A0A077Z4L9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4L9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 195 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	21.8	Very low	25.6	Very low	209 Å²	209	130.6 Å²	130.6	100%	1.03	74%	0.736	S	S	*	*				0	137.4	0	-72.2	170.8	-179.6	0	0	108
2	I	20.5	Very low	26.6	Very low	169 Å²	169	125.7 Å²	125.7	87%	0.867	72%	0.716	S	S	*	*			trans	-96.9	117.6	164.7	-61.6	175.1	0	0	0	105.6	G4	I2-G4 PolarHBondContact O-N 3.41Å; I2-G4 VanDerWaalsContact O-N 3.13Å
3	Y	20.9	Very low	27.5	Very low	199 Å²	199	120.7 Å²	120.7	78%	0.78	69%	0.685	S	S	*	*			trans	-74.4	102.1	176.1	-72.2	-88.2	0	0	0	108.8	V5	Y3-V5 PolarHBondContact O-N 3.01Å
4	G	21.9	Very low	28.6	Very low	63 Å²	63	121.2 Å²	121.2	65%	0.649	69%	0.685	S	S	*	*			trans	-74.3	113.4	170.5	0	0	0	0	0	109.9	I2 V6	I2-G4 PolarHBondContact O-N 3.41Å; I2-G4 VanDerWaalsContact O-N 3.13Å; G4-V6 PolarHBondContact O-N 2.89Å
5	V	25.1	Very low	29.2	Very low	141 Å²	141	117.9 Å²	117.9	86%	0.855	67%	0.673	S	S	*	*			trans	-70.3	109.7	171.9	-179.7	0	0	0	0	108.2	Y3 K7	Y3-V5 PolarHBondContact O-N 3.01Å; V5-K7 PolarHBondContact O-N 3.5Å
6	V	24.8	Very low	29.8	Very low	132 Å²	132	112.8 Å²	112.8	80%	0.8	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-77.6	116.9	176	-178.9	0	0	0	0	108.5	G4	G4-V6 PolarHBondContact O-N 2.89Å
7	K	30.4	Very low	30.5	Very low	81 Å²	81	108.5 Å²	108.5	35%	0.352	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-71.8	132.8	179.1	-148.5	-176.3	-165.3	-163	0	109.9	V5 W11 S12 L13	V5-K7 PolarHBondContact O-N 3.5Å; K7-W11 HydrophobicContact CD-CB 4.03Å; K7-W11 HydrophobicContact CG-CB 4.18Å; K7-W11 HydrophobicContact CG-CE3 4.39Å; K7-W11 PolarHBondContact NZ-O 3.43Å; K7-S12 PolarHBondContact NZ-O 3.25Å; K7-L13 VanDerWaalsContact NZ-CD1 3.33Å
8	P	26.6	Very low	31.3	Very low	69 Å²	69	108.3 Å²	108.3	45%	0.448	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-64.1	144.3	173.9	-19.9	32.2	0	0	0	111.3	G10	P8-G10 PolarHBondContact O-N 3.17Å
9	P	27.5	Very low	32.2	Very low	138 Å²	138	107 Å²	107	90%	0.896	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	127.8	173.4	26.6	-33.3	0	0	0	110
10	G	31	Very low	33.1	Very low	80 Å²	80	105.8 Å²	105.8	83%	0.825	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.4	-9.9	-180	0	0	0	0	0	115.9	P8 S12	P8-G10 PolarHBondContact O-N 3.17Å; G10-S12 PolarHBondContact O-N 3.1Å
11	W	31.1	Very low	33.9	Very low	156 Å²	156	102.2 Å²	102.2	59%	0.591	58%	0.583	S	S	*	*			trans	-81.3	99.6	173	-81.2	29.3	0	0	0	112.1	K7	K7-W11 HydrophobicContact CD-CB 4.03Å; K7-W11 HydrophobicContact CG-CB 4.18Å; K7-W11 HydrophobicContact CG-CE3 4.39Å; K7-W11 PolarHBondContact NZ-O 3.43Å
12	S	37.1	Very low	35.4	Very low	71 Å²	71	97.2 Å²	97.2	50%	0.497	56%	0.556	S	S	.	*			trans	-57.6	146.3	159.7	55.4	0	0	0	0	110.1	K7 G10 D14	K7-S12 PolarHBondContact NZ-O 3.25Å; G10-S12 PolarHBondContact O-N 3.1Å; S12-D14 VanDerWaalsContact C-N 3.34Å
13	L	38.3	Very low	37	Very low	61 Å²	61	92.1 Å²	92.1	32%	0.319	54%	0.536	S	S	.	.	S	Bend	trans	-73.9	-28.9	177.9	-87.6	82.4	0	0	0	111.9	K7 S15 L82	K7-L13 VanDerWaalsContact NZ-CD1 3.33Å; L13-S15 PolarHBondContact O-N 3.26Å; L13-L82 HydrophobicContact CD2-CD1 3.82Å; L13-L82 HydrophobicContact CD2-CD2 3.68Å; L13-L82 HydrophobicContact CD2-CG 4.43Å
14	D	43.2	Very low	38.5	Very low	128 Å²	128	83 Å²	83	68%	0.684	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-16	-153.1	-49.4	-54.5	0	0	0	115.6	S12 L18	S12-D14 VanDerWaalsContact C-N 3.34Å; D14-L18 WeakPolarHBondContact O-CB 3.49Å; D14-L18 WeakPolarHBondContact O-CD1 3.44Å
15	S	37.2	Very low	40	Very low	72 Å²	72	81.7 Å²	81.7	50%	0.503	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-49.2	-177.2	60.3	0	0	0	0	113.5	L13 T19	L13-S15 PolarHBondContact O-N 3.26Å; S15-T19 WeakPolarHBondContact O-CB 3.48Å; S15-T19 PolarHBondContact O-N 3.44Å; S15-T19 PolarHBondContact O-OG1 3.22Å
16	A	38.7	Very low	41.6	Very low	35 Å²	35	79.8 Å²	79.8	29%	0.289	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-47.2	-175.8	0	0	0	0	0	112	L18 T19 I20	A16-L18 PolarHBondContact O-N 3.17Å; A16-T19 PolarHBondContact O-N 3.39Å; A16-I20 WeakPolarHBondContact O-CG1 3.43Å; A16-I20 PolarHBondContact O-N 3.32Å
17	D	42.9	Very low	43.2	Very low	40 Å²	40	76 Å²	76	21%	0.214	44%	0.439	C	S	.	.	H	α-helix	trans	-70.8	-34.1	-176.2	-63	-47.1	0	0	0	111.5	I20 H21	D17-I20 PolarHBondContact O-N 3.47Å; D17-H21 PolarHBondContact O-N 2.98Å; D17-H21 PolarHBondContact O-ND1 3.2Å
18	L	44.4	Very low	44.4	Very low	105 Å²	105	72.3 Å²	72.3	55%	0.55	42%	0.423	S	S	.	.	H	α-helix	trans	-70.3	-39.3	174.9	-130.6	159.2	0	0	0	111.8	D14 A16 H21 H22	D14-L18 WeakPolarHBondContact O-CB 3.49Å; D14-L18 WeakPolarHBondContact O-CD1 3.44Å; A16-L18 PolarHBondContact O-N 3.17Å; L18-H21 PolarHBondContact O-N 3.06Å; L18-H22 WeakPolarHBondContact O-CB 3.31Å; L18-H22 PolarHBondContact O-N 3.12Å
19	T	48.3	Very low	45.8	Very low	84 Å²	84	71.7 Å²	71.7	52%	0.515	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-45	171.1	-56.5	0	0	0	0	111	S15 A16 H21 H22 S23	S15-T19 WeakPolarHBondContact O-CB 3.48Å; S15-T19 PolarHBondContact O-N 3.44Å; S15-T19 PolarHBondContact O-OG1 3.22Å; A16-T19 PolarHBondContact O-N 3.39Å; T19-H21 PolarHBondContact O-N 3.18Å; T19-H22 PolarHBondContact O-N 3.29Å; T19-S23 PolarHBondContact O-N 3.41Å; T19-S23 PolarHBondContact O-OG 2.94Å
20	I	50.2	Low	47.3	Very low	82 Å²	82	68 Å²	68	42%	0.421	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-46.1	177.1	-71.6	165.3	0	0	0	110.7	A16 D17 H22 S23 I24 T86	A16-I20 WeakPolarHBondContact O-CG1 3.43Å; A16-I20 PolarHBondContact O-N 3.32Å; D17-I20 PolarHBondContact O-N 3.47Å; I20-H22 PolarHBondContact O-N 3.28Å; I20-S23 PolarHBondContact O-N 3.08Å; I20-I24 HydrophobicContact CG2-CD1 3.58Å; I20-I24 HydrophobicContact CG2-CG1 4.47Å; I20-I24 WeakPolarHBondContact O-CB 2.81Å; I20-I24 VanDerWaalsContact O-CD1 3.28Å; I20-I24 WeakPolarHBondContact O-CD1 3.21Å; I20-I24 WeakPolarHBondContact O-CG1 3.39Å; I20-I24 PolarHBondContact O-N 2.71Å; I20-T86 HydrophobicContact CG2-CG2 4.32Å
21	H	50.8	Low	48.6	Very low	32 Å²	32	69.2 Å²	69.2	15%	0.148	38%	0.381	C	S	.	.	H	α-helix	trans	-57	-48.9	173.6	-82.2	38.4	0	0	0	111.6	D17 L18 T19 S23 I24 L25 T86	D17-H21 PolarHBondContact O-N 2.98Å; D17-H21 PolarHBondContact O-ND1 3.2Å; L18-H21 PolarHBondContact O-N 3.06Å; T19-H21 PolarHBondContact O-N 3.18Å; H21-S23 PolarHBondContact O-N 2.88Å; H21-I24 PolarHBondContact O-N 2.92Å; H21-L25 WeakPolarHBondContact O-CB 3.35Å; H21-L25 WeakPolarHBondContact O-CD1 3.48Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 2.93Å; H21-T86 PolarHBondContact CE1-OG1 3.32Å
22	H	51.6	Low	49.8	Very low	103 Å²	103	62.2 Å²	62.2	48%	0.477	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-44.2	-178.7	-152.3	-88.6	0	0	0	112.3	L18 T19 I20 I24 L25 E26	L18-H22 WeakPolarHBondContact O-CB 3.31Å; L18-H22 PolarHBondContact O-N 3.12Å; T19-H22 PolarHBondContact O-N 3.29Å; I20-H22 PolarHBondContact O-N 3.28Å; H22-I24 PolarHBondContact O-N 3.04Å; H22-L25 WeakPolarHBondContact O-CB 3.36Å; H22-L25 PolarHBondContact O-N 2.8Å; H22-E26 IonicContact CE1-OE1 3.1Å; H22-E26 PolarHBondContact CE1-OE1 3.31Å; H22-E26 IonicContact ND1-OE1 3.57Å; H22-E26 PolarHBondContact ND1-OE1 3.1Å; H22-E26 VanDerWaalsContact ND1-OE1 3.1Å; H22-E26 IonicContact ND1-OE2 3.37Å; H22-E26 WeakPolarHBondContact O-CB 3.26Å; H22-E26 WeakPolarHBondContact O-CG 3.29Å; H22-E26 PolarHBondContact O-N 3.48Å
23	S	54.5	Low	50.9	Low	62 Å²	62	60.7 Å²	60.7	43%	0.434	35%	0.347	S	S	.	.	H	α-helix	trans	-65.8	-35.6	177	-60.4	0	0	0	0	113.1	T19 I20 H21 C27	T19-S23 PolarHBondContact O-N 3.41Å; T19-S23 PolarHBondContact O-OG 2.94Å; I20-S23 PolarHBondContact O-N 3.08Å; H21-S23 PolarHBondContact O-N 2.88Å; S23-C27 WeakPolarHBondContact O-CB 3.11Å; S23-C27 PolarHBondContact O-N 3.21Å
24	I	52.9	Low	51.9	Low	8 Å²	8	62.8 Å²	62.8	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-44.5	173	-70.4	160.7	0	0	0	110.2	I20 H21 H22 N28 T86 I90 I93 I141	I20-I24 HydrophobicContact CG2-CD1 3.58Å; I20-I24 HydrophobicContact CG2-CG1 4.47Å; I20-I24 WeakPolarHBondContact O-CB 2.81Å; I20-I24 VanDerWaalsContact O-CD1 3.28Å; I20-I24 WeakPolarHBondContact O-CD1 3.21Å; I20-I24 WeakPolarHBondContact O-CG1 3.39Å; I20-I24 PolarHBondContact O-N 2.71Å; H21-I24 PolarHBondContact O-N 2.92Å; H22-I24 PolarHBondContact O-N 3.04Å; I24-N28 WeakPolarHBondContact CG2-ND2 3.43Å; I24-N28 WeakPolarHBondContact O-CB 3.39Å; I24-N28 PolarHBondContact O-N 2.94Å; I24-N28 PolarHBondContact O-ND2 2.9Å; I24-T86 HydrophobicContact CD1-CG2 4.27Å; I24-I90 HydrophobicContact CD1-CD1 3.91Å; I24-I90 HydrophobicContact CD1-CG1 3.79Å; I24-I90 HydrophobicContact CG2-CG1 4.03Å; I24-I93 HydrophobicContact CG2-CD1 4.36Å; I24-I141 HydrophobicContact CD1-CD1 3.58Å; I24-I141 HydrophobicContact CG1-CD1 3.61Å; I24-I141 HydrophobicContact CG1-CG1 4.44Å
25	L	54.4	Low	52.3	Low	35 Å²	35	58 Å²	58	18%	0.183	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-49.9	179	-72.5	164.4	0	0	0	111.9	H21 H22 N28 S29 I57 I93	H21-L25 WeakPolarHBondContact O-CB 3.35Å; H21-L25 WeakPolarHBondContact O-CD1 3.48Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 2.93Å; H22-L25 WeakPolarHBondContact O-CB 3.36Å; H22-L25 PolarHBondContact O-N 2.8Å; L25-N28 PolarHBondContact O-N 3.38Å; L25-S29 WeakPolarHBondContact O-CB 3.46Å; L25-S29 PolarHBondContact O-N 3.03Å; L25-S29 PolarHBondContact O-OG 2.6Å; L25-I57 HydrophobicContact CD2-CG2 3.07Å; L25-I93 HydrophobicContact CD2-CD1 3.59Å; L25-I93 HydrophobicContact CD2-CG1 4.48Å; L25-I93 HydrophobicContact CG-CD1 4.33Å
26	E	57.5	Low	53.1	Low	102 Å²	102	54.8 Å²	54.8	48%	0.477	31%	0.308	S	S	.	.	H	α-helix	trans	-58.4	-52.1	176.3	-76.1	175	154.8	0	0	110.9	H22 N28 S29 A30	H22-E26 IonicContact CE1-OE1 3.1Å; H22-E26 PolarHBondContact CE1-OE1 3.31Å; H22-E26 IonicContact ND1-OE1 3.57Å; H22-E26 PolarHBondContact ND1-OE1 3.1Å; H22-E26 VanDerWaalsContact ND1-OE1 3.1Å; H22-E26 IonicContact ND1-OE2 3.37Å; H22-E26 WeakPolarHBondContact O-CB 3.26Å; H22-E26 WeakPolarHBondContact O-CG 3.29Å; H22-E26 PolarHBondContact O-N 3.48Å; E26-N28 PolarHBondContact O-N 3.46Å; E26-S29 PolarHBondContact O-N 3.42Å; E26-S29 PolarHBondContact O-OG 3.31Å; E26-A30 WeakPolarHBondContact O-CB 3.16Å; E26-A30 PolarHBondContact O-N 2.99Å
27	C	59.7	Low	54.1	Low	52 Å²	52	58.6 Å²	58.6	35%	0.351	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-41.5	-178.4	-173.5	0	0	0	0	112.3	S23 A30 R31 C140	S23-C27 WeakPolarHBondContact O-CB 3.11Å; S23-C27 PolarHBondContact O-N 3.21Å; C27-A30 PolarHBondContact O-N 3.38Å; C27-R31 WeakPolarHBondContact O-CB 3.35Å; C27-R31 PolarHBondContact O-N 2.64Å; C27-C140 HydrophobicContact CB-CB 3.67Å; C27-C140 WeakPolarHBondContact CB-SG 3.45Å; C27-C140 PolarHBondContact O-SG 3.19Å; C27-C140 WeakPolarHBondContact SG-CB 3.44Å; C27-C140 CovalentContact SG-SG 2.02Å; C27-C140 PolarHBondContact SG-SG 3.33Å
28	N	53.9	Low	54.7	Low	3 Å²	3	63.1 Å²	63.1	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-67.8	-40.1	176.2	-81	-31.2	0	0	0	112.2	I24 L25 E26 A30 R31 L32 I93 Q97 C140	I24-N28 WeakPolarHBondContact CG2-ND2 3.43Å; I24-N28 WeakPolarHBondContact O-CB 3.39Å; I24-N28 PolarHBondContact O-N 2.94Å; I24-N28 PolarHBondContact O-ND2 2.9Å; L25-N28 PolarHBondContact O-N 3.38Å; E26-N28 PolarHBondContact O-N 3.46Å; N28-A30 VanDerWaalsContact C-N 3.34Å; N28-A30 PolarHBondContact O-N 3.36Å; N28-R31 PolarHBondContact O-N 2.78Å; N28-L32 WeakPolarHBondContact O-CB 3.35Å; N28-L32 PolarHBondContact O-N 3.19Å; N28-I93 HydrophobicContact CB-CG2 3.63Å; N28-I93 WeakPolarHBondContact ND2-CG2 3.06Å; N28-Q97 VanDerWaalsContact C-NE2 3.3Å; N28-Q97 PolarHBondContact O-NE2 2.82Å; N28-Q97 PolarHBondContact OD1-NE2 3.42Å; N28-Q97 PolarHBondContact OD1-OE1 2.78Å; N28-C140 PolarHBondContact OD1-N 3.08Å
29	S	56.8	Low	55.2	Low	56 Å²	56	58.7 Å²	58.7	39%	0.392	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-38.2	175	72.8	0	0	0	0	112.2	L25 E26 L32 A33	L25-S29 WeakPolarHBondContact O-CB 3.46Å; L25-S29 PolarHBondContact O-N 3.03Å; L25-S29 PolarHBondContact O-OG 2.6Å; E26-S29 PolarHBondContact O-N 3.42Å; E26-S29 PolarHBondContact O-OG 3.31Å; S29-L32 PolarHBondContact O-N 3.04Å; S29-A33 WeakPolarHBondContact O-CB 3.4Å; S29-A33 PolarHBondContact O-N 3Å
30	A	59.9	Low	55.6	Low	61 Å²	61	60.2 Å²	60.2	50%	0.504	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-45.7	174.7	0	0	0	0	0	112.3	E26 C27 N28 L32 A33 Q34	E26-A30 WeakPolarHBondContact O-CB 3.16Å; E26-A30 PolarHBondContact O-N 2.99Å; C27-A30 PolarHBondContact O-N 3.38Å; N28-A30 VanDerWaalsContact C-N 3.34Å; N28-A30 PolarHBondContact O-N 3.36Å; A30-L32 VanDerWaalsContact C-N 3.35Å; A30-L32 PolarHBondContact O-N 2.99Å; A30-A33 PolarHBondContact O-N 2.82Å; A30-Q34 WeakPolarHBondContact O-CB 3.42Å; A30-Q34 PolarHBondContact O-N 2.74Å
31	R	57.2	Low	55.8	Low	106 Å²	106	57.6 Å²	57.6	40%	0.4	32%	0.315	S	S	.	.	H	α-helix	trans	-59.2	-43.3	173.7	-86.2	-85	-173	156.7	3.5	112.1	C27 N28 Q34 V35 T137 I138	C27-R31 WeakPolarHBondContact O-CB 3.35Å; C27-R31 PolarHBondContact O-N 2.64Å; N28-R31 PolarHBondContact O-N 2.78Å; R31-Q34 WeakPolarHBondContact O-CB 3.35Å; R31-Q34 PolarHBondContact O-N 3.11Å; R31-V35 WeakPolarHBondContact O-CG2 3.26Å; R31-V35 PolarHBondContact O-N 3.41Å; R31-V35 VanDerWaalsContact O-N 3.11Å; R31-T137 PolarHBondContact NH1-O 2.84Å; R31-I138 HydrophobicContact CB-CG2 3.82Å; R31-I138 WeakPolarHBondContact CG-O 3.17Å
32	L	57.1	Low	56.1	Low	8 Å²	8	61.3 Å²	61.3	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-48.9	176.5	-176.8	82	0	0	0	110.9	N28 S29 A30 Q34 V35 A36 V50 I53 Q97 I100	N28-L32 WeakPolarHBondContact O-CB 3.35Å; N28-L32 PolarHBondContact O-N 3.19Å; S29-L32 PolarHBondContact O-N 3.04Å; A30-L32 VanDerWaalsContact C-N 3.35Å; A30-L32 PolarHBondContact O-N 2.99Å; L32-Q34 PolarHBondContact O-N 2.64Å; L32-V35 PolarHBondContact O-N 2.94Å; L32-V35 VanDerWaalsContact O-N 3.17Å; L32-A36 VanDerWaalsContact O-CB 3.31Å; L32-A36 WeakPolarHBondContact O-CB 3.31Å; L32-A36 PolarHBondContact O-N 3.11Å; L32-V50 HydrophobicContact CD2-CG2 4.33Å; L32-I53 HydrophobicContact CD2-CD1 3.58Å; L32-I53 HydrophobicContact CD2-CG2 4.23Å; L32-Q97 HydrophobicContact CD1-CB 4.42Å; L32-Q97 HydrophobicContact CD1-CG 4.15Å; L32-I100 HydrophobicContact CD1-CB 4.12Å; L32-I100 HydrophobicContact CD1-CD1 3.78Å; L32-I100 HydrophobicContact CD1-CG2 4.04Å
33	A	59.1	Low	56.4	Low	39 Å²	39	60.7 Å²	60.7	32%	0.322	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-37.1	177.4	0	0	0	0	0	112	S29 A30 A36 N37	S29-A33 WeakPolarHBondContact O-CB 3.4Å; S29-A33 PolarHBondContact O-N 3Å; A30-A33 PolarHBondContact O-N 2.82Å; A33-A36 PolarHBondContact O-N 3.26Å; A33-N37 WeakPolarHBondContact O-CB 3.38Å; A33-N37 VanDerWaalsContact O-CG 3.28Å; A33-N37 PolarHBondContact O-N 3.11Å
34	Q	59.4	Low	56.5	Low	106 Å²	106	63 Å²	63	50%	0.495	35%	0.345	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.9	-170.2	-179.6	21.7	0	0	112.3	A30 R31 L32 Q38	A30-Q34 WeakPolarHBondContact O-CB 3.42Å; A30-Q34 PolarHBondContact O-N 2.74Å; R31-Q34 WeakPolarHBondContact O-CB 3.35Å; R31-Q34 PolarHBondContact O-N 3.11Å; L32-Q34 PolarHBondContact O-N 2.64Å; Q34-Q38 WeakPolarHBondContact O-CG 3.28Å; Q34-Q38 PolarHBondContact O-N 2.73Å
35	V	52.8	Low	56.4	Low	27 Å²	27	65.1 Å²	65.1	16%	0.164	36%	0.358	C	S	.	.	H	α-helix	trans	-72.4	-36	177.9	-175.2	0	0	0	0	111.5	R31 L32 N37 Q38 S39 V101 L104	R31-V35 WeakPolarHBondContact O-CG2 3.26Å; R31-V35 PolarHBondContact O-N 3.41Å; R31-V35 VanDerWaalsContact O-N 3.11Å; L32-V35 PolarHBondContact O-N 2.94Å; L32-V35 VanDerWaalsContact O-N 3.17Å; V35-N37 VanDerWaalsContact C-N 3.33Å; V35-N37 PolarHBondContact O-N 3.05Å; V35-Q38 WeakPolarHBondContact O-CB 3.42Å; V35-Q38 PolarHBondContact O-N 2.83Å; V35-S39 PolarHBondContact O-N 2.96Å; V35-V101 HydrophobicContact CB-CG2 3.9Å; V35-V101 HydrophobicContact CG1-CB 4.26Å; V35-V101 HydrophobicContact CG1-CG1 3.84Å; V35-V101 HydrophobicContact CG1-CG2 3.48Å; V35-V101 VanDerWaalsContact CG1-CG2 3.48Å; V35-V101 HydrophobicContact CG2-CG2 4.26Å; V35-L104 HydrophobicContact CG1-CD1 4.23Å
36	A	53.3	Low	56.3	Low	5 Å²	5	65.9 Å²	65.9	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-41.6	174.3	0	0	0	0	0	111.7	L32 A33 Q38 S39 R46	L32-A36 VanDerWaalsContact O-CB 3.31Å; L32-A36 WeakPolarHBondContact O-CB 3.31Å; L32-A36 PolarHBondContact O-N 3.11Å; A33-A36 PolarHBondContact O-N 3.26Å; A36-Q38 PolarHBondContact O-N 2.77Å; A36-S39 PolarHBondContact O-N 3.37Å; A36-S39 PolarHBondContact O-OG 2.85Å; A36-R46 HydrophobicContact CB-CG 3.76Å; A36-R46 PolarHBondContact O-NE 3.48Å
37	N	59.5	Low	56.3	Low	114 Å²	114	67.8 Å²	67.8	61%	0.61	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-11.2	174.1	-73.1	-13.3	0	0	0	114.3	A33 V35	A33-N37 WeakPolarHBondContact O-CB 3.38Å; A33-N37 VanDerWaalsContact O-CG 3.28Å; A33-N37 PolarHBondContact O-N 3.11Å; V35-N37 VanDerWaalsContact C-N 3.33Å; V35-N37 PolarHBondContact O-N 3.05Å
38	Q	56.5	Low	56	Low	135 Å²	135	71.9 Å²	71.9	63%	0.631	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-9.4	171.9	-72.1	173	1.5	0	0	113	Q34 V35 A36	Q34-Q38 WeakPolarHBondContact O-CG 3.28Å; Q34-Q38 PolarHBondContact O-N 2.73Å; V35-Q38 WeakPolarHBondContact O-CB 3.42Å; V35-Q38 PolarHBondContact O-N 2.83Å; A36-Q38 PolarHBondContact O-N 2.77Å
39	S	53.6	Low	55.9	Low	12 Å²	12	75.3 Å²	75.3	8%	0.084	40%	0.397	C	S	.	.	S	Bend	trans	-86.4	154.8	178.3	73.2	0	0	0	0	112.4	V35 A36 W41	V35-S39 PolarHBondContact O-N 2.96Å; A36-S39 PolarHBondContact O-N 3.37Å; A36-S39 PolarHBondContact O-OG 2.85Å; S39-W41 PolarHBondContact O-N 3.41Å; S39-W41 VanDerWaalsContact O-N 3.16Å
40	T	56.5	Low	55.8	Low	116 Å²	116	74.5 Å²	74.5	71%	0.712	39%	0.389	S	S	*	.			trans	-78	11.3	177.4	62.2	0	0	0	0	114.3	D108	T40-D108 WeakPolarHBondContact CB-OD1 3.19Å; T40-D108 WeakPolarHBondContact CG2-OD1 3.39Å; T40-D108 PolarHBondContact N-OD1 3.45Å; T40-D108 PolarHBondContact OG1-OD1 2.94Å
41	W	54.4	Low	55.7	Low	27 Å²	27	76.7 Å²	76.7	10%	0.102	39%	0.389	C	S	.	.			trans	-65.2	138.1	-174.5	-90.8	28.2	0	0	0	114	S39 D43 V45 R46 H49 L104	S39-W41 PolarHBondContact O-N 3.41Å; S39-W41 VanDerWaalsContact O-N 3.16Å; W41-D43 PolarHBondContact O-N 2.82Å; W41-V45 HydrophobicContact CD2-CB 4.42Å; W41-V45 HydrophobicContact CD2-CG1 4.41Å; W41-V45 HydrophobicContact CE3-CB 3.79Å; W41-V45 HydrophobicContact CE3-CG1 3.74Å; W41-V45 HydrophobicContact CH2-CG1 3.81Å; W41-V45 HydrophobicContact CZ2-CG1 4.46Å; W41-V45 HydrophobicContact CZ3-CB 3.98Å; W41-V45 HydrophobicContact CZ3-CG1 3.42Å; W41-V45 VanDerWaalsContact CZ3-CG1 3.42Å; W41-V45 WeakPolarHBondContact CZ3-O 3.42Å; W41-R46 PolarHBondContact O-NH2 3.48Å; W41-H49 AromaticContact CH2-CD2 3.96Å; W41-H49 AromaticContact CH2-CE1 3.66Å; W41-H49 AromaticContact CH2-CG 3.99Å; W41-H49 AromaticContact CH2-ND1 3.81Å; W41-H49 AromaticContact CH2-NE2 3.75Å; W41-H49 HydrophobicContact CZ3-CB 4.17Å; W41-H49 AromaticContact CZ3-CE1 3.86Å; W41-H49 AromaticContact CZ3-CG 3.64Å; W41-H49 AromaticContact CZ3-ND1 3.5Å; W41-L104 HydrophobicContact CD2-CD2 3.46Å; W41-L104 VanDerWaalsContact CD2-CD2 3.46Å; W41-L104 HydrophobicContact CE3-CD2 3.85Å; W41-L104 HydrophobicContact CG-CD2 3.74Å; W41-L104 HydrophobicContact CH2-CD2 4.48Å; W41-L104 HydrophobicContact CZ2-CD2 4.17Å; W41-L104 HydrophobicContact CZ3-CD2 4.31Å
42	N	57.6	Low	55.5	Low	110 Å²	110	77.3 Å²	77.3	59%	0.588	40%	0.395	S	S	*	.			trans	-56.4	132.6	166.1	-176.9	-0.1	0	0	0	110.1	N44 V45 R46	N42-N44 VanDerWaalsContact C-N 3.27Å; N42-N44 PolarHBondContact O-N 3.26Å; N42-N44 VanDerWaalsContact O-N 3.15Å; N42-V45 HydrophobicContact CB-CG2 4.3Å; N42-V45 PolarHBondContact O-N 3.47Å; N42-R46 PolarHBondContact O-N 3.47Å
43	D	58.8	Low	55.2	Low	91 Å²	91	77.5 Å²	77.5	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-54.1	-40.3	-167.8	-63.7	-54	0	0	0	112.8	W41 V45 R46 E47	W41-D43 PolarHBondContact O-N 2.82Å; D43-V45 VanDerWaalsContact C-N 3.35Å; D43-V45 PolarHBondContact O-N 2.94Å; D43-R46 WeakPolarHBondContact O-CA 3.47Å; D43-R46 VanDerWaalsContact O-CB 3.27Å; D43-R46 WeakPolarHBondContact O-CB 3.19Å; D43-R46 PolarHBondContact O-N 2.76Å; D43-R46 VanDerWaalsContact O-N 3.13Å; D43-R46 IonicContact OD1-CZ 2.77Å; D43-R46 IonicContact OD1-NH1 3.2Å; D43-R46 PolarHBondContact OD1-NH1 3.16Å; D43-R46 IonicContact OD1-NH2 2.73Å; D43-R46 PolarHBondContact OD1-NH2 3.15Å; D43-E47 PolarHBondContact O-N 3.32Å
44	N	55	Low	55	Low	111 Å²	111	81.4 Å²	81.4	59%	0.594	41%	0.405	S	S	*	.	H	α-helix	trans	-57.8	-42.6	178.5	-67.8	4.6	0	0	0	113.3	N42 R46 E47 E48	N42-N44 VanDerWaalsContact C-N 3.27Å; N42-N44 PolarHBondContact O-N 3.26Å; N42-N44 VanDerWaalsContact O-N 3.15Å; N44-R46 VanDerWaalsContact C-N 3.29Å; N44-R46 PolarHBondContact O-N 3.3Å; N44-E47 PolarHBondContact O-N 2.89Å; N44-E48 PolarHBondContact O-N 2.94Å
45	V	51.3	Low	54.9	Low	52 Å²	52	81.6 Å²	81.6	32%	0.315	41%	0.406	S	S	.	.	H	α-helix	trans	-72.6	-31.7	-178	-159.3	0	0	0	0	110.1	W41 N42 D43 H49	W41-V45 HydrophobicContact CD2-CB 4.42Å; W41-V45 HydrophobicContact CD2-CG1 4.41Å; W41-V45 HydrophobicContact CE3-CB 3.79Å; W41-V45 HydrophobicContact CE3-CG1 3.74Å; W41-V45 HydrophobicContact CH2-CG1 3.81Å; W41-V45 HydrophobicContact CZ2-CG1 4.46Å; W41-V45 HydrophobicContact CZ3-CB 3.98Å; W41-V45 HydrophobicContact CZ3-CG1 3.42Å; W41-V45 VanDerWaalsContact CZ3-CG1 3.42Å; W41-V45 WeakPolarHBondContact CZ3-O 3.42Å; N42-V45 HydrophobicContact CB-CG2 4.3Å; N42-V45 PolarHBondContact O-N 3.47Å; D43-V45 VanDerWaalsContact C-N 3.35Å; D43-V45 PolarHBondContact O-N 2.94Å; V45-H49 PolarHBondContact O-N 3.49Å; V45-H49 VanDerWaalsContact O-N 3.15Å; V45-H49 PolarHBondContact O-ND1 3.27Å; V45-H49 VanDerWaalsContact O-ND1 3.16Å
46	R	51.6	Low	54.9	Low	50 Å²	50	85.4 Å²	85.4	19%	0.189	42%	0.422	C	S	.	.	H	α-helix	trans	-64.9	-46.4	174	-156.7	-168.5	-57.7	135.9	18.3	110.7	A36 W41 N42 D43 N44 V50	A36-R46 HydrophobicContact CB-CG 3.76Å; A36-R46 PolarHBondContact O-NE 3.48Å; W41-R46 PolarHBondContact O-NH2 3.48Å; N42-R46 PolarHBondContact O-N 3.47Å; D43-R46 WeakPolarHBondContact O-CA 3.47Å; D43-R46 VanDerWaalsContact O-CB 3.27Å; D43-R46 WeakPolarHBondContact O-CB 3.19Å; D43-R46 PolarHBondContact O-N 2.76Å; D43-R46 VanDerWaalsContact O-N 3.13Å; D43-R46 IonicContact OD1-CZ 2.77Å; D43-R46 IonicContact OD1-NH1 3.2Å; D43-R46 PolarHBondContact OD1-NH1 3.16Å; D43-R46 IonicContact OD1-NH2 2.73Å; D43-R46 PolarHBondContact OD1-NH2 3.15Å; N44-R46 VanDerWaalsContact C-N 3.29Å; N44-R46 PolarHBondContact O-N 3.3Å; R46-V50 WeakPolarHBondContact O-CB 3.01Å; R46-V50 VanDerWaalsContact O-CG2 3.26Å; R46-V50 WeakPolarHBondContact O-CG2 3.46Å; R46-V50 PolarHBondContact O-N 2.99Å
47	E	57.7	Low	54.9	Low	142 Å²	142	86.6 Å²	86.6	66%	0.664	43%	0.427	S	S	*	.	H	α-helix	trans	-65.7	-46.3	177.2	-71.8	-164.8	145.3	0	0	112.7	D43 N44 H49 V50 H51	D43-E47 PolarHBondContact O-N 3.32Å; N44-E47 PolarHBondContact O-N 2.89Å; E47-H49 VanDerWaalsContact C-N 3.34Å; E47-H49 PolarHBondContact O-N 2.76Å; E47-V50 PolarHBondContact O-N 2.72Å; E47-H51 WeakPolarHBondContact O-CB 3.4Å; E47-H51 PolarHBondContact O-N 3.18Å
48	E	54.4	Low	54.7	Low	139 Å²	139	86.1 Å²	86.1	65%	0.65	43%	0.425	S	S	*	.	H	α-helix	trans	-56.1	-46.7	176.1	-84.5	-170.7	142.9	0	0	112	N44 H51 F52	N44-E48 PolarHBondContact O-N 2.94Å; E48-H51 PolarHBondContact O-N 3.42Å; E48-F52 WeakPolarHBondContact O-CB 3.05Å; E48-F52 PolarHBondContact O-N 2.68Å
49	H	52.3	Low	54.7	Low	75 Å²	75	82.6 Å²	82.6	35%	0.347	42%	0.415	S	S	.	.	H	α-helix	trans	-65.8	-47.2	178.8	-82.1	64.2	0	0	0	111.3	W41 V45 E47 H51 F52 I53	W41-H49 AromaticContact CH2-CD2 3.96Å; W41-H49 AromaticContact CH2-CE1 3.66Å; W41-H49 AromaticContact CH2-CG 3.99Å; W41-H49 AromaticContact CH2-ND1 3.81Å; W41-H49 AromaticContact CH2-NE2 3.75Å; W41-H49 HydrophobicContact CZ3-CB 4.17Å; W41-H49 AromaticContact CZ3-CE1 3.86Å; W41-H49 AromaticContact CZ3-CG 3.64Å; W41-H49 AromaticContact CZ3-ND1 3.5Å; V45-H49 PolarHBondContact O-N 3.49Å; V45-H49 VanDerWaalsContact O-N 3.15Å; V45-H49 PolarHBondContact O-ND1 3.27Å; V45-H49 VanDerWaalsContact O-ND1 3.16Å; E47-H49 VanDerWaalsContact C-N 3.34Å; E47-H49 PolarHBondContact O-N 2.76Å; H49-H51 PolarHBondContact O-N 2.94Å; H49-F52 PolarHBondContact O-N 2.83Å; H49-I53 HydrophobicContact CB-CD1 4.48Å; H49-I53 WeakPolarHBondContact O-CD1 3.48Å; H49-I53 WeakPolarHBondContact O-CG1 3.42Å; H49-I53 PolarHBondContact O-N 3.21Å
50	V	53.2	Low	54.6	Low	39 Å²	39	83.6 Å²	83.6	24%	0.236	42%	0.424	C	S	.	.	H	α-helix	trans	-58.6	-35.1	176.8	170.5	0	0	0	0	111.9	L32 R46 E47 K54	L32-V50 HydrophobicContact CD2-CG2 4.33Å; R46-V50 WeakPolarHBondContact O-CB 3.01Å; R46-V50 VanDerWaalsContact O-CG2 3.26Å; R46-V50 WeakPolarHBondContact O-CG2 3.46Å; R46-V50 PolarHBondContact O-N 2.99Å; E47-V50 PolarHBondContact O-N 2.72Å; V50-K54 WeakPolarHBondContact O-CG 3.25Å; V50-K54 PolarHBondContact O-N 3.2Å
51	H	59.4	Low	54.4	Low	107 Å²	107	79.3 Å²	79.3	50%	0.495	40%	0.401	S	S	.	.	H	α-helix	trans	-66.7	-54.8	174.2	-168.8	-79.2	0	0	0	112	E47 E48 H49 I53 K54 E55	E47-H51 WeakPolarHBondContact O-CB 3.4Å; E47-H51 PolarHBondContact O-N 3.18Å; E48-H51 PolarHBondContact O-N 3.42Å; H49-H51 PolarHBondContact O-N 2.94Å; H51-I53 PolarHBondContact O-N 3.05Å; H51-K54 WeakPolarHBondContact O-CB 3.24Å; H51-K54 PolarHBondContact O-N 3.34Å; H51-E55 IonicContact CE1-OE1 3.1Å; H51-E55 IonicContact CE1-OE2 3.13Å; H51-E55 PolarHBondContact CE1-OE2 3.1Å; H51-E55 IonicContact ND1-OE2 3.52Å; H51-E55 PolarHBondContact ND1-OE2 3.46Å; H51-E55 VanDerWaalsContact ND1-OE2 3.13Å; H51-E55 PolarHBondContact O-N 3.3Å
52	F	52.2	Low	54.6	Low	118 Å²	118	84.3 Å²	84.3	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-52.2	-41.6	178.6	171.8	-104.6	0	0	0	112	E48 H49 E55 E56	E48-F52 WeakPolarHBondContact O-CB 3.05Å; E48-F52 PolarHBondContact O-N 2.68Å; H49-F52 PolarHBondContact O-N 2.83Å; F52-E55 PolarHBondContact O-N 3.45Å; F52-E56 HydrophobicContact CD1-CG 4.39Å; F52-E56 HydrophobicContact CD2-CG 4.31Å; F52-E56 HydrophobicContact CE1-CG 3.83Å; F52-E56 HydrophobicContact CE2-CG 3.72Å; F52-E56 HydrophobicContact CZ-CG 3.45Å; F52-E56 VanDerWaalsContact CZ-CG 3.45Å; F52-E56 PolarHBondContact O-N 3.18Å
53	I	50.5	Low	54.5	Low	12 Å²	12	85.7 Å²	85.7	6%	0.062	43%	0.426	C	S	.	.	H	α-helix	trans	-68.5	-40	179.5	-61.3	153.3	0	0	0	111.6	L32 H49 H51 E55 I57 I100	L32-I53 HydrophobicContact CD2-CD1 3.58Å; L32-I53 HydrophobicContact CD2-CG2 4.23Å; H49-I53 HydrophobicContact CB-CD1 4.48Å; H49-I53 WeakPolarHBondContact O-CD1 3.48Å; H49-I53 WeakPolarHBondContact O-CG1 3.42Å; H49-I53 PolarHBondContact O-N 3.21Å; H51-I53 PolarHBondContact O-N 3.05Å; I53-E55 VanDerWaalsContact C-N 3.27Å; I53-E55 PolarHBondContact O-N 2.67Å; I53-I57 HydrophobicContact CG2-CD1 3.53Å; I53-I57 HydrophobicContact CG2-CG1 4.1Å; I53-I57 WeakPolarHBondContact O-CB 3.24Å; I53-I57 WeakPolarHBondContact O-CG1 3.41Å; I53-I57 PolarHBondContact O-N 3.48Å; I53-I100 HydrophobicContact CD1-CD1 3.1Å; I53-I100 HydrophobicContact CD1-CG1 3.75Å; I53-I100 HydrophobicContact CG1-CD1 3.61Å; I53-I100 HydrophobicContact CG1-CG1 4.36Å
54	K	54	Low	54.2	Low	121 Å²	121	83 Å²	83	53%	0.526	41%	0.411	S	S	.	.	H	α-helix	trans	-61.3	-39.4	173.5	-77.3	176.4	177.3	179.5	0	110.9	V50 H51 N58	V50-K54 WeakPolarHBondContact O-CG 3.25Å; V50-K54 PolarHBondContact O-N 3.2Å; H51-K54 WeakPolarHBondContact O-CB 3.24Å; H51-K54 PolarHBondContact O-N 3.34Å; K54-N58 WeakPolarHBondContact O-CB 3.39Å; K54-N58 PolarHBondContact O-N 3.21Å; K54-N58 PolarHBondContact O-ND2 3.27Å
55	E	59	Low	54.1	Low	110 Å²	110	84.3 Å²	84.3	51%	0.514	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-51.2	176	-70.2	-173.5	123.8	0	0	112.5	H51 F52 I53 I57 N58 S59	H51-E55 IonicContact CE1-OE1 3.1Å; H51-E55 IonicContact CE1-OE2 3.13Å; H51-E55 PolarHBondContact CE1-OE2 3.1Å; H51-E55 IonicContact ND1-OE2 3.52Å; H51-E55 PolarHBondContact ND1-OE2 3.46Å; H51-E55 VanDerWaalsContact ND1-OE2 3.13Å; H51-E55 PolarHBondContact O-N 3.3Å; F52-E55 PolarHBondContact O-N 3.45Å; I53-E55 VanDerWaalsContact C-N 3.27Å; I53-E55 PolarHBondContact O-N 2.67Å; E55-I57 VanDerWaalsContact C-N 3.35Å; E55-I57 PolarHBondContact O-N 2.7Å; E55-N58 PolarHBondContact O-N 2.73Å; E55-S59 VanDerWaalsContact O-CB 3.27Å; E55-S59 WeakPolarHBondContact O-CB 3.41Å; E55-S59 PolarHBondContact O-N 2.84Å
56	E	52.8	Low	54.5	Low	107 Å²	107	86.8 Å²	86.8	50%	0.5	42%	0.419	S	S	.	.	H	α-helix	trans	-58.2	-45	177.2	-79.3	-67.1	126.1	0	0	112.2	F52 S59 A60	F52-E56 HydrophobicContact CD1-CG 4.39Å; F52-E56 HydrophobicContact CD2-CG 4.31Å; F52-E56 HydrophobicContact CE1-CG 3.83Å; F52-E56 HydrophobicContact CE2-CG 3.72Å; F52-E56 HydrophobicContact CZ-CG 3.45Å; F52-E56 VanDerWaalsContact CZ-CG 3.45Å; F52-E56 PolarHBondContact O-N 3.18Å; E56-S59 PolarHBondContact O-N 3.16Å; E56-A60 WeakPolarHBondContact O-CB 3.49Å; E56-A60 PolarHBondContact O-N 3.37Å
57	I	51.7	Low	54.5	Low	30 Å²	30	89.7 Å²	89.7	15%	0.154	44%	0.435	C	S	.	.	H	α-helix	trans	-63.9	-44.6	177.4	-73.2	179.5	0	0	0	111.2	L25 I53 E55 S59 A61 I93	L25-I57 HydrophobicContact CD2-CG2 3.07Å; I53-I57 HydrophobicContact CG2-CD1 3.53Å; I53-I57 HydrophobicContact CG2-CG1 4.1Å; I53-I57 WeakPolarHBondContact O-CB 3.24Å; I53-I57 WeakPolarHBondContact O-CG1 3.41Å; I53-I57 PolarHBondContact O-N 3.48Å; E55-I57 VanDerWaalsContact C-N 3.35Å; E55-I57 PolarHBondContact O-N 2.7Å; I57-S59 VanDerWaalsContact C-N 3.33Å; I57-A61 VanDerWaalsContact O-CB 3.28Å; I57-A61 WeakPolarHBondContact O-CB 3.34Å; I57-A61 PolarHBondContact O-N 3.39Å; I57-I93 HydrophobicContact CD1-CG1 4.22Å; I57-I93 HydrophobicContact CD1-CG2 4Å; I57-I93 HydrophobicContact CG1-CG1 4.21Å; I57-I93 HydrophobicContact CG2-CG1 4.41Å
58	N	55.8	Low	54.1	Low	104 Å²	104	85.1 Å²	85.1	56%	0.556	41%	0.414	S	S	*	.	H	α-helix	trans	-67.5	-34.4	177.5	-74.4	-25.5	0	0	0	112	K54 E55 K62	K54-N58 WeakPolarHBondContact O-CB 3.39Å; K54-N58 PolarHBondContact O-N 3.21Å; K54-N58 PolarHBondContact O-ND2 3.27Å; E55-N58 PolarHBondContact O-N 2.73Å; N58-K62 VanDerWaalsContact O-CB 3.31Å; N58-K62 WeakPolarHBondContact O-CB 3.35Å; N58-K62 PolarHBondContact O-N 2.92Å
59	S	57.4	Low	54	Low	62 Å²	62	81.9 Å²	81.9	43%	0.434	40%	0.404	S	S	.	.	H	α-helix	trans	-65.1	-51.9	175.3	-169	0	0	0	0	110.8	E55 E56 I57 A61 K62 E63	E55-S59 VanDerWaalsContact O-CB 3.27Å; E55-S59 WeakPolarHBondContact O-CB 3.41Å; E55-S59 PolarHBondContact O-N 2.84Å; E56-S59 PolarHBondContact O-N 3.16Å; I57-S59 VanDerWaalsContact C-N 3.33Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.07Å; S59-K62 WeakPolarHBondContact O-CA 3.5Å; S59-K62 WeakPolarHBondContact O-CB 3.38Å; S59-K62 PolarHBondContact O-N 2.8Å; S59-E63 PolarHBondContact O-N 2.95Å
60	A	50.8	Low	54	Low	32 Å²	32	82.5 Å²	82.5	26%	0.264	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-40.5	176.7	0	0	0	0	0	112.5	E56 K62 Q64	E56-A60 WeakPolarHBondContact O-CB 3.49Å; E56-A60 PolarHBondContact O-N 3.37Å; A60-K62 VanDerWaalsContact C-N 3.3Å; A60-K62 PolarHBondContact O-N 3.43Å; A60-Q64 WeakPolarHBondContact O-CB 3.15Å; A60-Q64 PolarHBondContact O-N 2.8Å
61	A	52.2	Low	53.6	Low	27 Å²	27	83.9 Å²	83.9	22%	0.223	42%	0.415	C	S	.	.	H	α-helix	trans	-64.8	-33.2	174.3	0	0	0	0	0	112.6	I57 S59 K65 L89	I57-A61 VanDerWaalsContact O-CB 3.28Å; I57-A61 WeakPolarHBondContact O-CB 3.34Å; I57-A61 PolarHBondContact O-N 3.39Å; S59-A61 VanDerWaalsContact C-N 3.34Å; S59-A61 PolarHBondContact O-N 3.07Å; A61-K65 WeakPolarHBondContact O-CB 3.48Å; A61-K65 PolarHBondContact O-N 3.41Å; A61-K65 VanDerWaalsContact O-N 3.08Å; A61-L89 HydrophobicContact CB-CD1 4.44Å
62	K	59.1	Low	52.7	Low	132 Å²	132	82.4 Å²	82.4	57%	0.574	42%	0.416	S	S	*	.	H	α-helix	trans	-72.4	-48.6	175.6	-174.6	-172.9	169.3	-164	0	111.8	N58 S59 A60 Q64 K65 E66	N58-K62 VanDerWaalsContact O-CB 3.31Å; N58-K62 WeakPolarHBondContact O-CB 3.35Å; N58-K62 PolarHBondContact O-N 2.92Å; S59-K62 WeakPolarHBondContact O-CA 3.5Å; S59-K62 WeakPolarHBondContact O-CB 3.38Å; S59-K62 PolarHBondContact O-N 2.8Å; A60-K62 VanDerWaalsContact C-N 3.3Å; A60-K62 PolarHBondContact O-N 3.43Å; K62-Q64 VanDerWaalsContact C-N 3.32Å; K62-Q64 PolarHBondContact O-N 2.91Å; K62-K65 WeakPolarHBondContact O-CB 3.43Å; K62-K65 PolarHBondContact O-N 3.47Å; K62-K65 VanDerWaalsContact O-N 3.15Å; K62-E66 WeakPolarHBondContact CE-OE1 3.45Å; K62-E66 IonicContact NZ-OE1 3.89Å; K62-E66 PolarHBondContact O-N 3.16Å
63	E	56.4	Low	52.2	Low	138 Å²	138	82.8 Å²	82.8	65%	0.645	42%	0.423	S	S	*	.	H	α-helix	trans	-56.9	-45.8	175.8	-77	-168.3	143.9	0	0	111.2	S59 K65 E66 E67	S59-E63 PolarHBondContact O-N 2.95Å; E63-K65 PolarHBondContact O-N 3.23Å; E63-E66 PolarHBondContact O-N 3.39Å; E63-E67 PolarHBondContact O-N 3.47Å
64	Q	51.4	Low	51.8	Low	36 Å²	36	89.4 Å²	89.4	17%	0.168	45%	0.454	C	S	.	.	H	α-helix	trans	-65.8	-34.8	176.8	-75.2	-161.7	-13.6	0	0	113.2	A60 K62 E66 E67 I68 I85 L89	A60-Q64 WeakPolarHBondContact O-CB 3.15Å; A60-Q64 PolarHBondContact O-N 2.8Å; K62-Q64 VanDerWaalsContact C-N 3.32Å; K62-Q64 PolarHBondContact O-N 2.91Å; Q64-E66 VanDerWaalsContact C-N 3.32Å; Q64-E66 PolarHBondContact O-N 3.28Å; Q64-E67 PolarHBondContact O-N 3.02Å; Q64-I68 WeakPolarHBondContact O-CB 3.18Å; Q64-I68 WeakPolarHBondContact O-CD1 3.17Å; Q64-I68 WeakPolarHBondContact O-CG1 3.33Å; Q64-I68 PolarHBondContact O-N 3.46Å; Q64-I85 HydrophobicContact CG-CG2 4.47Å; Q64-I85 VanDerWaalsContact OE1-CG2 3.29Å; Q64-L89 VanDerWaalsContact OE1-CD1 3.23Å
65	K	53.8	Low	50.7	Low	138 Å²	138	86.2 Å²	86.2	60%	0.6	46%	0.455	S	S	*	.	H	α-helix	trans	-62.2	-42.1	173.1	-175.8	178.3	-179.9	178.9	0	111.2	A61 K62 E63 V69	A61-K65 WeakPolarHBondContact O-CB 3.48Å; A61-K65 PolarHBondContact O-N 3.41Å; A61-K65 VanDerWaalsContact O-N 3.08Å; K62-K65 WeakPolarHBondContact O-CB 3.43Å; K62-K65 PolarHBondContact O-N 3.47Å; K62-K65 VanDerWaalsContact O-N 3.15Å; E63-K65 PolarHBondContact O-N 3.23Å; K65-V69 WeakPolarHBondContact O-CB 3.44Å; K65-V69 VanDerWaalsContact O-CG2 3.24Å; K65-V69 WeakPolarHBondContact O-CG2 3.38Å; K65-V69 PolarHBondContact O-N 3.33Å
66	E	58.4	Low	49.6	Very low	103 Å²	103	83.9 Å²	83.9	48%	0.481	46%	0.455	S	S	.	.	H	α-helix	trans	-67.1	-38.6	176	-69.3	177	-168.6	0	0	111.6	K62 E63 Q64 V69 N70	K62-E66 WeakPolarHBondContact CE-OE1 3.45Å; K62-E66 IonicContact NZ-OE1 3.89Å; K62-E66 PolarHBondContact O-N 3.16Å; E63-E66 PolarHBondContact O-N 3.39Å; Q64-E66 VanDerWaalsContact C-N 3.32Å; Q64-E66 PolarHBondContact O-N 3.28Å; E66-V69 PolarHBondContact O-N 3.03Å; E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 VanDerWaalsContact O-CG 3.27Å; E66-N70 PolarHBondContact O-N 3.41Å; E66-N70 PolarHBondContact O-ND2 3.18Å; E66-N70 VanDerWaalsContact O-ND2 3.13Å
67	E	52.8	Low	48.4	Very low	112 Å²	112	88.1 Å²	88.1	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-47	174.8	-166.9	174	-151.6	0	0	112.2	E63 Q64 V69 N70 M71	E63-E67 PolarHBondContact O-N 3.47Å; Q64-E67 PolarHBondContact O-N 3.02Å; E67-V69 VanDerWaalsContact C-N 3.33Å; E67-V69 PolarHBondContact O-N 3.02Å; E67-N70 PolarHBondContact O-N 3.5Å; E67-M71 HydrophobicContact CG-SD 4.43Å; E67-M71 WeakPolarHBondContact O-CB 3.33Å; E67-M71 VanDerWaalsContact O-CG 3.29Å; E67-M71 WeakPolarHBondContact O-CG 3.41Å; E67-M71 PolarHBondContact O-N 2.78Å
68	I	49	Very low	47.1	Very low	45 Å²	45	95.2 Å²	95.2	23%	0.231	50%	0.501	C	S	.	.	H	α-helix	trans	-57.8	-45	174.7	-69.1	163.7	0	0	0	110.8	Q64 M71 S72 I85	Q64-I68 WeakPolarHBondContact O-CB 3.18Å; Q64-I68 WeakPolarHBondContact O-CD1 3.17Å; Q64-I68 WeakPolarHBondContact O-CG1 3.33Å; Q64-I68 PolarHBondContact O-N 3.46Å; I68-M71 PolarHBondContact O-N 3.26Å; I68-S72 WeakPolarHBondContact O-CB 3.13Å; I68-S72 PolarHBondContact O-N 3.15Å; I68-S72 PolarHBondContact O-OG 3.39Å; I68-I85 HydrophobicContact CD1-CD1 4.49Å; I68-I85 HydrophobicContact CD1-CG2 4.11Å; I68-I85 HydrophobicContact CG1-CD1 3.85Å; I68-I85 HydrophobicContact CG1-CG2 4.4Å
69	V	52.6	Low	46.3	Very low	72 Å²	72	95.7 Å²	95.7	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-44.8	178.1	167.5	0	0	0	0	110.8	K65 E66 E67 S72 L73	K65-V69 WeakPolarHBondContact O-CB 3.44Å; K65-V69 VanDerWaalsContact O-CG2 3.24Å; K65-V69 WeakPolarHBondContact O-CG2 3.38Å; K65-V69 PolarHBondContact O-N 3.33Å; E66-V69 PolarHBondContact O-N 3.03Å; E67-V69 VanDerWaalsContact C-N 3.33Å; E67-V69 PolarHBondContact O-N 3.02Å; V69-S72 WeakPolarHBondContact O-CB 3.43Å; V69-S72 PolarHBondContact O-N 3.05Å; V69-L73 HydrophobicContact CG1-CD1 3.81Å; V69-L73 HydrophobicContact CG1-CG 4.48Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.21Å; V69-L73 PolarHBondContact O-N 2.95Å
70	N	51.7	Low	45.3	Very low	88 Å²	88	95.2 Å²	95.2	47%	0.471	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-43.1	177.3	-77	-33.9	0	0	0	112.4	E66 E67 S72 L73 H74	E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 VanDerWaalsContact O-CG 3.27Å; E66-N70 PolarHBondContact O-N 3.41Å; E66-N70 PolarHBondContact O-ND2 3.18Å; E66-N70 VanDerWaalsContact O-ND2 3.13Å; E67-N70 PolarHBondContact O-N 3.5Å; N70-S72 VanDerWaalsContact C-N 3.32Å; N70-S72 PolarHBondContact O-N 2.97Å; N70-L73 PolarHBondContact O-N 3.18Å; N70-H74 PolarHBondContact O-N 2.94Å; N70-H74 VanDerWaalsContact O-N 3.09Å; N70-H74 PolarHBondContact O-ND1 3.31Å
71	M	44.2	Very low	44.9	Very low	68 Å²	68	96.4 Å²	96.4	34%	0.335	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-39.5	174.6	-71.3	-174.6	69.3	0	0	112.3	E67 I68 H74 P80	E67-M71 HydrophobicContact CG-SD 4.43Å; E67-M71 WeakPolarHBondContact O-CB 3.33Å; E67-M71 VanDerWaalsContact O-CG 3.29Å; E67-M71 WeakPolarHBondContact O-CG 3.41Å; E67-M71 PolarHBondContact O-N 2.78Å; I68-M71 PolarHBondContact O-N 3.26Å; M71-H74 PolarHBondContact O-N 2.92Å; M71-P80 HydrophobicContact CE-CG 3.53Å
72	S	40.5	Very low	44.5	Very low	76 Å²	76	98.1 Å²	98.1	53%	0.531	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.3	-57.4	0	0	0	0	111.9	I68 V69 N70	I68-S72 WeakPolarHBondContact O-CB 3.13Å; I68-S72 PolarHBondContact O-N 3.15Å; I68-S72 PolarHBondContact O-OG 3.39Å; V69-S72 WeakPolarHBondContact O-CB 3.43Å; V69-S72 PolarHBondContact O-N 3.05Å; N70-S72 VanDerWaalsContact C-N 3.32Å; N70-S72 PolarHBondContact O-N 2.97Å
73	L	42.3	Very low	43.8	Very low	126 Å²	126	95.1 Å²	95.1	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-70.6	-30.6	179	-73.9	165.2	0	0	0	113.5	V69 N70 G75	V69-L73 HydrophobicContact CG1-CD1 3.81Å; V69-L73 HydrophobicContact CG1-CG 4.48Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.21Å; V69-L73 PolarHBondContact O-N 2.95Å; N70-L73 PolarHBondContact O-N 3.18Å; L73-G75 VanDerWaalsContact C-N 3.34Å; L73-G75 PolarHBondContact O-N 3.05Å
74	H	41.8	Very low	43.2	Very low	151 Å²	151	92.5 Å²	92.5	70%	0.699	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	8.6	-173.4	-75.2	62.4	0	0	0	114.4	N70 M71 A76	N70-H74 PolarHBondContact O-N 2.94Å; N70-H74 VanDerWaalsContact O-N 3.09Å; N70-H74 PolarHBondContact O-ND1 3.31Å; M71-H74 PolarHBondContact O-N 2.92Å; H74-A76 PolarHBondContact O-N 3.13Å; H74-A76 VanDerWaalsContact O-N 3.1Å
75	G	31.7	Very low	43	Very low	54 Å²	54	92 Å²	92	56%	0.557	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	16	173.1	0	0	0	0	0	114.9	L73 W77	L73-G75 VanDerWaalsContact C-N 3.34Å; L73-G75 PolarHBondContact O-N 3.05Å; G75-W77 PolarHBondContact O-N 3.24Å
76	A	34.2	Very low	42.8	Very low	61 Å²	61	86.5 Å²	86.5	50%	0.504	47%	0.467	S	S	.	.			trans	-75.6	54.6	-177.9	0	0	0	0	0	112.5	H74 M78	H74-A76 PolarHBondContact O-N 3.13Å; H74-A76 VanDerWaalsContact O-N 3.1Å; A76-M78 PolarHBondContact O-N 2.81Å
77	W	28.1	Very low	42.3	Very low	196 Å²	196	81.8 Å²	81.8	74%	0.742	45%	0.446	S	S	*	.			trans	-76.1	64.3	177.9	-81	83.3	0	0	0	112.3	G75	G75-W77 PolarHBondContact O-N 3.24Å
78	M	25.8	Very low	42.1	Very low	179 Å²	179	77.8 Å²	77.8	88%	0.882	43%	0.43	S	S	*	.	S	Bend	trans	-126.9	73.4	149.2	-78.9	-158.5	174.8	0	0	109	A76 P80	A76-M78 PolarHBondContact O-N 2.81Å; M78-P80 WeakPolarHBondContact O-CD 3.45Å
79	N	37.2	Very low	42.3	Very low	114 Å²	114	75.9 Å²	75.9	61%	0.61	42%	0.42	S	S	*	.			trans	0.4	87.7	164.9	-65	-34.8	0	0	0	114.9	P81	N79-P81 VanDerWaalsContact O-CD 3.31Å; N79-P81 WeakPolarHBondContact O-CD 3.28Å
80	P	36.3	Very low	42.2	Very low	51 Å²	51	73 Å²	73	33%	0.331	40%	0.402	S	S	.	.			trans	-59.9	113.9	135.4	27.9	-24.3	0	0	0	103.8	M71 M78 L82	M71-P80 HydrophobicContact CE-CG 3.53Å; M78-P80 WeakPolarHBondContact O-CD 3.45Å; P80-L82 PolarHBondContact O-N 3.41Å
81	P	43.4	Very low	42.3	Very low	58 Å²	58	68.9 Å²	68.9	38%	0.377	38%	0.38	S	S	.	.			trans	-59.7	133.4	-175.9	26.8	-33.9	0	0	0	106.7	N79 S83 K84	N79-P81 VanDerWaalsContact O-CD 3.31Å; N79-P81 WeakPolarHBondContact O-CD 3.28Å; P81-S83 WeakPolarHBondContact CB-OG 3.44Å; P81-S83 PolarHBondContact O-N 2.88Å; P81-K84 HydrophobicContact CG-CG 4.27Å; P81-K84 WeakPolarHBondContact O-CB 3.26Å; P81-K84 PolarHBondContact O-N 3.46Å
82	L	42.9	Very low	42.7	Very low	62 Å²	62	69.4 Å²	69.4	33%	0.325	39%	0.387	S	S	.	.	H	α-helix	trans	-56.7	-20.2	-176.6	-82	99.7	0	0	0	112.3	L13 P80 K84 I85 T86	L13-L82 HydrophobicContact CD2-CD1 3.82Å; L13-L82 HydrophobicContact CD2-CD2 3.68Å; L13-L82 HydrophobicContact CD2-CG 4.43Å; P80-L82 PolarHBondContact O-N 3.41Å; L82-K84 PolarHBondContact O-N 3.48Å; L82-K84 VanDerWaalsContact O-N 3.13Å; L82-I85 PolarHBondContact O-N 3.36Å; L82-T86 PolarHBondContact O-N 3.17Å; L82-T86 PolarHBondContact O-OG1 2.91Å; L82-T86 VanDerWaalsContact O-OG1 3.14Å
83	S	45.4	Very low	43.4	Very low	70 Å²	70	66 Å²	66	49%	0.49	36%	0.363	S	S	.	.	H	α-helix	trans	-48.1	-32.9	165.5	65.2	0	0	0	0	114	P81 A87	P81-S83 WeakPolarHBondContact CB-OG 3.44Å; P81-S83 PolarHBondContact O-N 2.88Å; S83-A87 WeakPolarHBondContact O-CA 3.5Å; S83-A87 WeakPolarHBondContact O-CB 3.29Å; S83-A87 PolarHBondContact O-N 2.93Å
84	K	43.6	Very low	43.9	Very low	82 Å²	82	60 Å²	60	36%	0.357	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-49.6	171.9	-75.4	-165.4	-178	-168.8	0	112.3	P81 L82 A87 C88 L150	P81-K84 HydrophobicContact CG-CG 4.27Å; P81-K84 WeakPolarHBondContact O-CB 3.26Å; P81-K84 PolarHBondContact O-N 3.46Å; L82-K84 PolarHBondContact O-N 3.48Å; L82-K84 VanDerWaalsContact O-N 3.13Å; K84-A87 PolarHBondContact O-N 3.11Å; K84-C88 WeakPolarHBondContact O-CB 3.37Å; K84-C88 PolarHBondContact O-N 3.23Å; K84-C88 PolarHBondContact O-SG 2.04Å; K84-L150 HydrophobicContact CD-CD2 4.32Å; K84-L150 HydrophobicContact CG-CD1 4.26Å
85	I	48.1	Very low	44.4	Very low	26 Å²	26	54.6 Å²	54.6	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-47.7	-176.8	-56.5	178.3	0	0	0	109.1	Q64 I68 L82 A87 C88 L89	Q64-I85 HydrophobicContact CG-CG2 4.47Å; Q64-I85 VanDerWaalsContact OE1-CG2 3.29Å; I68-I85 HydrophobicContact CD1-CD1 4.49Å; I68-I85 HydrophobicContact CD1-CG2 4.11Å; I68-I85 HydrophobicContact CG1-CD1 3.85Å; I68-I85 HydrophobicContact CG1-CG2 4.4Å; L82-I85 PolarHBondContact O-N 3.36Å; I85-A87 PolarHBondContact O-N 3.46Å; I85-C88 PolarHBondContact O-N 2.98Å; I85-L89 PolarHBondContact O-N 2.84Å
86	T	49.5	Very low	45.4	Very low	22 Å²	22	53.7 Å²	53.7	14%	0.135	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-44.4	173.3	-49.5	0	0	0	0	111.9	I20 H21 I24 L82 C88 L89 I90	I20-T86 HydrophobicContact CG2-CG2 4.32Å; H21-T86 PolarHBondContact CE1-OG1 3.32Å; I24-T86 HydrophobicContact CD1-CG2 4.27Å; L82-T86 PolarHBondContact O-N 3.17Å; L82-T86 PolarHBondContact O-OG1 2.91Å; L82-T86 VanDerWaalsContact O-OG1 3.14Å; T86-C88 VanDerWaalsContact C-N 3.29Å; T86-C88 PolarHBondContact O-N 2.92Å; T86-L89 PolarHBondContact O-N 3.13Å; T86-I90 HydrophobicContact CG2-CD1 4.09Å; T86-I90 WeakPolarHBondContact O-CD1 3.31Å; T86-I90 WeakPolarHBondContact O-CG1 3.27Å; T86-I90 PolarHBondContact O-N 2.92Å
87	A	46.5	Very low	46.3	Very low	4 Å²	4	50.9 Å²	50.9	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-40.5	173.7	0	0	0	0	0	111.7	S83 K84 I85 I90 V91 N147	S83-A87 WeakPolarHBondContact O-CA 3.5Å; S83-A87 WeakPolarHBondContact O-CB 3.29Å; S83-A87 PolarHBondContact O-N 2.93Å; K84-A87 PolarHBondContact O-N 3.11Å; I85-A87 PolarHBondContact O-N 3.46Å; A87-I90 PolarHBondContact O-N 2.83Å; A87-V91 WeakPolarHBondContact O-CB 3.36Å; A87-V91 WeakPolarHBondContact O-CG2 3.49Å; A87-V91 PolarHBondContact O-N 2.95Å; A87-N147 HydrophobicContact CB-CB 3.83Å; A87-N147 WeakPolarHBondContact CB-OD1 3.41Å
88	C	50	Low	47.3	Very low	28 Å²	28	41.6 Å²	41.6	19%	0.189	24%	0.237	C	C	.	.	H	α-helix	trans	-71.3	-34.4	-178.8	-62.8	0	0	0	0	111.9	K84 I85 T86 V91 T92 C151	K84-C88 WeakPolarHBondContact O-CB 3.37Å; K84-C88 PolarHBondContact O-N 3.23Å; K84-C88 PolarHBondContact O-SG 2.04Å; I85-C88 PolarHBondContact O-N 2.98Å; T86-C88 VanDerWaalsContact C-N 3.29Å; T86-C88 PolarHBondContact O-N 2.92Å; C88-V91 PolarHBondContact O-N 3.36Å; C88-T92 VanDerWaalsContact O-CB 3.32Å; C88-T92 WeakPolarHBondContact O-CB 3.07Å; C88-T92 PolarHBondContact O-N 2.93Å; C88-T92 PolarHBondContact O-OG1 3Å; C88-C151 WeakPolarHBondContact CA-SG 3.34Å; C88-C151 HydrophobicContact CB-CB 3.67Å; C88-C151 WeakPolarHBondContact CB-SG 3.39Å; C88-C151 PolarHBondContact N-SG 3.46Å; C88-C151 WeakPolarHBondContact SG-CA 3.38Å; C88-C151 WeakPolarHBondContact SG-CB 3.39Å; C88-C151 CovalentContact SG-SG 2.04Å; C88-C151 PolarHBondContact SG-SG 3.4Å
89	L	52.8	Low	48.5	Very low	6 Å²	6	36.9 Å²	36.9	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-47.6	169.5	-155.5	100.1	0	0	0	110.9	A61 Q64 I85 T86 V91 T92 I93	A61-L89 HydrophobicContact CB-CD1 4.44Å; Q64-L89 VanDerWaalsContact OE1-CD1 3.23Å; I85-L89 PolarHBondContact O-N 2.84Å; T86-L89 PolarHBondContact O-N 3.13Å; L89-V91 PolarHBondContact O-N 3.35Å; L89-T92 PolarHBondContact O-N 3.48Å; L89-I93 HydrophobicContact CD2-CD1 3.69Å; L89-I93 HydrophobicContact CG-CD1 3.83Å; L89-I93 WeakPolarHBondContact O-CB 3.36Å; L89-I93 WeakPolarHBondContact O-CD1 3.42Å; L89-I93 WeakPolarHBondContact O-CG1 3.5Å; L89-I93 PolarHBondContact O-N 3.03Å
90	I	51.2	Low	49.2	Very low	11 Å²	11	32.6 Å²	32.6	6%	0.056	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-44.9	176.5	-60.8	158.1	0	0	0	110.9	I24 T86 A87 S94 I141 L143	I24-I90 HydrophobicContact CD1-CD1 3.91Å; I24-I90 HydrophobicContact CD1-CG1 3.79Å; I24-I90 HydrophobicContact CG2-CG1 4.03Å; T86-I90 HydrophobicContact CG2-CD1 4.09Å; T86-I90 WeakPolarHBondContact O-CD1 3.31Å; T86-I90 WeakPolarHBondContact O-CG1 3.27Å; T86-I90 PolarHBondContact O-N 2.92Å; A87-I90 PolarHBondContact O-N 2.83Å; I90-S94 WeakPolarHBondContact O-CB 2.97Å; I90-S94 PolarHBondContact O-N 3.38Å; I90-S94 PolarHBondContact O-OG 3.18Å; I90-I141 HydrophobicContact CD1-CB 4.45Å; I90-I141 HydrophobicContact CD1-CD1 3.75Å; I90-I141 HydrophobicContact CD1-CG2 4.42Å; I90-I141 HydrophobicContact CG1-CD1 4.41Å; I90-I141 HydrophobicContact CG2-CB 4.32Å; I90-L143 HydrophobicContact CB-CD1 4.48Å; I90-L143 HydrophobicContact CB-CD2 4.3Å; I90-L143 HydrophobicContact CG2-CD1 3.75Å; I90-L143 HydrophobicContact CG2-CD2 3.98Å; I90-L143 HydrophobicContact CG2-CG 3.76Å
91	V	52.2	Low	49.9	Very low	2 Å²	2	30.6 Å²	30.6	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-47.8	178.9	168.5	0	0	0	0	110.8	A87 C88 L89 S94 L95 L143 Y148 C151	A87-V91 WeakPolarHBondContact O-CB 3.36Å; A87-V91 WeakPolarHBondContact O-CG2 3.49Å; A87-V91 PolarHBondContact O-N 2.95Å; C88-V91 PolarHBondContact O-N 3.36Å; L89-V91 PolarHBondContact O-N 3.35Å; V91-S94 PolarHBondContact O-N 2.89Å; V91-L95 HydrophobicContact CG1-CD1 3.66Å; V91-L95 HydrophobicContact CG1-CG 4.43Å; V91-L95 WeakPolarHBondContact O-CB 3.45Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 3.44Å; V91-L143 HydrophobicContact CB-CD1 4.17Å; V91-L143 HydrophobicContact CG2-CD1 3.5Å; V91-L143 HydrophobicContact CG2-CD2 3.54Å; V91-L143 HydrophobicContact CG2-CG 4.14Å; V91-Y148 HydrophobicContact CG1-CD2 4.23Å; V91-C151 HydrophobicContact CB-CB 4Å; V91-C151 HydrophobicContact CG1-CB 4.03Å; V91-C151 HydrophobicContact CG2-CB 4.02Å
92	T	53.8	Low	50.1	Low	78 Å²	78	28 Å²	28	48%	0.479	16%	0.158	S	C	.	.	H	α-helix	trans	-65.8	-45.4	-179.8	-61.1	0	0	0	0	111.8	C88 L89 L95 A96	C88-T92 VanDerWaalsContact O-CB 3.32Å; C88-T92 WeakPolarHBondContact O-CB 3.07Å; C88-T92 PolarHBondContact O-N 2.93Å; C88-T92 PolarHBondContact O-OG1 3Å; L89-T92 PolarHBondContact O-N 3.48Å; T92-L95 PolarHBondContact O-N 3.25Å; T92-A96 WeakPolarHBondContact O-CB 3.37Å; T92-A96 PolarHBondContact O-N 3.29Å
93	I	54.5	Low	50.2	Low	6 Å²	6	25.5 Å²	25.5	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-47.6	176.7	-65.4	161.8	0	0	0	110.4	I24 L25 N28 I57 L89 L95 A96 Q97	I24-I93 HydrophobicContact CG2-CD1 4.36Å; L25-I93 HydrophobicContact CD2-CD1 3.59Å; L25-I93 HydrophobicContact CD2-CG1 4.48Å; L25-I93 HydrophobicContact CG-CD1 4.33Å; N28-I93 HydrophobicContact CB-CG2 3.63Å; N28-I93 WeakPolarHBondContact ND2-CG2 3.06Å; I57-I93 HydrophobicContact CD1-CG1 4.22Å; I57-I93 HydrophobicContact CD1-CG2 4Å; I57-I93 HydrophobicContact CG1-CG1 4.21Å; I57-I93 HydrophobicContact CG2-CG1 4.41Å; L89-I93 HydrophobicContact CD2-CD1 3.69Å; L89-I93 HydrophobicContact CG-CD1 3.83Å; L89-I93 WeakPolarHBondContact O-CB 3.36Å; L89-I93 WeakPolarHBondContact O-CD1 3.42Å; L89-I93 WeakPolarHBondContact O-CG1 3.5Å; L89-I93 PolarHBondContact O-N 3.03Å; I93-L95 VanDerWaalsContact C-N 3.35Å; I93-L95 PolarHBondContact O-N 3.26Å; I93-A96 PolarHBondContact O-N 3.27Å; I93-Q97 HydrophobicContact CG2-CG 4.46Å; I93-Q97 WeakPolarHBondContact O-CB 3.38Å; I93-Q97 VanDerWaalsContact O-CG 3.28Å; I93-Q97 WeakPolarHBondContact O-CG 3.2Å; I93-Q97 PolarHBondContact O-N 2.86Å; I93-Q97 PolarHBondContact O-OE1 3.27Å
94	S	52.1	Low	50.2	Low	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70.3	-31	-178.3	-49.3	0	0	0	0	112.6	I90 V91 A98	I90-S94 WeakPolarHBondContact O-CB 2.97Å; I90-S94 PolarHBondContact O-N 3.38Å; I90-S94 PolarHBondContact O-OG 3.18Å; V91-S94 PolarHBondContact O-N 2.89Å; S94-A98 VanDerWaalsContact O-CB 3.24Å; S94-A98 WeakPolarHBondContact O-CB 3.41Å; S94-A98 PolarHBondContact O-N 2.71Å
95	L	53.2	Low	50.2	Low	36 Å²	36	23.3 Å²	23.3	19%	0.188	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-52.6	168.5	-91.8	162.9	0	0	0	111	V91 T92 I93 Q97 A98 Y99 I131 I135	V91-L95 HydrophobicContact CG1-CD1 3.66Å; V91-L95 HydrophobicContact CG1-CG 4.43Å; V91-L95 WeakPolarHBondContact O-CB 3.45Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 3.44Å; T92-L95 PolarHBondContact O-N 3.25Å; I93-L95 VanDerWaalsContact C-N 3.35Å; I93-L95 PolarHBondContact O-N 3.26Å; L95-Q97 PolarHBondContact O-N 2.96Å; L95-A98 WeakPolarHBondContact O-CA 3.42Å; L95-A98 WeakPolarHBondContact O-CB 3.18Å; L95-A98 PolarHBondContact O-N 3.02Å; L95-Y99 HydrophobicContact CD2-CE2 4.21Å; L95-Y99 VanDerWaalsContact O-CD2 3.25Å; L95-Y99 WeakPolarHBondContact O-CD2 3.09Å; L95-Y99 PolarHBondContact O-N 2.89Å; L95-I131 HydrophobicContact CD2-CD1 3.97Å; L95-I131 HydrophobicContact CD2-CG1 4.4Å; L95-I131 HydrophobicContact CD2-CG2 3.45Å; L95-I131 VanDerWaalsContact CD2-CG2 3.45Å; L95-I131 HydrophobicContact CG-CG2 4.33Å; L95-I135 HydrophobicContact CG-CD1 4.21Å
96	A	52.4	Low	49.8	Very low	35 Å²	35	23.5 Å²	23.5	29%	0.289	13%	0.131	S	C	.	.	H	α-helix	trans	-56	-53.4	179.8	0	0	0	0	0	110.1	T92 I93 A98 Y99 I100	T92-A96 WeakPolarHBondContact O-CB 3.37Å; T92-A96 PolarHBondContact O-N 3.29Å; I93-A96 PolarHBondContact O-N 3.27Å; A96-A98 PolarHBondContact O-N 3.34Å; A96-Y99 WeakPolarHBondContact O-CB 3.03Å; A96-Y99 PolarHBondContact O-N 2.97Å; A96-I100 WeakPolarHBondContact O-CD1 3.39Å; A96-I100 WeakPolarHBondContact O-CG1 3.43Å; A96-I100 PolarHBondContact O-N 3.42Å; A96-I100 VanDerWaalsContact O-N 3.11Å
97	Q	52.8	Low	49.4	Very low	2 Å²	2	27.8 Å²	27.8	1%	0.009	15%	0.149	C	C	.	.	H	α-helix	trans	-49.8	-43.2	171.9	-72.5	174.7	-56.8	0	0	113	N28 L32 I93 L95 I100 V101 I138	N28-Q97 VanDerWaalsContact C-NE2 3.3Å; N28-Q97 PolarHBondContact O-NE2 2.82Å; N28-Q97 PolarHBondContact OD1-NE2 3.42Å; N28-Q97 PolarHBondContact OD1-OE1 2.78Å; L32-Q97 HydrophobicContact CD1-CB 4.42Å; L32-Q97 HydrophobicContact CD1-CG 4.15Å; I93-Q97 HydrophobicContact CG2-CG 4.46Å; I93-Q97 WeakPolarHBondContact O-CB 3.38Å; I93-Q97 VanDerWaalsContact O-CG 3.28Å; I93-Q97 WeakPolarHBondContact O-CG 3.2Å; I93-Q97 PolarHBondContact O-N 2.86Å; I93-Q97 PolarHBondContact O-OE1 3.27Å; L95-Q97 PolarHBondContact O-N 2.96Å; Q97-I100 PolarHBondContact O-N 3.2Å; Q97-V101 PolarHBondContact O-N 3.33Å; Q97-I138 HydrophobicContact CB-CD1 4.07Å; Q97-I138 HydrophobicContact CB-CG2 4.07Å; Q97-I138 HydrophobicContact CG-CG2 4.29Å; Q97-I138 VanDerWaalsContact NE2-CG2 3.33Å
98	A	50.8	Low	49.1	Very low	2 Å²	2	30 Å²	30	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-39.1	178.8	0	0	0	0	0	113.3	S94 L95 A96 I100 V101 G102 I134	S94-A98 VanDerWaalsContact O-CB 3.24Å; S94-A98 WeakPolarHBondContact O-CB 3.41Å; S94-A98 PolarHBondContact O-N 2.71Å; L95-A98 WeakPolarHBondContact O-CA 3.42Å; L95-A98 WeakPolarHBondContact O-CB 3.18Å; L95-A98 PolarHBondContact O-N 3.02Å; A96-A98 PolarHBondContact O-N 3.34Å; A98-I100 VanDerWaalsContact C-N 3.32Å; A98-I100 PolarHBondContact O-N 3.29Å; A98-V101 PolarHBondContact O-N 3.2Å; A98-G102 PolarHBondContact O-N 3.4Å; A98-I134 VanDerWaalsContact CA-CG2 3.45Å; A98-I134 HydrophobicContact CB-CB 3.66Å; A98-I134 HydrophobicContact CB-CD1 4.22Å; A98-I134 HydrophobicContact CB-CG2 3.51Å
99	Y	50.6	Low	48.3	Very low	79 Å²	79	31.6 Å²	31.6	31%	0.31	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-41.4	172.3	-85.5	-79.2	0	0	0	112.1	L95 A96 G103 Y125 P126	L95-Y99 HydrophobicContact CD2-CE2 4.21Å; L95-Y99 VanDerWaalsContact O-CD2 3.25Å; L95-Y99 WeakPolarHBondContact O-CD2 3.09Å; L95-Y99 PolarHBondContact O-N 2.89Å; A96-Y99 WeakPolarHBondContact O-CB 3.03Å; A96-Y99 PolarHBondContact O-N 2.97Å; Y99-G103 PolarHBondContact O-N 2.92Å; Y99-Y125 WeakPolarHBondContact OH-CD1 3.45Å; Y99-Y125 WeakPolarHBondContact OH-CE1 3.41Å; Y99-P126 HydrophobicContact CD1-CG 4.05Å; Y99-P126 HydrophobicContact CE1-CG 3.47Å; Y99-P126 VanDerWaalsContact CE1-CG 3.47Å; Y99-P126 HydrophobicContact CE2-CG 4.46Å
100	I	51.7	Low	47.5	Very low	25 Å²	25	34.9 Å²	34.9	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-42.3	-179.8	-58.6	135.5	0	0	0	110.7	L32 I53 A96 Q97 A98 G103 L104	L32-I100 HydrophobicContact CD1-CB 4.12Å; L32-I100 HydrophobicContact CD1-CD1 3.78Å; L32-I100 HydrophobicContact CD1-CG2 4.04Å; I53-I100 HydrophobicContact CD1-CD1 3.1Å; I53-I100 HydrophobicContact CD1-CG1 3.75Å; I53-I100 HydrophobicContact CG1-CD1 3.61Å; I53-I100 HydrophobicContact CG1-CG1 4.36Å; A96-I100 WeakPolarHBondContact O-CD1 3.39Å; A96-I100 WeakPolarHBondContact O-CG1 3.43Å; A96-I100 PolarHBondContact O-N 3.42Å; A96-I100 VanDerWaalsContact O-N 3.11Å; Q97-I100 PolarHBondContact O-N 3.2Å; A98-I100 VanDerWaalsContact C-N 3.32Å; A98-I100 PolarHBondContact O-N 3.29Å; I100-G103 CarbonylContact O-C 3.34Å; I100-G103 WeakPolarHBondContact O-CA 3.36Å; I100-G103 PolarHBondContact O-N 3.47Å; I100-L104 HydrophobicContact CG2-CD1 4.21Å; I100-L104 HydrophobicContact CG2-CG 4.32Å; I100-L104 WeakPolarHBondContact O-CG 3.41Å; I100-L104 PolarHBondContact O-N 3.41Å
101	V	50.1	Low	46.6	Very low	9 Å²	9	38.3 Å²	38.3	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-72.5	-31.5	180	173.1	0	0	0	0	112.5	V35 Q97 A98 G103 R105 I134 I138	V35-V101 HydrophobicContact CB-CG2 3.9Å; V35-V101 HydrophobicContact CG1-CB 4.26Å; V35-V101 HydrophobicContact CG1-CG1 3.84Å; V35-V101 HydrophobicContact CG1-CG2 3.48Å; V35-V101 VanDerWaalsContact CG1-CG2 3.48Å; V35-V101 HydrophobicContact CG2-CG2 4.26Å; Q97-V101 PolarHBondContact O-N 3.33Å; A98-V101 PolarHBondContact O-N 3.2Å; V101-G103 VanDerWaalsContact C-N 3.28Å; V101-R105 HydrophobicContact CG1-CG 4.48Å; V101-R105 WeakPolarHBondContact O-CB 2.97Å; V101-R105 WeakPolarHBondContact O-CG 3.46Å; V101-R105 PolarHBondContact O-N 2.94Å; V101-I134 HydrophobicContact CB-CG2 4.32Å; V101-I134 HydrophobicContact CG1-CG2 4.47Å; V101-I138 HydrophobicContact CB-CD1 3.66Å; V101-I138 HydrophobicContact CG1-CD1 4.21Å; V101-I138 HydrophobicContact CG2-CD1 3.31Å; V101-I138 HydrophobicContact CG2-CG1 4.38Å
102	G	47.7	Very low	45.8	Very low	4 Å²	4	47 Å²	47	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-43.3	161.4	0	0	0	0	0	111.5	A98 L104 R105 A106 L118	A98-G102 PolarHBondContact O-N 3.4Å; G102-L104 PolarHBondContact O-N 3.44Å; G102-R105 PolarHBondContact O-N 2.78Å; G102-A106 PolarHBondContact O-N 3.41Å; G102-A106 VanDerWaalsContact O-N 3.1Å; G102-L118 WeakPolarHBondContact O-CD1 2.96Å
103	G	46	Very low	44.8	Very low	8 Å²	8	46.1 Å²	46.1	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-48.2	-50.5	170.7	0	0	0	0	0	115.6	Y99 I100 V101 L118	Y99-G103 PolarHBondContact O-N 2.92Å; I100-G103 CarbonylContact O-C 3.34Å; I100-G103 WeakPolarHBondContact O-CA 3.36Å; I100-G103 PolarHBondContact O-N 3.47Å; V101-G103 VanDerWaalsContact C-N 3.28Å; G103-L118 VanDerWaalsContact O-CD1 3.26Å; G103-L118 WeakPolarHBondContact O-CD1 3.4Å
104	L	44.2	Very low	43.6	Very low	4 Å²	4	48.2 Å²	48.2	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-71.2	-47.6	179.1	-60.7	171.3	0	0	0	109.6	V35 W41 I100 G102 A106 Q107 D108	V35-L104 HydrophobicContact CG1-CD1 4.23Å; W41-L104 HydrophobicContact CD2-CD2 3.46Å; W41-L104 VanDerWaalsContact CD2-CD2 3.46Å; W41-L104 HydrophobicContact CE3-CD2 3.85Å; W41-L104 HydrophobicContact CG-CD2 3.74Å; W41-L104 HydrophobicContact CH2-CD2 4.48Å; W41-L104 HydrophobicContact CZ2-CD2 4.17Å; W41-L104 HydrophobicContact CZ3-CD2 4.31Å; I100-L104 HydrophobicContact CG2-CD1 4.21Å; I100-L104 HydrophobicContact CG2-CG 4.32Å; I100-L104 WeakPolarHBondContact O-CG 3.41Å; I100-L104 PolarHBondContact O-N 3.41Å; G102-L104 PolarHBondContact O-N 3.44Å; L104-A106 PolarHBondContact O-N 2.91Å; L104-Q107 PolarHBondContact O-N 3.24Å; L104-D108 PolarHBondContact O-N 2.85Å; L104-D108 VanDerWaalsContact O-N 3.17Å
105	R	43.4	Very low	42.7	Very low	102 Å²	102	56.6 Å²	56.6	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-69.6	-31.5	-170.7	-75.8	-172.9	171.4	-151.4	-4.2	116.2	V101 G102 I110	V101-R105 HydrophobicContact CG1-CG 4.48Å; V101-R105 WeakPolarHBondContact O-CB 2.97Å; V101-R105 WeakPolarHBondContact O-CG 3.46Å; V101-R105 PolarHBondContact O-N 2.94Å; G102-R105 PolarHBondContact O-N 2.78Å; R105-I110 PolarHBondContact O-N 2.02Å
106	A	41	Very low	41.8	Very low	31 Å²	31	62.7 Å²	62.7	26%	0.256	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.7	175.6	0	0	0	0	0	113.5	G102 L104 L118	G102-A106 PolarHBondContact O-N 3.41Å; G102-A106 VanDerWaalsContact O-N 3.1Å; L104-A106 PolarHBondContact O-N 2.91Å; A106-L118 HydrophobicContact CB-CB 4.48Å; A106-L118 HydrophobicContact CB-CD1 3.44Å; A106-L118 VanDerWaalsContact CB-CD1 3.44Å
107	Q	40.1	Very low	40.7	Very low	111 Å²	111	61.7 Å²	61.7	52%	0.519	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-31.9	164.4	-70.4	-164.2	7	0	0	112.2	L104 G109	L104-Q107 PolarHBondContact O-N 3.24Å; Q107-G109 PolarHBondContact O-N 3.34Å
108	D	40.3	Very low	39.6	Very low	51 Å²	51	63.4 Å²	63.4	27%	0.273	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	8.8	171.6	-66.2	-40.1	0	0	0	113.9	T40 L104 I110	T40-D108 WeakPolarHBondContact CB-OD1 3.19Å; T40-D108 WeakPolarHBondContact CG2-OD1 3.39Å; T40-D108 PolarHBondContact N-OD1 3.45Å; T40-D108 PolarHBondContact OG1-OD1 2.94Å; L104-D108 PolarHBondContact O-N 2.85Å; L104-D108 VanDerWaalsContact O-N 3.17Å; D108-I110 VanDerWaalsContact C-N 3.26Å; D108-I110 HydrophobicContact CB-CD1 4.47Å; D108-I110 HydrophobicContact CB-CG1 4.33Å; D108-I110 PolarHBondContact O-N 2.9Å
109	G	32.6	Very low	38.7	Very low	62 Å²	62	67.7 Å²	67.7	64%	0.639	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	9.9	176.1	0	0	0	0	0	115.4	Q107 A111	Q107-G109 PolarHBondContact O-N 3.34Å; G109-A111 VanDerWaalsContact C-N 3.35Å; G109-A111 PolarHBondContact O-N 3.34Å
110	I	36.2	Very low	37.6	Very low	75 Å²	75	69.8 Å²	69.8	39%	0.385	40%	0.396	S	S	.	.			trans	-74.6	88	179.7	-54.1	179	0	0	0	109.4	R105 D108 E112 F113	R105-I110 PolarHBondContact O-N 2.02Å; D108-I110 VanDerWaalsContact C-N 3.26Å; D108-I110 HydrophobicContact CB-CD1 4.47Å; D108-I110 HydrophobicContact CB-CG1 4.33Å; D108-I110 PolarHBondContact O-N 2.9Å; I110-E112 PolarHBondContact O-N 2.78Å; I110-F113 PolarHBondContact O-N 3.24Å; I110-F113 VanDerWaalsContact O-N 3.1Å
111	A	32.8	Very low	36.5	Very low	83 Å²	83	74 Å²	74	69%	0.686	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.2	-168.9	0	0	0	0	0	115.5	G109 F113 G114	G109-A111 VanDerWaalsContact C-N 3.35Å; G109-A111 PolarHBondContact O-N 3.34Å; A111-F113 VanDerWaalsContact C-N 3.31Å; A111-F113 PolarHBondContact O-N 2.89Å; A111-G114 PolarHBondContact O-N 3.41Å; A111-G114 VanDerWaalsContact O-N 3.17Å
112	E	36.2	Very low	35.6	Very low	183 Å²	183	77.7 Å²	77.7	86%	0.855	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-28.1	176.4	-70.4	-168.1	134.8	0	0	113.7	I110	I110-E112 PolarHBondContact O-N 2.78Å
113	F	31.7	Very low	34.7	Very low	60 Å²	60	79.9 Å²	79.9	26%	0.263	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-19.7	172.5	-80.7	-93.8	0	0	0	112.6	I110 A111 Q115 R116 I134	I110-F113 PolarHBondContact O-N 3.24Å; I110-F113 VanDerWaalsContact O-N 3.1Å; A111-F113 VanDerWaalsContact C-N 3.31Å; A111-F113 PolarHBondContact O-N 2.89Å; F113-Q115 VanDerWaalsContact C-N 3.34Å; F113-Q115 PolarHBondContact O-N 3.34Å; F113-R116 PolarHBondContact O-N 3.13Å; F113-I134 HydrophobicContact CE1-CD1 4.1Å; F113-I134 HydrophobicContact CE1-CG1 4.35Å
114	G	30.5	Very low	34	Very low	51 Å²	51	82.2 Å²	82.2	53%	0.526	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11	-168.8	0	0	0	0	0	117	A111	A111-G114 PolarHBondContact O-N 3.41Å; A111-G114 VanDerWaalsContact O-N 3.17Å
115	Q	33.4	Very low	33.6	Very low	175 Å²	175	91.2 Å²	91.2	82%	0.818	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-15.6	176.5	-76.4	-159.4	-2	0	0	114.6	F113	F113-Q115 VanDerWaalsContact C-N 3.34Å; F113-Q115 PolarHBondContact O-N 3.34Å
116	R	33.8	Very low	33.5	Very low	164 Å²	164	87.2 Å²	87.2	62%	0.619	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.8	3.2	-165.1	-79.7	-164.7	177.9	178.8	-0.7	118.7	F113 A124 Y125 P126	F113-R116 PolarHBondContact O-N 3.13Å; R116-A124 CarbonylContact C-O 3.45Å; R116-A124 CarbonylContact O-C 3.5Å; R116-A124 VanDerWaalsContact O-O 3.07Å; R116-Y125 CarbonylContact O-C 2.9Å; R116-P126 WeakPolarHBondContact O-CA 3Å
117	G	29.3	Very low	33.7	Very low	14 Å²	14	88 Å²	88	14%	0.144	53%	0.526	C	S	.	.			trans	-165.7	82.6	-175.7	0	0	0	0	0	117.3	A124	G117-A124 VanDerWaalsContact CA-O 3.29Å; G117-A124 WeakPolarHBondContact CA-O 3.31Å
118	L	28.9	Very low	34.2	Very low	38 Å²	38	85.2 Å²	85.2	20%	0.199	52%	0.515	C	S	.	.			trans	-165.1	109.5	166.1	-141.5	175.3	0	0	0	115	G102 G103 A106 L120 A123	G102-L118 WeakPolarHBondContact O-CD1 2.96Å; G103-L118 VanDerWaalsContact O-CD1 3.26Å; G103-L118 WeakPolarHBondContact O-CD1 3.4Å; A106-L118 HydrophobicContact CB-CB 4.48Å; A106-L118 HydrophobicContact CB-CD1 3.44Å; A106-L118 VanDerWaalsContact CB-CD1 3.44Å; L118-L120 VanDerWaalsContact C-N 3.3Å; L118-L120 PolarHBondContact O-N 2.77Å; L118-A123 WeakPolarHBondContact O-CB 3.27Å
119	A	31.9	Very low	34.5	Very low	93 Å²	93	88.4 Å²	88.4	77%	0.769	53%	0.532	S	S	*	.			trans	-59.9	77.5	-178.9	0	0	0	0	0	115.7
120	L	27.9	Very low	35.2	Very low	123 Å²	123	86.1 Å²	86.1	64%	0.644	51%	0.508	S	S	*	.	S	Bend	trans	-99.9	157.9	141.3	-75.9	163.7	0	0	0	107.9	L118 G122 A123	L118-L120 VanDerWaalsContact C-N 3.3Å; L118-L120 PolarHBondContact O-N 2.77Å; L120-G122 PolarHBondContact O-N 3.13Å; L120-A123 PolarHBondContact O-N 3.06Å; L120-A123 VanDerWaalsContact O-N 3.12Å
121	P	29.1	Very low	35.9	Very low	113 Å²	113	82.8 Å²	82.8	73%	0.734	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	103.9	-177	-18.4	30.2	0	0	0	111.2
122	G	30	Very low	36.7	Very low	86 Å²	86	81.8 Å²	81.8	89%	0.887	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.3	-7.2	-179	0	0	0	0	0	116.2	L120	L120-G122 PolarHBondContact O-N 3.13Å
123	A	28.9	Very low	37.3	Very low	51 Å²	51	79 Å²	79	42%	0.421	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-84.8	144.8	178.8	0	0	0	0	0	113.5	L118 L120	L118-A123 WeakPolarHBondContact O-CB 3.27Å; L120-A123 PolarHBondContact O-N 3.06Å; L120-A123 VanDerWaalsContact O-N 3.12Å
124	A	32.3	Very low	38.1	Very low	57 Å²	57	76.8 Å²	76.8	47%	0.471	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-68.4	154.5	177.6	0	0	0	0	0	112.8	R116 G117	R116-A124 CarbonylContact C-O 3.45Å; R116-A124 CarbonylContact O-C 3.5Å; R116-A124 VanDerWaalsContact O-O 3.07Å; G117-A124 VanDerWaalsContact CA-O 3.29Å; G117-A124 WeakPolarHBondContact CA-O 3.31Å
125	Y	35.8	Very low	39.1	Very low	192 Å²	192	74.6 Å²	74.6	75%	0.753	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-68.1	134.5	172.8	-99	-116.3	0	0	0	111.4	Y99 R116 S127	Y99-Y125 WeakPolarHBondContact OH-CD1 3.45Å; Y99-Y125 WeakPolarHBondContact OH-CE1 3.41Å; R116-Y125 CarbonylContact O-C 2.9Å; Y125-S127 PolarHBondContact O-N 2.83Å
126	P	40.4	Very low	40.1	Very low	19 Å²	19	70.2 Å²	70.2	12%	0.123	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-54	126.6	175.7	22.6	-30.9	0	0	0	109.7	Y99 R116 I131	Y99-P126 HydrophobicContact CD1-CG 4.05Å; Y99-P126 HydrophobicContact CE1-CG 3.47Å; Y99-P126 VanDerWaalsContact CE1-CG 3.47Å; Y99-P126 HydrophobicContact CE2-CG 4.46Å; R116-P126 WeakPolarHBondContact O-CA 3Å; P126-I131 HydrophobicContact CB-CG1 3.99Å; P126-I131 HydrophobicContact CG-CD1 4.14Å; P126-I131 HydrophobicContact CG-CG1 3.9Å; P126-I131 VanDerWaalsContact O-CD1 3.3Å; P126-I131 WeakPolarHBondContact O-CD1 3.28Å
127	S	46	Very low	40.8	Very low	47 Å²	47	66.6 Å²	66.6	33%	0.329	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-57.9	149.3	-178	67.8	0	0	0	0	111.1	Y125 N129 G130 I131	Y125-S127 PolarHBondContact O-N 2.83Å; S127-N129 PolarHBondContact O-N 2.98Å; S127-G130 WeakPolarHBondContact O-CA 3.17Å; S127-G130 PolarHBondContact O-N 3.4Å; S127-G130 PolarHBondContact OG-N 3.44Å; S127-I131 PolarHBondContact O-N 3.05Å
128	D	49.3	Very low	41.6	Very low	52 Å²	52	66.1 Å²	66.1	28%	0.278	40%	0.403	S	S	.	.	H	α-helix	trans	-53.6	-32.4	-177.2	-84.2	3.9	0	0	0	113.6	R132 K152	D128-R132 WeakPolarHBondContact O-CB 3.17Å; D128-R132 WeakPolarHBondContact O-CD 3.44Å; D128-R132 WeakPolarHBondContact O-CG 3.18Å; D128-R132 PolarHBondContact O-N 2.92Å; D128-K152 IonicContact OD1-NZ 2.64Å; D128-K152 PolarHBondContact OD1-NZ 2.98Å; D128-K152 IonicContact OD2-NZ 2.74Å; D128-K152 PolarHBondContact OD2-NZ 3.17Å
129	N	48.5	Very low	42.6	Very low	119 Å²	119	64.8 Å²	64.8	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-68	-40.6	172.8	-75.9	-4.7	0	0	0	112.9	S127 R132 Q133	S127-N129 PolarHBondContact O-N 2.98Å; N129-R132 PolarHBondContact O-N 3.31Å; N129-Q133 WeakPolarHBondContact O-CB 3.44Å; N129-Q133 WeakPolarHBondContact O-CG 3.42Å; N129-Q133 PolarHBondContact O-N 3.32Å
130	G	46.9	Very low	43.4	Very low	13 Å²	13	62.4 Å²	62.4	13%	0.134	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-44.6	174.8	0	0	0	0	0	111.5	S127 R132 Q133 I134	S127-G130 WeakPolarHBondContact O-CA 3.17Å; S127-G130 PolarHBondContact O-N 3.4Å; S127-G130 PolarHBondContact OG-N 3.44Å; G130-R132 PolarHBondContact O-N 2.94Å; G130-Q133 PolarHBondContact O-N 2.96Å; G130-I134 WeakPolarHBondContact O-CD1 3.22Å; G130-I134 WeakPolarHBondContact O-CG1 3.44Å; G130-I134 PolarHBondContact O-N 2.91Å
131	I	49.7	Very low	44.5	Very low	6 Å²	6	59.5 Å²	59.5	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-55.1	-51.7	171.9	-70.2	175.3	0	0	0	110.3	L95 P126 S127 Q133 I134 I135 Y148	L95-I131 HydrophobicContact CD2-CD1 3.97Å; L95-I131 HydrophobicContact CD2-CG1 4.4Å; L95-I131 HydrophobicContact CD2-CG2 3.45Å; L95-I131 VanDerWaalsContact CD2-CG2 3.45Å; L95-I131 HydrophobicContact CG-CG2 4.33Å; P126-I131 HydrophobicContact CB-CG1 3.99Å; P126-I131 HydrophobicContact CG-CD1 4.14Å; P126-I131 HydrophobicContact CG-CG1 3.9Å; P126-I131 VanDerWaalsContact O-CD1 3.3Å; P126-I131 WeakPolarHBondContact O-CD1 3.28Å; S127-I131 PolarHBondContact O-N 3.05Å; I131-Q133 PolarHBondContact O-N 3Å; I131-I134 PolarHBondContact O-N 3.13Å; I131-I135 HydrophobicContact CG2-CD1 3.54Å; I131-I135 HydrophobicContact CG2-CG1 4.2Å; I131-I135 WeakPolarHBondContact O-CB 3.17Å; I131-I135 VanDerWaalsContact O-CG1 3.24Å; I131-I135 WeakPolarHBondContact O-CG1 3.46Å; I131-I135 PolarHBondContact O-N 2.81Å; I131-Y148 HydrophobicContact CG2-CE2 3.84Å; I131-Y148 WeakPolarHBondContact CG2-OH 3.31Å
132	R	50	Low	45.4	Very low	62 Å²	62	59.4 Å²	59.4	23%	0.234	36%	0.36	C	S	.	.	H	α-helix	trans	-60.2	-45.3	179.8	-78.1	165.3	163.2	-127.9	-2.3	113.2	D128 N129 G130 I135 S136 D145	D128-R132 WeakPolarHBondContact O-CB 3.17Å; D128-R132 WeakPolarHBondContact O-CD 3.44Å; D128-R132 WeakPolarHBondContact O-CG 3.18Å; D128-R132 PolarHBondContact O-N 2.92Å; N129-R132 PolarHBondContact O-N 3.31Å; G130-R132 PolarHBondContact O-N 2.94Å; R132-I135 PolarHBondContact O-N 2.94Å; R132-S136 WeakPolarHBondContact O-CB 3.41Å; R132-S136 PolarHBondContact O-N 3.45Å; R132-S136 PolarHBondContact O-OG 3Å; R132-D145 VanDerWaalsContact CZ-CG 3.49Å; R132-D145 IonicContact CZ-OD1 3.34Å; R132-D145 IonicContact CZ-OD2 2.7Å; R132-D145 IonicContact NH1-OD1 2.83Å; R132-D145 PolarHBondContact NH1-OD1 2.88Å; R132-D145 IonicContact NH1-OD2 3.35Å; R132-D145 PolarHBondContact NH1-OD2 3.04Å; R132-D145 IonicContact NH2-OD1 3.1Å; R132-D145 PolarHBondContact NH2-OD1 3.45Å; R132-D145 IonicContact NH2-OD2 2.85Å; R132-D145 PolarHBondContact NH2-OD2 2.96Å
133	Q	49.7	Very low	46.3	Very low	124 Å²	124	56.9 Å²	56.9	58%	0.579	33%	0.325	S	S	*	.	H	α-helix	trans	-58.4	-49.6	175.2	-80.9	-177.9	-19.8	0	0	110.8	N129 G130 I131 I135 S136 T137	N129-Q133 WeakPolarHBondContact O-CB 3.44Å; N129-Q133 WeakPolarHBondContact O-CG 3.42Å; N129-Q133 PolarHBondContact O-N 3.32Å; G130-Q133 PolarHBondContact O-N 2.96Å; I131-Q133 PolarHBondContact O-N 3Å; Q133-I135 PolarHBondContact O-N 3.23Å; Q133-S136 CarbonylContact O-C 3.57Å; Q133-S136 PolarHBondContact O-N 3.46Å; Q133-S136 PolarHBondContact O-OG 3Å; Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 PolarHBondContact O-N 3.01Å; Q133-T137 PolarHBondContact O-OG1 3.2Å
134	I	48.2	Very low	47.2	Very low	14 Å²	14	58.2 Å²	58.2	7%	0.072	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-39.9	-178.4	-56.5	159.6	0	0	0	111.2	A98 V101 F113 G130 I131 S136 T137 I138	A98-I134 VanDerWaalsContact CA-CG2 3.45Å; A98-I134 HydrophobicContact CB-CB 3.66Å; A98-I134 HydrophobicContact CB-CD1 4.22Å; A98-I134 HydrophobicContact CB-CG2 3.51Å; V101-I134 HydrophobicContact CB-CG2 4.32Å; V101-I134 HydrophobicContact CG1-CG2 4.47Å; F113-I134 HydrophobicContact CE1-CD1 4.1Å; F113-I134 HydrophobicContact CE1-CG1 4.35Å; G130-I134 WeakPolarHBondContact O-CD1 3.22Å; G130-I134 WeakPolarHBondContact O-CG1 3.44Å; G130-I134 PolarHBondContact O-N 2.91Å; I131-I134 PolarHBondContact O-N 3.13Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 3.28Å; I134-T137 CarbonylContact O-C 3.55Å; I134-T137 WeakPolarHBondContact O-CA 3.46Å; I134-T137 PolarHBondContact O-N 2.82Å; I134-I138 HydrophobicContact CG2-CD1 3.26Å; I134-I138 HydrophobicContact CG2-CG1 3.79Å; I134-I138 WeakPolarHBondContact O-CG1 3.34Å; I134-I138 PolarHBondContact O-N 3.38Å
135	I	50.4	Low	47.7	Very low	5 Å²	5	59.5 Å²	59.5	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-55.9	-47.5	170.9	-72.7	175.1	0	0	0	110.8	L95 I131 R132 Q133 T137 G139 L143 Y148	L95-I135 HydrophobicContact CG-CD1 4.21Å; I131-I135 HydrophobicContact CG2-CD1 3.54Å; I131-I135 HydrophobicContact CG2-CG1 4.2Å; I131-I135 WeakPolarHBondContact O-CB 3.17Å; I131-I135 VanDerWaalsContact O-CG1 3.24Å; I131-I135 WeakPolarHBondContact O-CG1 3.46Å; I131-I135 PolarHBondContact O-N 2.81Å; R132-I135 PolarHBondContact O-N 2.94Å; Q133-I135 PolarHBondContact O-N 3.23Å; I135-T137 PolarHBondContact O-N 3.25Å; I135-G139 VanDerWaalsContact O-CA 3.29Å; I135-G139 WeakPolarHBondContact O-CA 3.18Å; I135-G139 PolarHBondContact O-N 2.93Å; I135-L143 HydrophobicContact CG2-CB 4.04Å; I135-L143 HydrophobicContact CG2-CD1 3.57Å; I135-L143 HydrophobicContact CG2-CG 4.32Å; I135-Y148 HydrophobicContact CD1-CD2 3.93Å; I135-Y148 HydrophobicContact CD1-CE2 3.71Å
136	S	54.6	Low	48	Very low	83 Å²	83	56 Å²	56	58%	0.58	32%	0.318	S	S	*	.	H	α-helix	trans	-68.3	-16.8	176.3	70.8	0	0	0	0	114.2	R132 Q133 I134	R132-S136 WeakPolarHBondContact O-CB 3.41Å; R132-S136 PolarHBondContact O-N 3.45Å; R132-S136 PolarHBondContact O-OG 3Å; Q133-S136 CarbonylContact O-C 3.57Å; Q133-S136 PolarHBondContact O-N 3.46Å; Q133-S136 PolarHBondContact O-OG 3Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 3.28Å
137	T	49.4	Very low	48.4	Very low	87 Å²	87	57 Å²	57	53%	0.534	32%	0.322	S	S	.	.	H	α-helix	trans	-95.8	-30.3	-178.6	-51.5	0	0	0	0	112.6	R31 Q133 I134 I135	R31-T137 PolarHBondContact NH1-O 2.84Å; Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 PolarHBondContact O-N 3.01Å; Q133-T137 PolarHBondContact O-OG1 3.2Å; I134-T137 CarbonylContact O-C 3.55Å; I134-T137 WeakPolarHBondContact O-CA 3.46Å; I134-T137 PolarHBondContact O-N 2.82Å; I135-T137 PolarHBondContact O-N 3.25Å
138	I	45.8	Very low	48.3	Very low	4 Å²	4	54.9 Å²	54.9	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-106.8	-41.1	-178.7	-49	174.2	0	0	0	111.8	R31 Q97 V101 I134 C140	R31-I138 HydrophobicContact CB-CG2 3.82Å; R31-I138 WeakPolarHBondContact CG-O 3.17Å; Q97-I138 HydrophobicContact CB-CD1 4.07Å; Q97-I138 HydrophobicContact CB-CG2 4.07Å; Q97-I138 HydrophobicContact CG-CG2 4.29Å; Q97-I138 VanDerWaalsContact NE2-CG2 3.33Å; V101-I138 HydrophobicContact CB-CD1 3.66Å; V101-I138 HydrophobicContact CG1-CD1 4.21Å; V101-I138 HydrophobicContact CG2-CD1 3.31Å; V101-I138 HydrophobicContact CG2-CG1 4.38Å; I134-I138 HydrophobicContact CG2-CD1 3.26Å; I134-I138 HydrophobicContact CG2-CG1 3.79Å; I134-I138 WeakPolarHBondContact O-CG1 3.34Å; I134-I138 PolarHBondContact O-N 3.38Å; I138-C140 PolarHBondContact O-N 3.44Å
139	G	49.2	Very low	48	Very low	11 Å²	11	56.6 Å²	56.6	11%	0.113	31%	0.309	C	S	.	.			trans	-62.9	128.2	-173	0	0	0	0	0	111.9	I135 I141	I135-G139 VanDerWaalsContact O-CA 3.29Å; I135-G139 WeakPolarHBondContact O-CA 3.18Å; I135-G139 PolarHBondContact O-N 2.93Å; G139-I141 PolarHBondContact O-N 3.15Å
140	C	50.2	Low	47.6	Very low	42 Å²	42	54.3 Å²	54.3	28%	0.284	30%	0.297	S	S	.	.	S	Bend	trans	-72	-8.7	-179.8	-66.2	0	0	0	0	114.8	C27 N28 I138	C27-C140 HydrophobicContact CB-CB 3.67Å; C27-C140 WeakPolarHBondContact CB-SG 3.45Å; C27-C140 PolarHBondContact O-SG 3.19Å; C27-C140 WeakPolarHBondContact SG-CB 3.44Å; C27-C140 CovalentContact SG-SG 2.02Å; C27-C140 PolarHBondContact SG-SG 3.33Å; N28-C140 PolarHBondContact OD1-N 3.08Å; I138-C140 PolarHBondContact O-N 3.44Å
141	I	49.3	Very low	47.7	Very low	63 Å²	63	55.3 Å²	55.3	32%	0.323	30%	0.301	S	S	.	.	S	Bend	trans	-124.7	125.6	170.7	-63.9	178.6	0	0	0	107.1	I24 I90 G139 L143	I24-I141 HydrophobicContact CD1-CD1 3.58Å; I24-I141 HydrophobicContact CG1-CD1 3.61Å; I24-I141 HydrophobicContact CG1-CG1 4.44Å; I90-I141 HydrophobicContact CD1-CB 4.45Å; I90-I141 HydrophobicContact CD1-CD1 3.75Å; I90-I141 HydrophobicContact CD1-CG2 4.42Å; I90-I141 HydrophobicContact CG1-CD1 4.41Å; I90-I141 HydrophobicContact CG2-CB 4.32Å; G139-I141 PolarHBondContact O-N 3.15Å; I141-L143 PolarHBondContact O-N 3.5Å
142	P	48.5	Very low	47.4	Very low	111 Å²	111	57.6 Å²	57.6	72%	0.721	31%	0.311	S	S	*	.			trans	-65.5	110.4	173.8	27.2	-32.8	0	0	0	108.9	D144	P142-D144 PolarHBondContact O-N 2.85Å
143	L	49.9	Very low	46.6	Very low	32 Å²	32	55.7 Å²	55.7	17%	0.168	31%	0.311	C	S	.	.			trans	-72.8	115.6	175.3	-85	163.2	0	0	0	109.9	I90 V91 I135 I141 N147	I90-L143 HydrophobicContact CB-CD1 4.48Å; I90-L143 HydrophobicContact CB-CD2 4.3Å; I90-L143 HydrophobicContact CG2-CD1 3.75Å; I90-L143 HydrophobicContact CG2-CD2 3.98Å; I90-L143 HydrophobicContact CG2-CG 3.76Å; V91-L143 HydrophobicContact CB-CD1 4.17Å; V91-L143 HydrophobicContact CG2-CD1 3.5Å; V91-L143 HydrophobicContact CG2-CD2 3.54Å; V91-L143 HydrophobicContact CG2-CG 4.14Å; I135-L143 HydrophobicContact CG2-CB 4.04Å; I135-L143 HydrophobicContact CG2-CD1 3.57Å; I135-L143 HydrophobicContact CG2-CG 4.32Å; I141-L143 PolarHBondContact O-N 3.5Å; L143-N147 HydrophobicContact CD2-CB 3.81Å
144	D	47.2	Very low	45.5	Very low	79 Å²	79	55.3 Å²	55.3	42%	0.422	32%	0.319	S	S	.	.			trans	-66.2	157.2	165.6	70.7	49.6	0	0	0	111.1	P142 I146 N147 Y148	P142-D144 PolarHBondContact O-N 2.85Å; D144-I146 PolarHBondContact O-N 3.39Å; D144-I146 WeakPolarHBondContact OD1-CA 3.22Å; D144-I146 WeakPolarHBondContact OD1-CB 3.44Å; D144-I146 PolarHBondContact OD1-N 2.92Å; D144-N147 VanDerWaalsContact CG-ND2 3.26Å; D144-N147 PolarHBondContact O-N 3.42Å; D144-N147 WeakPolarHBondContact OD1-CB 3.2Å; D144-N147 PolarHBondContact OD1-N 2.87Å; D144-N147 PolarHBondContact OD1-ND2 3.2Å; D144-N147 PolarHBondContact OD2-ND2 3.21Å; D144-Y148 PolarHBondContact O-N 3.02Å
145	D	43.2	Very low	44.8	Very low	84 Å²	84	59.5 Å²	59.5	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-53.6	-35.6	179.5	-89.7	38.2	0	0	0	113.2	R132 W149	R132-D145 VanDerWaalsContact CZ-CG 3.49Å; R132-D145 IonicContact CZ-OD1 3.34Å; R132-D145 IonicContact CZ-OD2 2.7Å; R132-D145 IonicContact NH1-OD1 2.83Å; R132-D145 PolarHBondContact NH1-OD1 2.88Å; R132-D145 IonicContact NH1-OD2 3.35Å; R132-D145 PolarHBondContact NH1-OD2 3.04Å; R132-D145 IonicContact NH2-OD1 3.1Å; R132-D145 PolarHBondContact NH2-OD1 3.45Å; R132-D145 IonicContact NH2-OD2 2.85Å; R132-D145 PolarHBondContact NH2-OD2 2.96Å; D145-W149 WeakPolarHBondContact O-CB 3.48Å; D145-W149 PolarHBondContact O-N 3.14Å
146	I	42.1	Very low	43.8	Very low	120 Å²	120	66.5 Å²	66.5	62%	0.615	37%	0.374	S	S	*	.	H	α-helix	trans	-70.4	-45.5	-175	-65.3	167.5	0	0	0	109.2	D144 W149 L150	D144-I146 PolarHBondContact O-N 3.39Å; D144-I146 WeakPolarHBondContact OD1-CA 3.22Å; D144-I146 WeakPolarHBondContact OD1-CB 3.44Å; D144-I146 PolarHBondContact OD1-N 2.92Å; I146-W149 PolarHBondContact O-N 3.45Å; I146-L150 HydrophobicContact CG2-CD1 3.7Å; I146-L150 HydrophobicContact CG2-CG 4.23Å; I146-L150 WeakPolarHBondContact O-CB 3.5Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.42Å
147	N	48.3	Very low	42.8	Very low	38 Å²	38	66.9 Å²	66.9	20%	0.203	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-41.5	176	-76.7	-45.3	0	0	0	111.8	A87 L143 D144 C151	A87-N147 HydrophobicContact CB-CB 3.83Å; A87-N147 WeakPolarHBondContact CB-OD1 3.41Å; L143-N147 HydrophobicContact CD2-CB 3.81Å; D144-N147 VanDerWaalsContact CG-ND2 3.26Å; D144-N147 PolarHBondContact O-N 3.42Å; D144-N147 WeakPolarHBondContact OD1-CB 3.2Å; D144-N147 PolarHBondContact OD1-N 2.87Å; D144-N147 PolarHBondContact OD1-ND2 3.2Å; D144-N147 PolarHBondContact OD2-ND2 3.21Å; N147-C151 PolarHBondContact O-N 3.18Å; N147-C151 PolarHBondContact O-SG 3.45Å; N147-C151 VanDerWaalsContact O-SG 3.36Å
148	Y	44.3	Very low	42.1	Very low	4 Å²	4	70.1 Å²	70.1	2%	0.016	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-50.1	172.7	-178.4	-97.8	0	0	0	112.2	V91 I131 I135 D144 C151 K152	V91-Y148 HydrophobicContact CG1-CD2 4.23Å; I131-Y148 HydrophobicContact CG2-CE2 3.84Å; I131-Y148 WeakPolarHBondContact CG2-OH 3.31Å; I135-Y148 HydrophobicContact CD1-CD2 3.93Å; I135-Y148 HydrophobicContact CD1-CE2 3.71Å; D144-Y148 PolarHBondContact O-N 3.02Å; Y148-C151 PolarHBondContact O-N 3.44Å; Y148-K152 HydrophobicContact CE1-CD 3.86Å; Y148-K152 WeakPolarHBondContact O-CB 3.49Å; Y148-K152 PolarHBondContact O-N 3.48Å
149	W	43.3	Very low	41.6	Very low	87 Å²	87	72.5 Å²	72.5	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-71.5	-34.5	-179.9	-75.9	119.7	0	0	0	113.8	D145 I146 C151 K152 G153 P155	D145-W149 WeakPolarHBondContact O-CB 3.48Å; D145-W149 PolarHBondContact O-N 3.14Å; I146-W149 PolarHBondContact O-N 3.45Å; W149-C151 PolarHBondContact O-N 3.22Å; W149-K152 HydrophobicContact CE3-CB 4.48Å; W149-K152 HydrophobicContact CE3-CD 4.39Å; W149-K152 HydrophobicContact CZ3-CD 4.04Å; W149-G153 CarbonylContact O-C 3.54Å; W149-G153 PolarHBondContact O-N 2.99Å; W149-G153 VanDerWaalsContact O-N 3.07Å; W149-G153 VanDerWaalsContact O-O 3.11Å; W149-P155 HydrophobicContact CH2-CB 4.38Å; W149-P155 HydrophobicContact CZ3-CB 4.07Å
150	L	40.4	Very low	41	Very low	72 Å²	72	74.2 Å²	74.2	38%	0.377	41%	0.409	S	S	.	.	H	α-helix	trans	-59	-29.3	175.2	-84.6	171.8	0	0	0	112.4	K84 I146	K84-L150 HydrophobicContact CD-CD2 4.32Å; K84-L150 HydrophobicContact CG-CD1 4.26Å; I146-L150 HydrophobicContact CG2-CD1 3.7Å; I146-L150 HydrophobicContact CG2-CG 4.23Å; I146-L150 WeakPolarHBondContact O-CB 3.5Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.42Å
151	C	47.5	Very low	40.2	Very low	33 Å²	33	76.1 Å²	76.1	22%	0.223	42%	0.415	C	S	.	.	H	α-helix	trans	-102.4	-29.9	-175.4	-64.1	0	0	0	0	113.7	C88 V91 N147 Y148 W149 G153	C88-C151 WeakPolarHBondContact CA-SG 3.34Å; C88-C151 HydrophobicContact CB-CB 3.67Å; C88-C151 WeakPolarHBondContact CB-SG 3.39Å; C88-C151 PolarHBondContact N-SG 3.46Å; C88-C151 WeakPolarHBondContact SG-CA 3.38Å; C88-C151 WeakPolarHBondContact SG-CB 3.39Å; C88-C151 CovalentContact SG-SG 2.04Å; C88-C151 PolarHBondContact SG-SG 3.4Å; V91-C151 HydrophobicContact CB-CB 4Å; V91-C151 HydrophobicContact CG1-CB 4.03Å; V91-C151 HydrophobicContact CG2-CB 4.02Å; N147-C151 PolarHBondContact O-N 3.18Å; N147-C151 PolarHBondContact O-SG 3.45Å; N147-C151 VanDerWaalsContact O-SG 3.36Å; Y148-C151 PolarHBondContact O-N 3.44Å; W149-C151 PolarHBondContact O-N 3.22Å; C151-G153 PolarHBondContact O-N 2.88Å
152	K	43.8	Very low	39.5	Very low	54 Å²	54	79.7 Å²	79.7	24%	0.235	43%	0.43	C	S	.	.	H	α-helix	trans	-68.9	-17.6	166.9	-152.7	-176.2	-176.8	-167.6	0	112.5	D128 Y148 W149	D128-K152 IonicContact OD1-NZ 2.64Å; D128-K152 PolarHBondContact OD1-NZ 2.98Å; D128-K152 IonicContact OD2-NZ 2.74Å; D128-K152 PolarHBondContact OD2-NZ 3.17Å; Y148-K152 HydrophobicContact CE1-CD 3.86Å; Y148-K152 WeakPolarHBondContact O-CB 3.49Å; Y148-K152 PolarHBondContact O-N 3.48Å; W149-K152 HydrophobicContact CE3-CB 4.48Å; W149-K152 HydrophobicContact CE3-CD 4.39Å; W149-K152 HydrophobicContact CZ3-CD 4.04Å
153	G	33.8	Very low	38.8	Very low	23 Å²	23	80.9 Å²	80.9	24%	0.237	43%	0.426	C	S	.	.			trans	80.9	-179.8	-171.4	0	0	0	0	0	112.4	W149 C151	W149-G153 CarbonylContact O-C 3.54Å; W149-G153 PolarHBondContact O-N 2.99Å; W149-G153 VanDerWaalsContact O-N 3.07Å; W149-G153 VanDerWaalsContact O-O 3.11Å; C151-G153 PolarHBondContact O-N 2.88Å
154	P	26.3	Very low	37.9	Very low	115 Å²	115	86 Å²	86	75%	0.747	45%	0.447	S	S	*	.	S	Bend	trans	-56.5	147.8	-178.8	24.8	-34.4	0	0	0	111.3	Y156	P154-Y156 PolarHBondContact O-N 3.19Å; P154-Y156 VanDerWaalsContact O-N 3.11Å
155	P	33.4	Very low	37	Very low	102 Å²	102	88.9 Å²	88.9	66%	0.662	46%	0.456	S	S	*	.			trans	-53.3	119.4	-165.8	17.9	-31.8	0	0	0	112.3	W149 N157	W149-P155 HydrophobicContact CH2-CB 4.38Å; W149-P155 HydrophobicContact CZ3-CB 4.07Å; P155-N157 VanDerWaalsContact C-N 3.31Å; P155-N157 PolarHBondContact O-N 3.47Å
156	Y	28.9	Very low	36.5	Very low	152 Å²	152	91.1 Å²	91.1	60%	0.596	46%	0.464	S	S	*	.			trans	-63.4	87.9	178.1	-97.3	-97.1	0	0	0	110.3	P154 Q158 M161	P154-Y156 PolarHBondContact O-N 3.19Å; P154-Y156 VanDerWaalsContact O-N 3.11Å; Y156-Q158 PolarHBondContact O-N 3.1Å; Y156-M161 HydrophobicContact CD1-CE 3.78Å; Y156-M161 HydrophobicContact CE1-CE 4.01Å
157	N	34.6	Very low	36	Very low	92 Å²	92	91.7 Å²	91.7	49%	0.492	46%	0.464	S	S	.	.			trans	-65.5	114.7	165.8	177	-1.3	0	0	0	108.5	P155 A159 S160 M161	P155-N157 VanDerWaalsContact C-N 3.31Å; P155-N157 PolarHBondContact O-N 3.47Å; N157-A159 VanDerWaalsContact C-N 3.26Å; N157-A159 PolarHBondContact O-N 2.87Å; N157-A159 WeakPolarHBondContact OD1-CB 3.46Å; N157-A159 PolarHBondContact OD1-N 2.8Å; N157-A159 VanDerWaalsContact OD1-N 3.08Å; N157-S160 WeakPolarHBondContact CB-OG 3.24Å; N157-S160 PolarHBondContact ND2-OG 3.1Å; N157-S160 WeakPolarHBondContact O-CA 3.37Å; N157-S160 VanDerWaalsContact O-CB 3.31Å; N157-S160 WeakPolarHBondContact O-CB 3.36Å; N157-S160 PolarHBondContact O-N 3.46Å; N157-M161 PolarHBondContact O-N 2.95Å
158	Q	33.9	Very low	35.1	Very low	155 Å²	155	94 Å²	94	72%	0.724	48%	0.48	S	S	*	.	H	α-helix	trans	-57	-39.1	-177.2	-162.3	167.7	0.4	0	0	112.1	Y156 S160 M161 E162	Y156-Q158 PolarHBondContact O-N 3.1Å; Q158-S160 VanDerWaalsContact C-N 3.32Å; Q158-S160 PolarHBondContact O-N 2.86Å; Q158-M161 WeakPolarHBondContact O-CB 3.29Å; Q158-M161 PolarHBondContact O-N 3.13Å; Q158-E162 PolarHBondContact O-N 3.23Å
159	A	34.6	Very low	34.4	Very low	54 Å²	54	97.6 Å²	97.6	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-30.8	175.2	0	0	0	0	0	113	N157 M161 Q163	N157-A159 VanDerWaalsContact C-N 3.26Å; N157-A159 PolarHBondContact O-N 2.87Å; N157-A159 WeakPolarHBondContact OD1-CB 3.46Å; N157-A159 PolarHBondContact OD1-N 2.8Å; N157-A159 VanDerWaalsContact OD1-N 3.08Å; A159-M161 VanDerWaalsContact C-N 3.29Å; A159-Q163 PolarHBondContact O-N 3.41Å
160	S	36.6	Very low	33.8	Very low	46 Å²	46	101.6 Å²	101.6	32%	0.322	53%	0.525	S	S	.	.	H	α-helix	trans	-71.6	-24.4	172.6	-57.3	0	0	0	0	112.5	N157 Q158 K164	N157-S160 WeakPolarHBondContact CB-OG 3.24Å; N157-S160 PolarHBondContact ND2-OG 3.1Å; N157-S160 WeakPolarHBondContact O-CA 3.37Å; N157-S160 VanDerWaalsContact O-CB 3.31Å; N157-S160 WeakPolarHBondContact O-CB 3.36Å; N157-S160 PolarHBondContact O-N 3.46Å; Q158-S160 VanDerWaalsContact C-N 3.32Å; Q158-S160 PolarHBondContact O-N 2.86Å; S160-K164 VanDerWaalsContact O-CB 3.28Å; S160-K164 WeakPolarHBondContact O-CB 3.06Å; S160-K164 VanDerWaalsContact O-CG 3.31Å; S160-K164 WeakPolarHBondContact O-CG 3.47Å; S160-K164 PolarHBondContact O-N 3.04Å
161	M	33.8	Very low	33.3	Very low	82 Å²	82	109.2 Å²	109.2	40%	0.404	55%	0.549	S	S	.	.	H	α-helix	trans	-74.3	-43.8	176.9	-153.2	-155	-64.4	0	0	111.2	Y156 N157 Q158 A159 Q163 K164 F165	Y156-M161 HydrophobicContact CD1-CE 3.78Å; Y156-M161 HydrophobicContact CE1-CE 4.01Å; N157-M161 PolarHBondContact O-N 2.95Å; Q158-M161 WeakPolarHBondContact O-CB 3.29Å; Q158-M161 PolarHBondContact O-N 3.13Å; A159-M161 VanDerWaalsContact C-N 3.29Å; M161-Q163 PolarHBondContact O-N 3.44Å; M161-K164 PolarHBondContact O-N 2.94Å; M161-F165 HydrophobicContact CG-CD2 4.15Å; M161-F165 WeakPolarHBondContact O-CB 3.44Å; M161-F165 PolarHBondContact O-N 3.2Å; M161-F165 HydrophobicContact SD-CD2 4.21Å; M161-F165 HydrophobicContact SD-CE2 4.24Å
162	E	34.6	Very low	32.3	Very low	138 Å²	138	117.7 Å²	117.7	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-59.5	-44.6	176.2	-67.7	179.9	152.8	0	0	111.8	Q158 Q166	Q158-E162 PolarHBondContact O-N 3.23Å; E162-Q166 WeakPolarHBondContact O-CG 3.37Å; E162-Q166 PolarHBondContact O-N 2.9Å
163	Q	33.9	Very low	31.6	Very low	136 Å²	136	121 Å²	121	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-64.9	-40.7	174.4	-72.7	-172.1	-15.6	0	0	112.8	A159 M161 Q167	A159-Q163 PolarHBondContact O-N 3.41Å; M161-Q163 PolarHBondContact O-N 3.44Å; Q163-Q167 WeakPolarHBondContact O-CG 3.38Å; Q163-Q167 PolarHBondContact O-N 2.9Å
164	K	30.8	Very low	31.4	Very low	140 Å²	140	125.8 Å²	125.8	61%	0.609	62%	0.623	S	S	*	*	H	α-helix	trans	-74	-35.3	179.6	-77.1	-177.9	177	-178.2	0	113.1	S160 M161 Q166 Q167 T168	S160-K164 VanDerWaalsContact O-CB 3.28Å; S160-K164 WeakPolarHBondContact O-CB 3.06Å; S160-K164 VanDerWaalsContact O-CG 3.31Å; S160-K164 WeakPolarHBondContact O-CG 3.47Å; S160-K164 PolarHBondContact O-N 3.04Å; M161-K164 PolarHBondContact O-N 2.94Å; K164-Q166 VanDerWaalsContact C-N 3.29Å; K164-Q166 PolarHBondContact O-N 2.71Å; K164-Q167 CarbonylContact O-C 3.59Å; K164-Q167 PolarHBondContact O-N 3.49Å; K164-T168 PolarHBondContact O-N 2.98Å; K164-T168 PolarHBondContact O-OG1 3.01Å; K164-T168 VanDerWaalsContact O-OG1 3.11Å
165	F	28.2	Very low	31.6	Very low	140 Å²	140	125 Å²	125	61%	0.614	62%	0.62	S	S	*	*	H	α-helix	trans	-61.9	-37.9	174.5	-117	-89.1	0	0	0	111.5	M161 Q167 S169	M161-F165 HydrophobicContact CG-CD2 4.15Å; M161-F165 WeakPolarHBondContact O-CB 3.44Å; M161-F165 PolarHBondContact O-N 3.2Å; M161-F165 HydrophobicContact SD-CD2 4.21Å; M161-F165 HydrophobicContact SD-CE2 4.24Å; F165-Q167 PolarHBondContact O-N 2.69Å; F165-S169 VanDerWaalsContact O-CB 3.26Å; F165-S169 WeakPolarHBondContact O-CB 3.35Å; F165-S169 PolarHBondContact O-N 3.47Å; F165-S169 VanDerWaalsContact O-N 3.16Å; F165-S169 PolarHBondContact O-OG 3.1Å
166	Q	33.5	Very low	31.2	Very low	131 Å²	131	124.2 Å²	124.2	61%	0.612	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-16	172.8	-69.4	-169.4	14.6	0	0	114.2	E162 K164 K170	E162-Q166 WeakPolarHBondContact O-CG 3.37Å; E162-Q166 PolarHBondContact O-N 2.9Å; K164-Q166 VanDerWaalsContact C-N 3.29Å; K164-Q166 PolarHBondContact O-N 2.71Å; Q166-K170 WeakPolarHBondContact O-CD 3.45Å; Q166-K170 WeakPolarHBondContact O-CG 3.3Å
167	Q	30.9	Very low	31.2	Very low	132 Å²	132	126.1 Å²	126.1	62%	0.617	63%	0.629	S	S	*	*	H	α-helix	trans	-97.3	-36.3	177	-70.9	-178.7	6.3	0	0	112.9	Q163 K164 F165 K170	Q163-Q167 WeakPolarHBondContact O-CG 3.38Å; Q163-Q167 PolarHBondContact O-N 2.9Å; K164-Q167 CarbonylContact O-C 3.59Å; K164-Q167 PolarHBondContact O-N 3.49Å; F165-Q167 PolarHBondContact O-N 2.69Å; Q167-K170 PolarHBondContact O-N 3.35Å
168	T	29.3	Very low	30.8	Very low	87 Å²	87	128.2 Å²	128.2	53%	0.534	64%	0.639	S	S	.	*	H	α-helix	trans	-75.2	-36.9	177.5	53.2	0	0	0	0	112.2	K164 K170 R171 R172	K164-T168 PolarHBondContact O-N 2.98Å; K164-T168 PolarHBondContact O-OG1 3.01Å; K164-T168 VanDerWaalsContact O-OG1 3.11Å; T168-K170 PolarHBondContact O-N 3.46Å; T168-R171 PolarHBondContact O-N 3.09Å; T168-R171 VanDerWaalsContact O-N 3.1Å; T168-R172 PolarHBondContact O-N 3.48Å
169	S	30.8	Very low	30.5	Very low	79 Å²	79	129.5 Å²	129.5	55%	0.552	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-19.4	172.4	55.1	0	0	0	0	114.1	F165	F165-S169 VanDerWaalsContact O-CB 3.26Å; F165-S169 WeakPolarHBondContact O-CB 3.35Å; F165-S169 PolarHBondContact O-N 3.47Å; F165-S169 VanDerWaalsContact O-N 3.16Å; F165-S169 PolarHBondContact O-OG 3.1Å
170	K	31.4	Very low	30	Very low	171 Å²	171	136.2 Å²	136.2	74%	0.743	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-2.9	176	-68.7	-178	-178.3	178.6	0	114.5	Q166 Q167 T168	Q166-K170 WeakPolarHBondContact O-CD 3.45Å; Q166-K170 WeakPolarHBondContact O-CG 3.3Å; Q167-K170 PolarHBondContact O-N 3.35Å; T168-K170 PolarHBondContact O-N 3.46Å
171	R	29.1	Very low	29.5	Very low	231 Å²	231	137.3 Å²	137.3	87%	0.872	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	3.9	-174.3	-81.8	-167.6	172.2	-162.4	-1.1	116.1	T168	T168-R171 PolarHBondContact O-N 3.09Å; T168-R171 VanDerWaalsContact O-N 3.1Å
172	R	27.1	Very low	29.3	Very low	211 Å²	211	143.5 Å²	143.5	80%	0.796	70%	0.702	S	S	*	*	S	Bend	trans	-124.2	137.3	164.8	-78.5	-174.5	171.8	-179.3	-3	109.7	T168	T168-R172 PolarHBondContact O-N 3.48Å
173	N	27.7	Very low	28.8	Very low	124 Å²	124	145.5 Å²	145.5	66%	0.663	71%	0.711	S	S	*	*			trans	-50.2	128	178.2	-109.1	-16.2	0	0	0	110.1	S175	N173-S175 PolarHBondContact O-N 2.91Å
174	P	31	Very low	28.7	Very low	124 Å²	124	150.2 Å²	150.2	81%	0.805	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	8.2	-179.4	29.4	-35.2	0	0	0	113.8
175	S	29.5	Very low	28.5	Very low	98 Å²	98	149.5 Å²	149.5	69%	0.685	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	7.6	-174.1	65.4	0	0	0	0	115	N173	N173-S175 PolarHBondContact O-N 2.91Å
176	S	25.8	Very low	28.5	Very low	86 Å²	86	152.4 Å²	152.4	60%	0.601	74%	0.737	S	S	*	*			trans	-126.1	18.6	-175.3	78.5	0	0	0	0	115.2	I178	S176-I178 PolarHBondContact O-N 3.28Å
177	F	27.6	Very low	28.3	Very low	191 Å²	191	153.3 Å²	153.3	84%	0.838	74%	0.741	S	S	*	*			trans	-74.2	105	161	-96.4	-84.7	0	0	0	108.2	Q179	F177-Q179 PolarHBondContact O-N 2.96Å
178	I	26.4	Very low	28.3	Very low	136 Å²	136	155 Å²	155	70%	0.697	76%	0.755	S	S	*	*			trans	-67.2	101.1	168.9	-56.8	177.7	0	0	0	106.9	S176 F180	S176-I178 PolarHBondContact O-N 3.28Å; I178-F180 VanDerWaalsContact C-N 3.26Å; I178-F180 HydrophobicContact CG2-CD2 3.53Å; I178-F180 HydrophobicContact CG2-CE2 3.45Å; I178-F180 VanDerWaalsContact CG2-CE2 3.45Å; I178-F180 HydrophobicContact CG2-CG 4.42Å; I178-F180 HydrophobicContact CG2-CZ 4.26Å; I178-F180 PolarHBondContact O-N 3.47Å
179	Q	27.3	Very low	28.4	Very low	183 Å²	183	161.5 Å²	161.5	86%	0.855	77%	0.769	S	S	*	*			trans	-71.8	80.1	174.2	-74.5	-177.7	-43.7	0	0	110.2	F177 G181	F177-Q179 PolarHBondContact O-N 2.96Å; Q179-G181 PolarHBondContact O-N 3.25Å
180	F	25.2	Very low	28.5	Very low	194 Å²	194	164 Å²	164	85%	0.851	78%	0.784	S	S	*	*			trans	-75.7	112.8	156.9	-79.9	-69	0	0	0	108.7	I178	I178-F180 VanDerWaalsContact C-N 3.26Å; I178-F180 HydrophobicContact CG2-CD2 3.53Å; I178-F180 HydrophobicContact CG2-CE2 3.45Å; I178-F180 VanDerWaalsContact CG2-CE2 3.45Å; I178-F180 HydrophobicContact CG2-CG 4.42Å; I178-F180 HydrophobicContact CG2-CZ 4.26Å; I178-F180 PolarHBondContact O-N 3.47Å
181	G	25.6	Very low	29	Very low	69 Å²	69	162.3 Å²	162.3	71%	0.711	78%	0.782	S	S	*	*	S	Bend	trans	100.7	66.7	168.9	0	0	0	0	0	116.8	Q179	Q179-G181 PolarHBondContact O-N 3.25Å
182	R	29.3	Very low	29.3	Very low	212 Å²	212	157.6 Å²	157.6	80%	0.8	77%	0.772	S	S	*	*				-172.3	72.5	128.2	-103.7	170.7	-174.3	-166.1	1.4	112.5	R184	R182-R184 VanDerWaalsContact C-N 3.28Å; R182-R184 PolarHBondContact O-N 3.32Å
183	E	24.5	Very low	29.6	Very low	181 Å²	181	158.4 Å²	158.4	85%	0.846	78%	0.775	S	S	*	*			trans	-73.3	88.4	158	-167.4	166.2	-150.1	0	0	109.1	V185	E183-V185 HydrophobicContact CG-CG2 4.24Å
184	R	31.7	Very low	29.9	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	79%	0.787	S	S	*	*			trans	-120.1	69.8	154.7	-79.3	-163	177.9	-170	0.6	108.7	R182 R186	R182-R184 VanDerWaalsContact C-N 3.28Å; R182-R184 PolarHBondContact O-N 3.32Å; R184-R186 VanDerWaalsContact C-N 3.28Å; R184-R186 PolarHBondContact O-N 3.29Å
185	V	27.2	Very low	30.2	Very low	124 Å²	124	162.1 Å²	162.1	75%	0.752	82%	0.823	S	S	*	*			trans	-68.4	91.9	161.2	178.4	0	0	0	0	107.4	E183	E183-V185 HydrophobicContact CG-CG2 4.24Å
186	R	28.1	Very low	30.2	Very low	201 Å²	201	165.3 Å²	165.3	76%	0.758	83%	0.83	S	S	*	*			trans	-166.1	120.5	146.5	-112	-174.7	166.8	135.9	1.7	112.8	R184	R184-R186 VanDerWaalsContact C-N 3.28Å; R184-R186 PolarHBondContact O-N 3.29Å
187	E	29.4	Very low	30.4	Very low	151 Å²	151	169.5 Å²	169.5	71%	0.706	84%	0.842	S	S	*	*			trans	54	82.7	138.6	-65	158.2	-141.5	0	0	117.4
188	D	30.3	Very low	30.6	Very low	168 Å²	168	168.3 Å²	168.3	90%	0.898	84%	0.842	S	S	*	*				-158.6	125.6	119.3	-106.4	-25.6	0	0	0	111.1
189	R	31.6	Very low	30.8	Very low	222 Å²	222	170.2 Å²	170.2	84%	0.838	85%	0.851	S	S	*	*			trans	-115.5	147.7	170.7	-62	-172.1	-172	-155.1	3.4	108.4
190	P	33.3	Very low	31	Very low	132 Å²	132	169.4 Å²	169.4	86%	0.857	85%	0.85	S	S	*	*				-130	150.5	117.1	31.6	-22.3	0	0	0	114.9
191	I	41.4	Very low	31.4	Very low	136 Å²	136	167.7 Å²	167.7	70%	0.697	85%	0.85	S	S	*	*			trans	-96.2	156.5	169.4	2.7	174.2	0	0	0	107
192	I	36	Very low	31.9	Very low	132 Å²	132	174.8 Å²	174.8	68%	0.677	86%	0.86	S	S	*	*			cis	-147.1	-166.6	29.4	0.8	168.7	0	0	0	108.7
193	R	32.1	Very low	32.1	Very low	227 Å²	227	171.9 Å²	171.9	86%	0.857	87%	0.865	S	S	*	*			cis	-156.9	154.2	43.3	-78.7	-177.1	174.7	-168.3	-2.7	113.6
194	L	35.2	Very low	32.7	Very low	175 Å²	175	171.2 Å²	171.2	92%	0.916	87%	0.867	S	S	*	*			trans	-73.7	152.8	173.8	-67.1	158.1	0	0	0	112
195	G	36	Very low	32.8	Very low	151 Å²	151	165.4 Å²	165.4	100%	1.557	87%	0.865	S	S	*	*			trans	-146.8	0	162.4	0	0	0	0	0	108.5

Retrieved 195 of 195 residues in 49.2 ms (Link to these results)

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