254 K276	S243-T250 WeakPolarHBondContact O-CA 3.47Å; V244-T250 HydrophobicContact CG1-CG2 4Å; G248-T250 PolarHBondContact O-N 3.17Å; T250-L252 PolarHBondContact O-N 3.3Å; T250-L252 VanDerWaalsContact O-N 3.13Å; T250-L252 PolarHBondContact OG1-N 2.94Å; T250-H253 PolarHBondContact N-ND1 3.2Å; T250-H253 WeakPolarHBondContact O-CB 3.41Å; T250-H253 PolarHBondContact O-N 3.43Å; T250-H253 PolarHBondContact OG1-N 3.11Å; T250-H253 PolarHBondContact OG1-ND1 3.28Å; T250-V254 PolarHBondContact O-N 2.83Å; T250-K276 HydrophobicContact CG2-CD 3.64Å; T250-K276 HydrophobicContact CG2-CG 4.27Å
251	P	97	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-51.5	-35.1	169.2	-28.6	35.9	0	0	0	113.1	L214 H215 A218 V241 S243 V254 A255 L267	L214-P251 HydrophobicContact CB-CG 4.36Å; L214-P251 HydrophobicContact CD2-CB 4.22Å; L214-P251 HydrophobicContact CD2-CG 3.67Å; L214-P251 HydrophobicContact CG-CB 3.93Å; L214-P251 HydrophobicContact CG-CG 3.7Å; H215-P251 WeakPolarHBondContact NE2-CD 3.43Å; A218-P251 HydrophobicContact CB-CB 4.21Å; V241-P251 WeakPolarHBondContact O-CD 3.22Å; S243-P251 VanDerWaalsContact O-CD 3.31Å; S243-P251 WeakPolarHBondContact O-CD 3.39Å; P251-V254 PolarHBondContact O-N 2.81Å; P251-A255 WeakPolarHBondContact O-CB 3.45Å; P251-A255 PolarHBondContact O-N 3.35Å; P251-L267 VanDerWaalsContact C-CD1 3.43Å; P251-L267 HydrophobicContact CB-CD1 3.77Å; P251-L267 HydrophobicContact CB-CD2 4Å
252	L	97	Very high	95.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-67	-41.9	177.2	-176.8	62.6	0	0	0	111.8	T250 V254 A255 T256 A264 L267 L268 A272	T250-L252 PolarHBondContact O-N 3.3Å; T250-L252 VanDerWaalsContact O-N 3.13Å; T250-L252 PolarHBondContact OG1-N 2.94Å; L252-V254 VanDerWaalsContact C-N 3.31Å; L252-V254 PolarHBondContact O-N 3.35Å; L252-A255 PolarHBondContact O-N 3.25Å; L252-T256 HydrophobicContact CD1-CG2 4.29Å; L252-T256 PolarHBondContact O-N 3.13Å; L252-T256 PolarHBondContact O-OG1 3.32Å; L252-A264 HydrophobicContact CD1-CB 3.89Å; L252-L267 HydrophobicContact CB-CD1 4.23Å; L252-L267 HydrophobicContact CD1-CB 4.4Å; L252-L267 HydrophobicContact CD1-CD1 4.5Å; L252-L268 HydrophobicContact CD1-CG 4.36Å; L252-L268 HydrophobicContact CD2-CD2 3.97Å; L252-A272 HydrophobicContact CB-CB 4.17Å; L252-A272 HydrophobicContact CD2-CB 3.98Å
253	H	96.3	Very high	95.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-41.3	173.6	-68.7	84.3	0	0	0	111.7	D249 T250 T256 R257 K276 M282 F287	D249-H253 HydrophobicContact CB-CB 3.81Å; T250-H253 PolarHBondContact N-ND1 3.2Å; T250-H253 WeakPolarHBondContact O-CB 3.41Å; T250-H253 PolarHBondContact O-N 3.43Å; T250-H253 PolarHBondContact OG1-N 3.11Å; T250-H253 PolarHBondContact OG1-ND1 3.28Å; H253-T256 PolarHBondContact O-OG1 2.88Å; H253-R257 WeakPolarHBondContact O-CB 3.43Å; H253-R257 PolarHBondContact O-N 3.04Å; H253-K276 PolarHBondContact CE1-O 3.42Å; H253-K276 PolarHBondContact NE2-O 2.86Å; H253-K276 VanDerWaalsContact NE2-O 3.08Å; H253-M282 PolarHBondContact NE2-O 3.01Å; H253-M282 VanDerWaalsContact NE2-O 3.15Å; H253-F287 HydrophobicContact CB-CE2 4.49Å
254	V	95.9	Very high	95.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-44.7	177.9	176.1	0	0	0	0	110.7	Y211 A219 D249 T250 P251 L252 N258	Y211-V254 HydrophobicContact CE1-CG1 4.16Å; Y211-V254 HydrophobicContact CE1-CG2 4.22Å; A219-V254 HydrophobicContact CB-CG1 3.66Å; D249-V254 HydrophobicContact CB-CG2 4.1Å; T250-V254 PolarHBondContact O-N 2.83Å; P251-V254 PolarHBondContact O-N 2.81Å; L252-V254 VanDerWaalsContact C-N 3.31Å; L252-V254 PolarHBondContact O-N 3.35Å; V254-N258 WeakPolarHBondContact O-CB 3.43Å; V254-N258 PolarHBondContact O-N 3.43Å; V254-N258 VanDerWaalsContact O-N 3.11Å
255	A	96.5	Very high	95.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-48.9	178.6	0	0	0	0	0	112	A218 P251 L252 N258 G259 R260 V263 A264 L267	A218-A255 HydrophobicContact CB-CB 4.36Å; P251-A255 WeakPolarHBondContact O-CB 3.45Å; P251-A255 PolarHBondContact O-N 3.35Å; L252-A255 PolarHBondContact O-N 3.25Å; A255-N258 CarbonylContact O-C 3.57Å; A255-N258 PolarHBondContact O-N 3.17Å; A255-G259 PolarHBondContact O-N 3.08Å; A255-G259 VanDerWaalsContact O-N 3.11Å; A255-R260 HydrophobicContact CB-CB 4.28Å; A255-R260 PolarHBondContact O-N 3.02Å; A255-V263 HydrophobicContact CB-CB 4.09Å; A255-V263 HydrophobicContact CB-CG1 3.57Å; A255-A264 HydrophobicContact CB-CB 4.48Å; A255-L267 HydrophobicContact CB-CD1 4.16Å
256	T	95.2	Very high	95.7	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-67.1	-42.7	-179.5	51.7	0	0	0	0	112.1	L252 H253 N258 G259 A264 S284 F285	L252-T256 HydrophobicContact CD1-CG2 4.29Å; L252-T256 PolarHBondContact O-N 3.13Å; L252-T256 PolarHBondContact O-OG1 3.32Å; H253-T256 PolarHBondContact O-OG1 2.88Å; T256-N258 PolarHBondContact O-N 3Å; T256-G259 PolarHBondContact O-N 3.15Å; T256-A264 HydrophobicContact CG2-CB 4.43Å; T256-S284 WeakPolarHBondContact CB-O 3.38Å; T256-S284 PolarHBondContact OG1-O 3.46Å; T256-F285 HydrophobicContact CG2-CD1 4.09Å; T256-F285 HydrophobicContact CG2-CE1 3.95Å; T256-F285 HydrophobicContact CG2-CZ 4.42Å
257	R	93.4	Very high	95.8	Very high	96 Å²	96	30.2 Å²	30.2	36%	0.362	18%	0.177	S	C	.	.	H	α-helix	trans	-58.5	-35.9	175.3	-177.8	176.9	66	-157.1	-3.8	112.4	Y211 D249 H253 G259 F287	Y211-R257 PolarHBondContact OH-NH2 2.99Å; D249-R257 IonicContact OD2-CZ 3.65Å; D249-R257 IonicContact OD2-NH1 2.74Å; D249-R257 PolarHBondContact OD2-NH1 3.02Å; D249-R257 IonicContact OD2-NH2 3.83Å; H253-R257 WeakPolarHBondContact O-CB 3.43Å; H253-R257 PolarHBondContact O-N 3.04Å; R257-G259 VanDerWaalsContact C-N 3.34Å; R257-F287 HydrophobicContact CB-CD2 4.21Å; R257-F287 HydrophobicContact CB-CG 4.23Å; R257-F287 HydrophobicContact CG-CD1 4.4Å
258	N	94.4	Very high	95.9	Very high	66 Å²	66	30.8 Å²	30.8	35%	0.353	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	6	179.2	-70.8	13.4	0	0	0	113.4	A219 V254 A255 T256 R260	A219-N258 WeakPolarHBondContact CA-ND2 3.37Å; A219-N258 PolarHBondContact O-ND2 3.4Å; V254-N258 WeakPolarHBondContact O-CB 3.43Å; V254-N258 PolarHBondContact O-N 3.43Å; V254-N258 VanDerWaalsContact O-N 3.11Å; A255-N258 CarbonylContact O-C 3.57Å; A255-N258 PolarHBondContact O-N 3.17Å; T256-N258 PolarHBondContact O-N 3Å; N258-R260 VanDerWaalsContact C-N 3.32Å; N258-R260 HydrophobicContact CB-CG 3.84Å; N258-R260 WeakPolarHBondContact O-CD 3.39Å; N258-R260 PolarHBondContact O-N 3.27Å
259	G	94.3	Very high	95.9	Very high	48 Å²	48	38.2 Å²	38.2	50%	0.495	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	30.2	179.7	0	0	0	0	0	114.3	A255 T256 R257 T261	A255-G259 PolarHBondContact O-N 3.08Å; A255-G259 VanDerWaalsContact O-N 3.11Å; T256-G259 PolarHBondContact O-N 3.15Å; R257-G259 VanDerWaalsContact C-N 3.34Å; G259-T261 PolarHBondContact O-N 2.96Å
260	R	96.6	Very high	95.8	Very high	99 Å²	99	40.3 Å²	40.3	37%	0.374	23%	0.23	S	C	.	.			trans	-91.2	74.3	-176.7	-51.5	-52.5	-165.7	-173.6	2.3	111.2	A218 A219 A255 N258 S262 V263 A264	A218-R260 WeakPolarHBondContact O-CG 3.36Å; A219-R260 PolarHBondContact O-NE 2.9Å; A219-R260 VanDerWaalsContact O-NE 3.12Å; A219-R260 PolarHBondContact O-NH2 3.31Å; A255-R260 HydrophobicContact CB-CB 4.28Å; A255-R260 PolarHBondContact O-N 3.02Å; N258-R260 VanDerWaalsContact C-N 3.32Å; N258-R260 HydrophobicContact CB-CG 3.84Å; N258-R260 WeakPolarHBondContact O-CD 3.39Å; N258-R260 PolarHBondContact O-N 3.27Å; R260-S262 PolarHBondContact O-N 3.04Å; R260-V263 HydrophobicContact CB-CB 3.98Å; R260-V263 HydrophobicContact CB-CG2 4.14Å; R260-V263 PolarHBondContact O-N 3.39Å; R260-A264 PolarHBondContact O-N 3.01Å
261	T	95	Very high	95.6	Very high	99 Å²	99	42.5 Å²	42.5	61%	0.607	25%	0.253	S	S	*	.	H	α-helix	trans	-57.7	-44.1	-174.1	-46.8	0	0	0	0	113.5	G259 V263 A264 S265	G259-T261 PolarHBondContact O-N 2.96Å; T261-V263 VanDerWaalsContact C-N 3.34Å; T261-V263 PolarHBondContact O-N 3.27Å; T261-A264 WeakPolarHBondContact O-CB 3.44Å; T261-A264 PolarHBondContact O-N 3.21Å; T261-S265 PolarHBondContact O-N 3.1Å; T261-S265 PolarHBondContact O-OG 2.66Å
262	S	96.5	Very high	95.5	Very high	72 Å²	72	43 Å²	43	50%	0.503	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-40	179.3	52.7	0	0	0	0	112.7	R260 S265 A266	R260-S262 PolarHBondContact O-N 3.04Å; S262-S265 PolarHBondContact O-N 2.83Å; S262-A266 PolarHBondContact O-N 3.11Å
263	V	97.8	Very high	95.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-44.7	173.5	171.1	0	0	0	0	110.6	A218 A223 A255 R260 T261 S265 A266 L267	A218-V263 HydrophobicContact CB-CG1 3.74Å; A223-V263 HydrophobicContact CB-CG2 4.31Å; A255-V263 HydrophobicContact CB-CB 4.09Å; A255-V263 HydrophobicContact CB-CG1 3.57Å; R260-V263 HydrophobicContact CB-CB 3.98Å; R260-V263 HydrophobicContact CB-CG2 4.14Å; R260-V263 PolarHBondContact O-N 3.39Å; T261-V263 VanDerWaalsContact C-N 3.34Å; T261-V263 PolarHBondContact O-N 3.27Å; V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.25Å; V263-A266 PolarHBondContact O-N 3.42Å; V263-L267 HydrophobicContact CG1-CD1 3.69Å; V263-L267 HydrophobicContact CG1-CG 4.05Å; V263-L267 WeakPolarHBondContact O-CB 3.38Å; V263-L267 VanDerWaalsContact O-CG 3.29Å; V263-L267 WeakPolarHBondContact O-CG 3.29Å; V263-L267 PolarHBondContact O-N 3.41Å
264	A	96.6	Very high	95.1	Very high	9 Å²	9	48.6 Å²	48.6	7%	0.074	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-43.2	178.6	0	0	0	0	0	111	L252 A255 T256 R260 T261 L267 L268	L252-A264 HydrophobicContact CD1-CB 3.89Å; A255-A264 HydrophobicContact CB-CB 4.48Å; T256-A264 HydrophobicContact CG2-CB 4.43Å; R260-A264 PolarHBondContact O-N 3.01Å; T261-A264 WeakPolarHBondContact O-CB 3.44Å; T261-A264 PolarHBondContact O-N 3.21Å; A264-L267 PolarHBondContact O-N 3.35Å; A264-L268 WeakPolarHBondContact O-CB 3.17Å; A264-L268 WeakPolarHBondContact O-CG 3.36Å; A264-L268 PolarHBondContact O-N 3.22Å
265	S	96.5	Very high	94.9	Very high	56 Å²	56	54.7 Å²	54.7	39%	0.392	32%	0.317	S	S	.	.	H	α-helix	trans	-58.1	-52	172.5	-64.4	0	0	0	0	112.2	T261 S262 V263 L267 L268 E269	T261-S265 PolarHBondContact O-N 3.1Å; T261-S265 PolarHBondContact O-OG 2.66Å; S262-S265 PolarHBondContact O-N 2.83Å; V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.25Å; S265-L267 VanDerWaalsContact C-N 3.31Å; S265-L267 PolarHBondContact O-N 3.11Å; S265-L268 PolarHBondContact O-N 3.22Å; S265-L268 VanDerWaalsContact O-N 3.16Å; S265-E269 WeakPolarHBondContact O-CG 3.47Å; S265-E269 PolarHBondContact O-N 2.97Å
266	A	95.6	Very high	94.6	Very high	7 Å²	7	58 Å²	58	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-39.8	179.3	0	0	0	0	0	112.9	A223 E227 S262 V263 E269 A270	A223-A266 HydrophobicContact CB-CB 4.2Å; E227-A266 HydrophobicContact CG-CB 4.02Å; S262-A266 PolarHBondContact O-N 3.11Å; V263-A266 PolarHBondContact O-N 3.42Å; A266-E269 PolarHBondContact O-N 3.28Å; A266-A270 WeakPolarHBondContact O-CB 3.31Å; A266-A270 PolarHBondContact O-N 3.31Å
267	L	96.4	Very high	94.3	Very high	0 Å²	0	65 Å²	65	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.5	-40	176.5	-69.5	174.2	0	0	0	112	L214 A218 L230 V241 P251 L252 A255 V263 A264 S265 A270 G271 A272	L214-L267 HydrophobicContact CD1-CD2 4.1Å; L214-L267 HydrophobicContact CD2-CD2 4.45Å; L214-L267 HydrophobicContact CG-CD2 4.47Å; A218-L267 HydrophobicContact CB-CD1 4.49Å; L230-L267 HydrophobicContact CD1-CD2 3.89Å; V241-L267 HydrophobicContact CG2-CD2 4.11Å; P251-L267 VanDerWaalsContact C-CD1 3.43Å; P251-L267 HydrophobicContact CB-CD1 3.77Å; P251-L267 HydrophobicContact CB-CD2 4Å; L252-L267 HydrophobicContact CB-CD1 4.23Å; L252-L267 HydrophobicContact CD1-CB 4.4Å; L252-L267 HydrophobicContact CD1-CD1 4.5Å; A255-L267 HydrophobicContact CB-CD1 4.16Å; V263-L267 HydrophobicContact CG1-CD1 3.69Å; V263-L267 HydrophobicContact CG1-CG 4.05Å; V263-L267 WeakPolarHBondContact O-CB 3.38Å; V263-L267 VanDerWaalsContact O-CG 3.29Å; V263-L267 WeakPolarHBondContact O-CG 3.29Å; V263-L267 PolarHBondContact O-N 3.41Å; A264-L267 PolarHBondContact O-N 3.35Å; S265-L267 VanDerWaalsContact C-N 3.31Å; S265-L267 PolarHBondContact O-N 3.11Å; L267-A270 CarbonylContact O-C 3.28Å; L267-A270 PolarHBondContact O-N 3.38Å; L267-G271 PolarHBondContact O-N 3.05Å; L267-A272 HydrophobicContact CB-CB 3.99Å; L267-A272 WeakPolarHBondContact O-CB 3.43Å; L267-A272 PolarHBondContact O-N 3.37Å
268	L	95.6	Very high	94.2	Very high	70 Å²	70	60.8 Å²	60.8	37%	0.366	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-41.3	175.7	-72	168.6	0	0	0	111.5	L252 A264 S265 A270 G271 F285	L252-L268 HydrophobicContact CD1-CG 4.36Å; L252-L268 HydrophobicContact CD2-CD2 3.97Å; A264-L268 WeakPolarHBondContact O-CB 3.17Å; A264-L268 WeakPolarHBondContact O-CG 3.36Å; A264-L268 PolarHBondContact O-N 3.22Å; S265-L268 PolarHBondContact O-N 3.22Å; S265-L268 VanDerWaalsContact O-N 3.16Å; L268-A270 PolarHBondContact O-N 2.98Å; L268-G271 PolarHBondContact O-N 2.88Å; L268-F285 HydrophobicContact CD1-CZ 4.36Å
269	E	94.6	Very high	94	Very high	165 Å²	165	61.5 Å²	61.5	77%	0.771	35%	0.352	S	S	*	.	H	α-helix	trans	-62	-33.3	173.6	-72.6	174	-169.5	0	0	111.9	S265 A266 G271	S265-E269 WeakPolarHBondContact O-CG 3.47Å; S265-E269 PolarHBondContact O-N 2.97Å; A266-E269 PolarHBondContact O-N 3.28Å; E269-G271 PolarHBondContact O-N 3.44Å
270	A	93	Very high	93.7	Very high	47 Å²	47	67.2 Å²	67.2	39%	0.388	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	4.9	172.2	0	0	0	0	0	114.4	L230 A266 L267 L268	L230-A270 HydrophobicContact CD1-CB 3.64Å; A266-A270 WeakPolarHBondContact O-CB 3.31Å; A266-A270 PolarHBondContact O-N 3.31Å; L267-A270 CarbonylContact O-C 3.28Å; L267-A270 PolarHBondContact O-N 3.38Å; L268-A270 PolarHBondContact O-N 2.98Å
271	G	94.1	Very high	93	Very high	49 Å²	49	69.7 Å²	69.7	51%	0.505	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	19.6	174.4	0	0	0	0	0	115.8	H242 L267 L268 E269 D273	H242-G271 PolarHBondContact CE1-O 2.88Å; L267-G271 PolarHBondContact O-N 3.05Å; L268-G271 PolarHBondContact O-N 2.88Å; E269-G271 PolarHBondContact O-N 3.44Å; G271-D273 PolarHBondContact O-N 3.44Å
272	A	94.5	Very high	92.5	Very high	10 Å²	10	66.8 Å²	66.8	8%	0.083	35%	0.352	C	S	.	.			trans	-59.7	133.8	174.3	0	0	0	0	0	112.1	V241 L252 L267 V274	V241-A272 HydrophobicContact CG2-CB 3.85Å; L252-A272 HydrophobicContact CB-CB 4.17Å; L252-A272 HydrophobicContact CD2-CB 3.98Å; L267-A272 HydrophobicContact CB-CB 3.99Å; L267-A272 WeakPolarHBondContact O-CB 3.43Å; L267-A272 PolarHBondContact O-N 3.37Å; A272-V274 PolarHBondContact O-N 3.26Å
273	D	93.1	Very high	92	Very high	71 Å²	71	64.6 Å²	64.6	38%	0.38	34%	0.335	S	S	.	.			trans	-83	117.2	-179.8	179	8.4	0	0	0	110	H242 G271 E275 K276	H242-D273 PolarHBondContact CE1-N 3.24Å; H242-D273 VanDerWaalsContact CE1-N 3.3Å; G271-D273 PolarHBondContact O-N 3.44Å; D273-E275 VanDerWaalsContact C-N 3.34Å; D273-E275 PolarHBondContact OD1-N 3.48Å; D273-K276 HydrophobicContact CB-CB 4.08Å; D273-K276 PolarHBondContact OD1-N 3.34Å; D273-K276 PolarHBondContact OD2-N 3.01Å
274	V	91.3	Very high	91	Very high	47 Å²	47	64.6 Å²	64.6	29%	0.285	34%	0.335	S	S	.	.	S	Bend	trans	-70.7	-28.6	178.1	60.5	0	0	0	0	113.2	A272 F285	A272-V274 PolarHBondContact O-N 3.26Å; V274-F285 HydrophobicContact CB-CE2 4.31Å; V274-F285 HydrophobicContact CG2-CD2 3.28Å; V274-F285 HydrophobicContact CG2-CE2 3.31Å
275	E	91	Very high	90.1	Very high	128 Å²	128	68 Å²	68	60%	0.598	35%	0.349	S	S	*	.	S	Bend	trans	-90.2	-8	-176.3	-63.5	-55.4	132.5	0	0	112.8	D273 R277	D273-E275 VanDerWaalsContact C-N 3.34Å; D273-E275 PolarHBondContact OD1-N 3.48Å; E275-R277 PolarHBondContact O-N 3.04Å
276	K	90.6	Very high	89	Confident	71 Å²	71	69.8 Å²	69.8	31%	0.309	35%	0.351	S	S	.	.			trans	-60.1	127.2	176.1	-174.2	165.4	172.8	82.3	0	109.1	H242 T250 H253 D273	H242-K276 HydrophobicContact CB-CD 4.26Å; T250-K276 HydrophobicContact CG2-CD 3.64Å; T250-K276 HydrophobicContact CG2-CG 4.27Å; H253-K276 PolarHBondContact CE1-O 3.42Å; H253-K276 PolarHBondContact NE2-O 2.86Å; H253-K276 VanDerWaalsContact NE2-O 3.08Å; D273-K276 HydrophobicContact CB-CB 4.08Å; D273-K276 PolarHBondContact OD1-N 3.34Å; D273-K276 PolarHBondContact OD2-N 3.01Å
277	R	90	Very high	87.4	Confident	155 Å²	155	70.7 Å²	70.7	59%	0.585	35%	0.353	S	S	*	.			trans	-96.3	138.3	179.3	-62.5	-177.7	-179.4	-148.3	1.3	110.9	E275 M282 V283	E275-R277 PolarHBondContact O-N 3.04Å; R277-M282 WeakPolarHBondContact CA-O 3.42Å; R277-V283 HydrophobicContact CG-CG1 3.89Å
278	N	91.3	Very high	85.3	Confident	8 Å²	8	76.1 Å²	76.1	4%	0.043	38%	0.379	C	S	.	.			trans	-75.8	-177.2	169.7	73.6	3.5	0	0	0	111.9	G248 D249 R280 F281 M282	G248-N278 WeakPolarHBondContact O-CA 3.29Å; G248-N278 WeakPolarHBondContact O-CB 3.12Å; D249-N278 WeakPolarHBondContact OD1-CB 3.45Å; D249-N278 PolarHBondContact OD1-ND2 3.42Å; N278-R280 PolarHBondContact O-N 3.48Å; N278-R280 VanDerWaalsContact O-N 3.07Å; N278-R280 WeakPolarHBondContact OD1-CA 3.21Å; N278-R280 WeakPolarHBondContact OD1-CB 3.45Å; N278-R280 PolarHBondContact OD1-N 3.18Å; N278-F281 PolarHBondContact O-N 2.96Å; N278-F281 PolarHBondContact OD1-N 3.43Å; N278-M282 PolarHBondContact N-O 3.36Å; N278-M282 PolarHBondContact OD1-N 3.3Å; N278-M282 PolarHBondContact OD1-O 3.38Å
279	S	90.4	Very high	83.1	Confident	81 Å²	81	78.9 Å²	78.9	57%	0.566	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-11.8	-179.2	-56.7	0	0	0	0	114	N247 G248	N247-S279 VanDerWaalsContact C-OG 3.29Å; N247-S279 WeakPolarHBondContact O-CB 3.43Å; N247-S279 PolarHBondContact O-N 3.35Å; N247-S279 PolarHBondContact O-OG 2.95Å; G248-S279 PolarHBondContact N-OG 2.96Å
280	R	87.1	Confident	80.9	Confident	167 Å²	167	74 Å²	74	63%	0.63	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	11.9	173.2	-58.6	-177.6	-174.6	177.1	3	112.6	N278 M282	N278-R280 PolarHBondContact O-N 3.48Å; N278-R280 VanDerWaalsContact O-N 3.07Å; N278-R280 WeakPolarHBondContact OD1-CA 3.21Å; N278-R280 WeakPolarHBondContact OD1-CB 3.45Å; N278-R280 PolarHBondContact OD1-N 3.18Å; R280-M282 HydrophobicContact CB-CG 4.32Å; R280-M282 PolarHBondContact O-N 3.22Å
281	F	82.3	Confident	78.7	Confident	151 Å²	151	79.3 Å²	79.3	66%	0.662	39%	0.394	S	S	*	.	S	Bend	trans	61.6	17.3	-177.3	-54.7	-81.2	0	0	0	114.9	N278	N278-F281 PolarHBondContact O-N 2.96Å; N278-F281 PolarHBondContact OD1-N 3.43Å
282	M	83.5	Confident	76	Confident	38 Å²	38	85.8 Å²	85.8	19%	0.187	41%	0.408	C	S	.	.			trans	-90.1	139.8	178.2	-62.6	-179.2	65.8	0	0	110.2	H253 R277 N278 R280 Q286 F287	H253-M282 PolarHBondContact NE2-O 3.01Å; H253-M282 VanDerWaalsContact NE2-O 3.15Å; R277-M282 WeakPolarHBondContact CA-O 3.42Å; N278-M282 PolarHBondContact N-O 3.36Å; N278-M282 PolarHBondContact OD1-N 3.3Å; N278-M282 PolarHBondContact OD1-O 3.38Å; R280-M282 HydrophobicContact CB-CG 4.32Å; R280-M282 PolarHBondContact O-N 3.22Å; M282-Q286 HydrophobicContact CE-CB 4.31Å; M282-Q286 HydrophobicContact CE-CG 4.39Å; M282-F287 HydrophobicContact CB-CZ 4.42Å; M282-F287 HydrophobicContact CE-CD1 3.52Å; M282-F287 HydrophobicContact CE-CE1 3.38Å; M282-F287 HydrophobicContact CE-CE2 4.45Å; M282-F287 HydrophobicContact CE-CG 4.13Å; M282-F287 HydrophobicContact CE-CZ 3.88Å; M282-F287 HydrophobicContact SD-CE1 3.8Å; M282-F287 HydrophobicContact SD-CZ 4.07Å
283	V	86.5	Confident	73	Confident	26 Å²	26	92.2 Å²	92.2	16%	0.158	44%	0.439	C	S	.	.			trans	-86.5	160.6	166.1	-64	0	0	0	0	110.4	R277 F285 Q286	R277-V283 HydrophobicContact CG-CG1 3.89Å; V283-F285 VanDerWaalsContact C-N 3.34Å; V283-F285 PolarHBondContact O-N 3.3Å; V283-Q286 HydrophobicContact CG2-CB 3.97Å; V283-Q286 WeakPolarHBondContact O-CB 3.49Å; V283-Q286 PolarHBondContact O-N 3.49Å; V283-Q286 VanDerWaalsContact O-N 3.1Å
284	S	77.9	Confident	70.2	Confident	0 Å²	0	99.8 Å²	99.8	0%	0	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-38.3	-172.7	59.6	0	0	0	0	114	T256 F287	T256-S284 WeakPolarHBondContact CB-O 3.38Å; T256-S284 PolarHBondContact OG1-O 3.46Å; S284-F287 WeakPolarHBondContact O-CD2 3.39Å
285	F	77.3	Confident	69.2	Low	81 Å²	81	102.5 Å²	102.5	36%	0.355	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.4	-179.8	-69	-72.3	0	0	0	114.8	T256 L268 V274 V283 F287 E288	T256-F285 HydrophobicContact CG2-CD1 4.09Å; T256-F285 HydrophobicContact CG2-CE1 3.95Å; T256-F285 HydrophobicContact CG2-CZ 4.42Å; L268-F285 HydrophobicContact CD1-CZ 4.36Å; V274-F285 HydrophobicContact CB-CE2 4.31Å; V274-F285 HydrophobicContact CG2-CD2 3.28Å; V274-F285 HydrophobicContact CG2-CE2 3.31Å; V283-F285 VanDerWaalsContact C-N 3.34Å; V283-F285 PolarHBondContact O-N 3.3Å; F285-F287 PolarHBondContact O-N 3.39Å; F285-E288 PolarHBondContact O-N 2.96Å
286	Q	73.5	Confident	68	Low	94 Å²	94	101.1 Å²	101.1	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-67.2	-22.7	-179.6	-162.8	172.6	-6.1	0	0	112.2	M282 V283 E288 L289 S290	M282-Q286 HydrophobicContact CE-CB 4.31Å; M282-Q286 HydrophobicContact CE-CG 4.39Å; V283-Q286 HydrophobicContact CG2-CB 3.97Å; V283-Q286 WeakPolarHBondContact O-CB 3.49Å; V283-Q286 PolarHBondContact O-N 3.49Å; V283-Q286 VanDerWaalsContact O-N 3.1Å; Q286-E288 VanDerWaalsContact C-N 3.31Å; Q286-E288 PolarHBondContact O-N 3.38Å; Q286-L289 PolarHBondContact O-N 3.49Å; Q286-S290 PolarHBondContact O-N 2.86Å
287	F	62.2	Low	66.8	Low	25 Å²	25	102.8 Å²	102.8	11%	0.11	49%	0.491	C	S	.	.	H	α-helix	trans	-63.6	-32	175.8	-66.8	-69.9	0	0	0	113.3	H253 R257 M282 S284 F285 L289 S290 H291	H253-F287 HydrophobicContact CB-CE2 4.49Å; R257-F287 HydrophobicContact CB-CD2 4.21Å; R257-F287 HydrophobicContact CB-CG 4.23Å; R257-F287 HydrophobicContact CG-CD1 4.4Å; M282-F287 HydrophobicContact CB-CZ 4.42Å; M282-F287 HydrophobicContact CE-CD1 3.52Å; M282-F287 HydrophobicContact CE-CE1 3.38Å; M282-F287 HydrophobicContact CE-CE2 4.45Å; M282-F287 HydrophobicContact CE-CG 4.13Å; M282-F287 HydrophobicContact CE-CZ 3.88Å; M282-F287 HydrophobicContact SD-CE1 3.8Å; M282-F287 HydrophobicContact SD-CZ 4.07Å; S284-F287 WeakPolarHBondContact O-CD2 3.39Å; F285-F287 PolarHBondContact O-N 3.39Å; F287-L289 VanDerWaalsContact C-N 3.35Å; F287-S290 PolarHBondContact O-OG 2.9Å; F287-S290 VanDerWaalsContact O-OG 3.11Å; F287-H291 PolarHBondContact O-CD2 3.16Å
288	E	51	Low	65.4	Low	114 Å²	114	99.7 Å²	99.7	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-33.4	176.9	-74.7	-164.2	165.9	0	0	112.2	F285 Q286	F285-E288 PolarHBondContact O-N 2.96Å; Q286-E288 VanDerWaalsContact C-N 3.31Å; Q286-E288 PolarHBondContact O-N 3.38Å
289	L	49.1	Very low	63.8	Low	129 Å²	129	105.4 Å²	105.4	68%	0.675	51%	0.513	S	S	*	.	H	α-helix	trans	-76.2	-34.7	-178	-70.1	169.4	0	0	0	112.4	Q286 F287 H291 K292	Q286-L289 PolarHBondContact O-N 3.49Å; F287-L289 VanDerWaalsContact C-N 3.35Å; L289-H291 VanDerWaalsContact C-N 3.28Å; L289-H291 PolarHBondContact O-N 3.2Å; L289-K292 PolarHBondContact O-N 3.48Å
290	S	49.4	Very low	62	Low	62 Å²	62	107.1 Å²	107.1	43%	0.434	51%	0.51	S	S	.	.	H	α-helix	trans	-68	-25.5	-180	50	0	0	0	0	113.8	Q286 F287	Q286-S290 PolarHBondContact O-N 2.86Å; F287-S290 PolarHBondContact O-OG 2.9Å; F287-S290 VanDerWaalsContact O-OG 3.11Å
291	H	46.3	Very low	60.2	Low	158 Å²	158	102.8 Å²	102.8	73%	0.731	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.7	-179.6	-78	-67.2	0	0	0	114.6	F287 L289	F287-H291 PolarHBondContact O-CD2 3.16Å; L289-H291 VanDerWaalsContact C-N 3.28Å; L289-H291 PolarHBondContact O-N 3.2Å
292	K	37.5	Very low	58.5	Low	186 Å²	186	99.1 Å²	99.1	81%	0.809	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	11.5	175.3	-75	-171.9	178.4	176.6	0	114.4	L289	L289-K292 PolarHBondContact O-N 3.48Å
293	I	31.1	Very low	56.5	Low	144 Å²	144	104.2 Å²	104.2	74%	0.738	51%	0.514	S	S	*	.			trans	-103	84.1	171.1	-53.9	174.1	0	0	0	108.3
294	I	35.6	Very low	53.7	Low	231 Å²	231	111.3 Å²	111.3	100%	1.185	55%	0.546	S	S	*	.			trans	-130	0	152.8	-52.9	178.2	0	0	0	105.1

Retrieved 294 of 294 residues in 296.3 ms (Link to these results)

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