A0A077ZCU2_TRITR Loading...

Transient receptor potential cation channel, subf amily C, member 3

AlphaFold DB , UniProt , Accession A0A077ZCU2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 151 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.5	Very low	50.6	Low	195 Å²	195	124.6 Å²	124.6	96%	0.961	57%	0.565	S	S	*	*				0	-36.1	0	-74.7	-66.4	-134.2	0	0	112.1	W3 K4	M1-W3 PolarHBondContact O-N 3.41Å; M1-K4 PolarHBondContact O-N 3.06Å
2	E	55.7	Low	50.6	Low	164 Å²	164	129.3 Å²	129.3	77%	0.766	58%	0.575	S	S	*	*	H	α-helix	trans	-58.6	-38.7	-173	-62.5	171.3	165.5	0	0	115.2	K4 Y5 V6	E2-K4 VanDerWaalsContact C-N 3.27Å; E2-K4 PolarHBondContact O-N 3.37Å; E2-Y5 WeakPolarHBondContact O-CB 3.42Å; E2-Y5 PolarHBondContact O-N 3.45Å; E2-Y5 VanDerWaalsContact O-N 3.08Å; E2-V6 WeakPolarHBondContact O-CG2 3.44Å; E2-V6 PolarHBondContact O-N 3.48Å
3	W	46	Very low	50.9	Low	139 Å²	139	125.6 Å²	125.6	53%	0.527	56%	0.56	S	S	.	*	H	α-helix	trans	-62.7	-29.2	-177.4	71	-98.3	0	0	0	114.5	M1 R7	M1-W3 PolarHBondContact O-N 3.41Å; W3-R7 PolarHBondContact O-N 3.46Å
4	K	44.8	Very low	51	Low	121 Å²	121	120.4 Å²	120.4	53%	0.526	54%	0.536	S	S	.	.	H	α-helix	trans	-72.4	-39	176.6	-68.4	-174.8	178.7	179.6	0	110.6	M1 E2 R7 C8	M1-K4 PolarHBondContact O-N 3.06Å; E2-K4 VanDerWaalsContact C-N 3.27Å; E2-K4 PolarHBondContact O-N 3.37Å; K4-R7 PolarHBondContact O-N 2.94Å; K4-C8 PolarHBondContact O-N 3.31Å; K4-C8 PolarHBondContact O-SG 2.92Å
5	Y	49.4	Very low	51.1	Low	171 Å²	171	119.9 Å²	119.9	67%	0.671	53%	0.534	S	S	*	.	H	α-helix	trans	-66.5	-45.9	178.8	-169.7	-93.8	0	0	0	111.3	E2 R7 C8 Q9	E2-Y5 WeakPolarHBondContact O-CB 3.42Å; E2-Y5 PolarHBondContact O-N 3.45Å; E2-Y5 VanDerWaalsContact O-N 3.08Å; Y5-R7 VanDerWaalsContact C-N 3.32Å; Y5-R7 PolarHBondContact O-N 3Å; Y5-C8 PolarHBondContact O-N 3.23Å; Y5-C8 VanDerWaalsContact O-N 3.12Å; Y5-Q9 PolarHBondContact O-N 3.25Å
6	V	47.7	Very low	51.2	Low	63 Å²	63	120.4 Å²	120.4	38%	0.382	54%	0.538	S	S	.	.	H	α-helix	trans	-60.6	-41.1	176.8	176.1	0	0	0	0	111.3	E2 Q9 I10	E2-V6 WeakPolarHBondContact O-CG2 3.44Å; E2-V6 PolarHBondContact O-N 3.48Å; V6-Q9 PolarHBondContact O-N 3.27Å; V6-I10 HydrophobicContact CG1-CD1 3.84Å; V6-I10 HydrophobicContact CG1-CG1 4.47Å; V6-I10 VanDerWaalsContact O-CG1 3.23Å; V6-I10 WeakPolarHBondContact O-CG1 3.39Å; V6-I10 PolarHBondContact O-N 3.49Å
7	R	49.9	Very low	51.2	Low	144 Å²	144	119.5 Å²	119.5	54%	0.543	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-47.1	173.4	-82	-173.7	174	-174.8	1.2	111.9	W3 K4 Y5 Q9 I10 W11	W3-R7 PolarHBondContact O-N 3.46Å; K4-R7 PolarHBondContact O-N 2.94Å; Y5-R7 VanDerWaalsContact C-N 3.32Å; Y5-R7 PolarHBondContact O-N 3Å; R7-Q9 VanDerWaalsContact C-N 3.28Å; R7-Q9 PolarHBondContact O-N 2.99Å; R7-I10 PolarHBondContact O-N 2.91Å; R7-W11 WeakPolarHBondContact O-CB 3.49Å; R7-W11 PolarHBondContact O-N 3Å
8	C	46.7	Very low	51.1	Low	86 Å²	86	113.9 Å²	113.9	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-60.6	-39.3	177.6	-73.6	0	0	0	0	112.1	K4 Y5 W11 W12	K4-C8 PolarHBondContact O-N 3.31Å; K4-C8 PolarHBondContact O-SG 2.92Å; Y5-C8 PolarHBondContact O-N 3.23Å; Y5-C8 VanDerWaalsContact O-N 3.12Å; C8-W11 PolarHBondContact O-N 3.39Å; C8-W12 VanDerWaalsContact O-CB 3.3Å; C8-W12 WeakPolarHBondContact O-CB 3.49Å; C8-W12 PolarHBondContact O-N 3.42Å
9	Q	57.6	Low	51.1	Low	94 Å²	94	119.4 Å²	119.4	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-45.9	177.8	-171.2	-179.4	-26.7	0	0	111.9	Y5 V6 R7 W11 W12 E13	Y5-Q9 PolarHBondContact O-N 3.25Å; V6-Q9 PolarHBondContact O-N 3.27Å; R7-Q9 VanDerWaalsContact C-N 3.28Å; R7-Q9 PolarHBondContact O-N 2.99Å; Q9-W11 VanDerWaalsContact C-N 3.32Å; Q9-W11 PolarHBondContact O-N 3.48Å; Q9-W12 WeakPolarHBondContact O-CB 3.42Å; Q9-W12 PolarHBondContact O-N 3.26Å; Q9-W12 VanDerWaalsContact O-N 3.13Å; Q9-E13 PolarHBondContact NE2-OE1 3.45Å; Q9-E13 WeakPolarHBondContact O-CG 3.31Å; Q9-E13 PolarHBondContact O-N 2.95Å
10	I	55.2	Low	51.4	Low	65 Å²	65	117.8 Å²	117.8	33%	0.333	54%	0.542	S	S	.	.	H	α-helix	trans	-61.4	-43.2	175.8	-65.4	166.9	0	0	0	110.7	V6 R7 W12 F14 W52	V6-I10 HydrophobicContact CG1-CD1 3.84Å; V6-I10 HydrophobicContact CG1-CG1 4.47Å; V6-I10 VanDerWaalsContact O-CG1 3.23Å; V6-I10 WeakPolarHBondContact O-CG1 3.39Å; V6-I10 PolarHBondContact O-N 3.49Å; R7-I10 PolarHBondContact O-N 2.91Å; I10-W12 VanDerWaalsContact C-N 3.31Å; I10-W12 PolarHBondContact O-N 3.22Å; I10-F14 WeakPolarHBondContact O-CB 3.49Å; I10-F14 PolarHBondContact O-N 3.09Å; I10-W52 HydrophobicContact CD1-CE3 4.25Å; I10-W52 HydrophobicContact CD1-CZ3 4.12Å; I10-W52 HydrophobicContact CG1-CE3 4.38Å; I10-W52 HydrophobicContact CG1-CZ3 3.75Å; I10-W52 HydrophobicContact CG2-CZ3 4.33Å
11	W	53.9	Low	51.5	Low	129 Å²	129	114.5 Å²	114.5	49%	0.489	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-37.3	175.9	-89.1	94.2	0	0	0	111.8	R7 C8 Q9 F15 F30	R7-W11 WeakPolarHBondContact O-CB 3.49Å; R7-W11 PolarHBondContact O-N 3Å; C8-W11 PolarHBondContact O-N 3.39Å; Q9-W11 VanDerWaalsContact C-N 3.32Å; Q9-W11 PolarHBondContact O-N 3.48Å; W11-F15 HydrophobicContact CD2-CE2 4.31Å; W11-F15 AromaticContact CE3-CD2 3.77Å; W11-F15 HydrophobicContact CE3-CD2 3.77Å; W11-F15 AromaticContact CE3-CE2 3.14Å; W11-F15 HydrophobicContact CE3-CE2 3.14Å; W11-F15 AromaticContact CE3-CZ 3.8Å; W11-F15 HydrophobicContact CE3-CZ 3.8Å; W11-F15 HydrophobicContact CZ3-CD2 4.4Å; W11-F15 AromaticContact CZ3-CE2 3.43Å; W11-F15 HydrophobicContact CZ3-CE2 3.43Å; W11-F15 VanDerWaalsContact CZ3-CE2 3.43Å; W11-F15 AromaticContact CZ3-CZ 3.57Å; W11-F15 HydrophobicContact CZ3-CZ 3.57Å; W11-F15 WeakPolarHBondContact O-CB 3.23Å; W11-F15 WeakPolarHBondContact O-CD2 3.37Å; W11-F15 PolarHBondContact O-N 3.12Å; W11-F30 HydrophobicContact CH2-CE2 4.39Å
12	W	51.1	Low	51.8	Low	181 Å²	181	106.7 Å²	106.7	69%	0.686	49%	0.492	S	S	*	.	H	α-helix	trans	-67.9	-50.6	178.4	-165	-87.1	0	0	0	111.6	C8 Q9 I10 F14 F15 E16	C8-W12 VanDerWaalsContact O-CB 3.3Å; C8-W12 WeakPolarHBondContact O-CB 3.49Å; C8-W12 PolarHBondContact O-N 3.42Å; Q9-W12 WeakPolarHBondContact O-CB 3.42Å; Q9-W12 PolarHBondContact O-N 3.26Å; Q9-W12 VanDerWaalsContact O-N 3.13Å; I10-W12 VanDerWaalsContact C-N 3.31Å; I10-W12 PolarHBondContact O-N 3.22Å; W12-F14 VanDerWaalsContact C-N 3.28Å; W12-F14 PolarHBondContact O-N 3.22Å; W12-F15 PolarHBondContact O-N 2.88Å; W12-E16 VanDerWaalsContact O-CB 3.32Å; W12-E16 WeakPolarHBondContact O-CB 3.32Å; W12-E16 PolarHBondContact O-N 2.76Å
13	E	54	Low	51.8	Low	81 Å²	81	104 Å²	104	38%	0.379	49%	0.489	S	S	.	.	H	α-helix	trans	-57.6	-42	174.6	-71.3	171.7	-167.8	0	0	110.7	Q9 E16 D17	Q9-E13 PolarHBondContact NE2-OE1 3.45Å; Q9-E13 WeakPolarHBondContact O-CG 3.31Å; Q9-E13 PolarHBondContact O-N 2.95Å; E13-E16 PolarHBondContact O-N 3.41Å; E13-D17 PolarHBondContact O-N 3.34Å; E13-D17 VanDerWaalsContact O-N 3.11Å
14	F	52.1	Low	52.6	Low	52 Å²	52	101.6 Å²	101.6	23%	0.228	49%	0.491	C	S	.	.	H	α-helix	trans	-66.8	-39.2	177	-166.5	-94.5	0	0	0	112.9	I10 W12 C18 F30 H33	I10-F14 WeakPolarHBondContact O-CB 3.49Å; I10-F14 PolarHBondContact O-N 3.09Å; W12-F14 VanDerWaalsContact C-N 3.28Å; W12-F14 PolarHBondContact O-N 3.22Å; F14-C18 VanDerWaalsContact CE1-SG 3.54Å; F14-C18 WeakPolarHBondContact O-CB 3.44Å; F14-C18 PolarHBondContact O-N 3.47Å; F14-C18 PolarHBondContact O-SG 3.39Å; F14-F30 HydrophobicContact CE1-CD2 4.21Å; F14-H33 HydrophobicContact CE2-CB 4.2Å; F14-H33 AromaticContact CE2-CD2 3.89Å; F14-H33 HydrophobicContact CZ-CB 4.36Å
15	F	53	Low	53.4	Low	114 Å²	114	97.4 Å²	97.4	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-74.6	-29.6	176.8	-86.9	-59.9	0	0	0	113.2	W11 W12 C18 R19	W11-F15 HydrophobicContact CD2-CE2 4.31Å; W11-F15 AromaticContact CE3-CD2 3.77Å; W11-F15 HydrophobicContact CE3-CD2 3.77Å; W11-F15 AromaticContact CE3-CE2 3.14Å; W11-F15 HydrophobicContact CE3-CE2 3.14Å; W11-F15 AromaticContact CE3-CZ 3.8Å; W11-F15 HydrophobicContact CE3-CZ 3.8Å; W11-F15 HydrophobicContact CZ3-CD2 4.4Å; W11-F15 AromaticContact CZ3-CE2 3.43Å; W11-F15 HydrophobicContact CZ3-CE2 3.43Å; W11-F15 VanDerWaalsContact CZ3-CE2 3.43Å; W11-F15 AromaticContact CZ3-CZ 3.57Å; W11-F15 HydrophobicContact CZ3-CZ 3.57Å; W11-F15 WeakPolarHBondContact O-CB 3.23Å; W11-F15 WeakPolarHBondContact O-CD2 3.37Å; W11-F15 PolarHBondContact O-N 3.12Å; W12-F15 PolarHBondContact O-N 2.88Å; F15-C18 PolarHBondContact O-N 3.42Å; F15-R19 WeakPolarHBondContact O-CG 3.48Å; F15-R19 PolarHBondContact O-N 3.25Å; F15-R19 VanDerWaalsContact O-N 3.14Å
16	E	52	Low	53.9	Low	127 Å²	127	90.5 Å²	90.5	59%	0.593	45%	0.449	S	S	*	.	H	α-helix	trans	-65.4	-43.7	174	-162.7	161.2	-163.2	0	0	110.3	W12 E13 R19	W12-E16 VanDerWaalsContact O-CB 3.32Å; W12-E16 WeakPolarHBondContact O-CB 3.32Å; W12-E16 PolarHBondContact O-N 2.76Å; E13-E16 PolarHBondContact O-N 3.41Å; E16-R19 PolarHBondContact O-N 3.25Å
17	D	52.4	Low	54.6	Low	105 Å²	105	91.7 Å²	91.7	56%	0.561	46%	0.456	S	S	*	.	H	α-helix	trans	-67.7	-39.4	171.4	-83.5	-20.8	0	0	0	113	E13 R19 A20	E13-D17 PolarHBondContact O-N 3.34Å; E13-D17 VanDerWaalsContact O-N 3.11Å; D17-R19 PolarHBondContact O-N 3.3Å; D17-A20 WeakPolarHBondContact O-CB 3.35Å; D17-A20 PolarHBondContact O-N 3.28Å; D17-A20 VanDerWaalsContact O-N 3.07Å
18	C	48.3	Very low	55.4	Low	19 Å²	19	89.4 Å²	89.4	13%	0.128	46%	0.455	C	S	.	.	H	α-helix	trans	-65.8	-19.6	178	-72.8	0	0	0	0	113.4	F14 F15 A20 C26	F14-C18 VanDerWaalsContact CE1-SG 3.54Å; F14-C18 WeakPolarHBondContact O-CB 3.44Å; F14-C18 PolarHBondContact O-N 3.47Å; F14-C18 PolarHBondContact O-SG 3.39Å; F15-C18 PolarHBondContact O-N 3.42Å; C18-A20 VanDerWaalsContact C-N 3.31Å; C18-C26 HydrophobicContact CB-CB 4.48Å; C18-C26 PolarHBondContact O-SG 3.32Å
19	R	52.1	Low	56.3	Low	219 Å²	219	87.7 Å²	87.7	83%	0.826	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.6	174.1	-81	176.7	164.2	168.6	-2.6	113	F15 E16 D17 L21	F15-R19 WeakPolarHBondContact O-CG 3.48Å; F15-R19 PolarHBondContact O-N 3.25Å; F15-R19 VanDerWaalsContact O-N 3.14Å; E16-R19 PolarHBondContact O-N 3.25Å; D17-R19 PolarHBondContact O-N 3.3Å; R19-L21 VanDerWaalsContact C-N 3.35Å
20	A	57.3	Low	56.7	Low	87 Å²	87	88.9 Å²	88.9	72%	0.719	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-17.8	175.3	0	0	0	0	0	112.9	D17 C18	D17-A20 WeakPolarHBondContact O-CB 3.35Å; D17-A20 PolarHBondContact O-N 3.28Å; D17-A20 VanDerWaalsContact O-N 3.07Å; C18-A20 VanDerWaalsContact C-N 3.31Å
21	L	52.3	Low	57.6	Low	49 Å²	49	90.3 Å²	90.3	26%	0.257	45%	0.45	S	S	.	.	S	Bend	trans	-102.9	144.8	-179.9	-75.5	103.9	0	0	0	112.5	R19 F25 C26	R19-L21 VanDerWaalsContact C-N 3.35Å; L21-F25 HydrophobicContact CB-CB 4.21Å; L21-F25 HydrophobicContact CD2-CB 3.78Å; L21-C26 PolarHBondContact O-SG 3.1Å
22	P	55.4	Low	58.3	Low	31 Å²	31	86.5 Å²	86.5	20%	0.201	44%	0.441	C	S	.	.			trans	-64.3	146.8	176.1	-8.8	19.9	0	0	0	110.7	P24 F25 C26 Q115	P22-P24 VanDerWaalsContact C-N 3.31Å; P22-P24 HydrophobicContact CB-CG 4.41Å; P22-P24 VanDerWaalsContact O-CD 3.31Å; P22-P24 WeakPolarHBondContact O-CD 3.38Å; P22-F25 HydrophobicContact CB-CD2 4.08Å; P22-F25 HydrophobicContact CG-CD2 3.75Å; P22-F25 HydrophobicContact CG-CE2 4.16Å; P22-F25 PolarHBondContact O-N 3.17Å; P22-C26 PolarHBondContact O-N 3.36Å; P22-C26 PolarHBondContact O-SG 3.47Å; P22-Q115 HydrophobicContact CG-CG 4.35Å
23	P	56.2	Low	59.1	Low	108 Å²	108	82.1 Å²	82.1	70%	0.701	43%	0.428	S	S	*	.	H	α-helix	trans	-42.7	-36.6	-176.4	-29.4	33.6	0	0	0	118	F25	P23-F25 VanDerWaalsContact C-N 3.34Å; P23-F25 PolarHBondContact O-N 2.9Å
24	P	62.2	Low	60	Low	87 Å²	87	79.9 Å²	79.9	57%	0.565	43%	0.426	S	S	*	.	H	α-helix	trans	-69.7	-26.1	176.3	25.6	-36.2	0	0	0	114.5	P22	P22-P24 VanDerWaalsContact C-N 3.31Å; P22-P24 HydrophobicContact CB-CG 4.41Å; P22-P24 VanDerWaalsContact O-CD 3.31Å; P22-P24 WeakPolarHBondContact O-CD 3.38Å
25	F	62.5	Low	61	Low	34 Å²	34	81 Å²	81	15%	0.149	44%	0.437	C	S	.	.	H	α-helix	trans	-85.1	-29.9	-179	-66.7	-81	0	0	0	112.2	L21 P22 P23 V27 L28 Q29 L88 L112	L21-F25 HydrophobicContact CB-CB 4.21Å; L21-F25 HydrophobicContact CD2-CB 3.78Å; P22-F25 HydrophobicContact CB-CD2 4.08Å; P22-F25 HydrophobicContact CG-CD2 3.75Å; P22-F25 HydrophobicContact CG-CE2 4.16Å; P22-F25 PolarHBondContact O-N 3.17Å; P23-F25 VanDerWaalsContact C-N 3.34Å; P23-F25 PolarHBondContact O-N 2.9Å; F25-V27 VanDerWaalsContact C-N 3.25Å; F25-V27 PolarHBondContact O-N 3.27Å; F25-L28 HydrophobicContact CD1-CD1 4.49Å; F25-L28 PolarHBondContact O-N 3.08Å; F25-Q29 WeakPolarHBondContact O-CB 3.39Å; F25-Q29 PolarHBondContact O-N 3.27Å; F25-L88 HydrophobicContact CE1-CD1 3.93Å; F25-L88 HydrophobicContact CE1-CD2 4.14Å; F25-L112 HydrophobicContact CE2-CD2 3.95Å; F25-L112 HydrophobicContact CZ-CD2 3.75Å
26	C	59.4	Low	61.7	Low	25 Å²	25	78.2 Å²	78.2	17%	0.169	43%	0.43	C	S	.	.	H	α-helix	trans	-61.7	-36	176.4	-48.3	0	0	0	0	111.5	C18 L21 P22 F30	C18-C26 HydrophobicContact CB-CB 4.48Å; C18-C26 PolarHBondContact O-SG 3.32Å; L21-C26 PolarHBondContact O-SG 3.1Å; P22-C26 PolarHBondContact O-N 3.36Å; P22-C26 PolarHBondContact O-SG 3.47Å; C26-F30 VanDerWaalsContact O-CB 3.31Å; C26-F30 WeakPolarHBondContact O-CB 3.22Å; C26-F30 PolarHBondContact O-N 3.35Å
27	V	63.1	Low	62.3	Low	88 Å²	88	79.1 Å²	79.1	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-70.4	-41.4	176.1	-178.4	0	0	0	0	111.5	F25 Q29 F30 L31	F25-V27 VanDerWaalsContact C-N 3.25Å; F25-V27 PolarHBondContact O-N 3.27Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; V27-F30 PolarHBondContact O-N 2.82Å; V27-L31 HydrophobicContact CG1-CD1 4.23Å; V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 WeakPolarHBondContact O-CG 3.38Å; V27-L31 PolarHBondContact O-N 3.32Å
28	L	67.5	Low	63.1	Low	97 Å²	97	76.1 Å²	76.1	51%	0.508	42%	0.418	S	S	.	.	H	α-helix	trans	-64	-40.7	175.1	-74.3	170.1	0	0	0	111.3	F25 L31 V32	F25-L28 HydrophobicContact CD1-CD1 4.49Å; F25-L28 PolarHBondContact O-N 3.08Å; L28-L31 PolarHBondContact O-N 2.93Å; L28-V32 WeakPolarHBondContact O-CB 3.35Å; L28-V32 VanDerWaalsContact O-CG2 3.24Å; L28-V32 WeakPolarHBondContact O-CG2 3.33Å; L28-V32 PolarHBondContact O-N 3.29Å
29	Q	64.3	Low	64	Low	50 Å²	50	80 Å²	80	23%	0.234	44%	0.437	C	S	.	.	H	α-helix	trans	-65.4	-43.7	176.1	-167	155.2	-13.6	0	0	110.7	F25 V27 L31 V32 H33	F25-Q29 WeakPolarHBondContact O-CB 3.39Å; F25-Q29 PolarHBondContact O-N 3.27Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; Q29-L31 PolarHBondContact O-N 3.47Å; Q29-V32 PolarHBondContact O-N 3.48Å; Q29-H33 WeakPolarHBondContact CG-CD2 3.42Å; Q29-H33 WeakPolarHBondContact O-CB 3.5Å; Q29-H33 PolarHBondContact O-CD2 2.87Å; Q29-H33 PolarHBondContact O-N 2.87Å
30	F	66.8	Low	64.3	Low	118 Å²	118	75.5 Å²	75.5	52%	0.518	42%	0.42	S	S	.	.	H	α-helix	trans	-60.5	-42.2	173	-172.9	-94.2	0	0	0	112.5	W11 F14 C26 V27 G34	W11-F30 HydrophobicContact CH2-CE2 4.39Å; F14-F30 HydrophobicContact CE1-CD2 4.21Å; C26-F30 VanDerWaalsContact O-CB 3.31Å; C26-F30 WeakPolarHBondContact O-CB 3.22Å; C26-F30 PolarHBondContact O-N 3.35Å; V27-F30 PolarHBondContact O-N 2.82Å; F30-G34 VanDerWaalsContact O-CA 3.31Å; F30-G34 WeakPolarHBondContact O-CA 3.36Å; F30-G34 PolarHBondContact O-N 2.69Å
31	L	72.7	Confident	64.6	Low	96 Å²	96	79 Å²	79	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-46.5	176.1	-76.9	171.7	0	0	0	111.4	V27 L28 Q29 G34 T35	V27-L31 HydrophobicContact CG1-CD1 4.23Å; V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 WeakPolarHBondContact O-CG 3.38Å; V27-L31 PolarHBondContact O-N 3.32Å; L28-L31 PolarHBondContact O-N 2.93Å; Q29-L31 PolarHBondContact O-N 3.47Å; L31-G34 PolarHBondContact O-N 3.31Å; L31-T35 VanDerWaalsContact O-CB 3.23Å; L31-T35 WeakPolarHBondContact O-CB 3.34Å; L31-T35 PolarHBondContact O-N 3.48Å; L31-T35 PolarHBondContact O-OG1 2.87Å
32	V	69.7	Low	65.2	Low	49 Å²	49	83.7 Å²	83.7	30%	0.297	44%	0.444	S	S	.	.	H	α-helix	trans	-65.4	-51.5	-179.8	171.5	0	0	0	0	110.9	L28 Q29 G34 T35 V36 F80	L28-V32 WeakPolarHBondContact O-CB 3.35Å; L28-V32 VanDerWaalsContact O-CG2 3.24Å; L28-V32 WeakPolarHBondContact O-CG2 3.33Å; L28-V32 PolarHBondContact O-N 3.29Å; Q29-V32 PolarHBondContact O-N 3.48Å; V32-G34 VanDerWaalsContact C-N 3.32Å; V32-G34 PolarHBondContact O-N 3.12Å; V32-T35 PolarHBondContact O-N 3.25Å; V32-V36 HydrophobicContact CG1-CG2 4.49Å; V32-V36 WeakPolarHBondContact O-CB 3.35Å; V32-V36 VanDerWaalsContact O-CG2 3.22Å; V32-V36 WeakPolarHBondContact O-CG2 3.34Å; V32-V36 PolarHBondContact O-N 3.03Å; V32-F80 HydrophobicContact CG1-CE1 4.09Å; V32-F80 HydrophobicContact CG1-CZ 3.75Å; V32-F80 HydrophobicContact CG2-CZ 4.27Å
33	H	68	Low	65.3	Low	89 Å²	89	87 Å²	87	41%	0.412	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-37.9	178.2	-75.4	-78.1	0	0	0	111.8	F14 Q29 Y37	F14-H33 HydrophobicContact CE2-CB 4.2Å; F14-H33 AromaticContact CE2-CD2 3.89Å; F14-H33 HydrophobicContact CZ-CB 4.36Å; Q29-H33 WeakPolarHBondContact CG-CD2 3.42Å; Q29-H33 WeakPolarHBondContact O-CB 3.5Å; Q29-H33 PolarHBondContact O-CD2 2.87Å; Q29-H33 PolarHBondContact O-N 2.87Å; H33-Y37 WeakPolarHBondContact O-CB 3.37Å; H33-Y37 PolarHBondContact O-N 2.85Å
34	G	72.2	Confident	64.9	Low	33 Å²	33	84.7 Å²	84.7	34%	0.34	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-44.4	175.7	0	0	0	0	0	112.6	F30 L31 V32 Y37 A38	F30-G34 VanDerWaalsContact O-CA 3.31Å; F30-G34 WeakPolarHBondContact O-CA 3.36Å; F30-G34 PolarHBondContact O-N 2.69Å; L31-G34 PolarHBondContact O-N 3.31Å; V32-G34 VanDerWaalsContact C-N 3.32Å; V32-G34 PolarHBondContact O-N 3.12Å; G34-Y37 PolarHBondContact O-N 3.46Å; G34-A38 VanDerWaalsContact O-CB 3.27Å; G34-A38 WeakPolarHBondContact O-CB 3.36Å; G34-A38 PolarHBondContact O-N 2.99Å
35	T	72.7	Confident	64.2	Low	77 Å²	77	84.7 Å²	84.7	47%	0.472	45%	0.454	S	S	.	.	H	α-helix	trans	-67.8	-42.3	176.2	-59.6	0	0	0	0	111.3	L31 V32 Y37 A38 L39	L31-T35 VanDerWaalsContact O-CB 3.23Å; L31-T35 WeakPolarHBondContact O-CB 3.34Å; L31-T35 PolarHBondContact O-N 3.48Å; L31-T35 PolarHBondContact O-OG1 2.87Å; V32-T35 PolarHBondContact O-N 3.25Å; T35-Y37 VanDerWaalsContact C-N 3.34Å; T35-Y37 PolarHBondContact O-N 3.04Å; T35-A38 PolarHBondContact O-N 3.45Å; T35-L39 HydrophobicContact CG2-CD1 3.81Å; T35-L39 HydrophobicContact CG2-CG 4.2Å; T35-L39 VanDerWaalsContact O-CB 3.29Å; T35-L39 WeakPolarHBondContact O-CB 3.4Å; T35-L39 VanDerWaalsContact O-CG 3.23Å; T35-L39 WeakPolarHBondContact O-CG 3.38Å; T35-L39 PolarHBondContact O-N 2.9Å
36	V	68	Low	63.8	Low	55 Å²	55	90.4 Å²	90.4	33%	0.333	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-41.8	175.3	171.6	0	0	0	0	111	V32 R40	V32-V36 HydrophobicContact CG1-CG2 4.49Å; V32-V36 WeakPolarHBondContact O-CB 3.35Å; V32-V36 VanDerWaalsContact O-CG2 3.22Å; V32-V36 WeakPolarHBondContact O-CG2 3.34Å; V32-V36 PolarHBondContact O-N 3.03Å; V36-R40 WeakPolarHBondContact O-CB 3.43Å; V36-R40 WeakPolarHBondContact O-CG 3.24Å; V36-R40 PolarHBondContact O-N 3.36Å
37	Y	64.5	Low	63.3	Low	146 Å²	146	96.2 Å²	96.2	57%	0.573	51%	0.509	S	S	*	.	H	α-helix	trans	-63.9	-44.9	174.8	176.6	-99	0	0	0	111.9	H33 G34 T35 R40 K41	H33-Y37 WeakPolarHBondContact O-CB 3.37Å; H33-Y37 PolarHBondContact O-N 2.85Å; G34-Y37 PolarHBondContact O-N 3.46Å; T35-Y37 VanDerWaalsContact C-N 3.34Å; T35-Y37 PolarHBondContact O-N 3.04Å; Y37-R40 PolarHBondContact O-N 3.23Å; Y37-K41 HydrophobicContact CE1-CD 4.48Å; Y37-K41 WeakPolarHBondContact O-CB 3.31Å; Y37-K41 PolarHBondContact O-N 3.27Å
38	A	69.5	Low	62.6	Low	41 Å²	41	99.2 Å²	99.2	34%	0.339	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-44.8	177	0	0	0	0	0	111.5	G34 T35 K41 L42	G34-A38 VanDerWaalsContact O-CB 3.27Å; G34-A38 WeakPolarHBondContact O-CB 3.36Å; G34-A38 PolarHBondContact O-N 2.99Å; T35-A38 PolarHBondContact O-N 3.45Å; A38-K41 PolarHBondContact O-N 2.94Å; A38-L42 WeakPolarHBondContact O-CB 3.27Å; A38-L42 WeakPolarHBondContact O-CD1 3.37Å; A38-L42 PolarHBondContact O-N 3.24Å
39	L	67.8	Low	61.7	Low	102 Å²	102	98.7 Å²	98.7	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-47.7	176.5	-75.4	168.6	0	0	0	110.9	T35 K41 L42 T43	T35-L39 HydrophobicContact CG2-CD1 3.81Å; T35-L39 HydrophobicContact CG2-CG 4.2Å; T35-L39 VanDerWaalsContact O-CB 3.29Å; T35-L39 WeakPolarHBondContact O-CB 3.4Å; T35-L39 VanDerWaalsContact O-CG 3.23Å; T35-L39 WeakPolarHBondContact O-CG 3.38Å; T35-L39 PolarHBondContact O-N 2.9Å; L39-K41 VanDerWaalsContact C-N 3.31Å; L39-K41 PolarHBondContact O-N 3.38Å; L39-L42 CarbonylContact O-C 3.55Å; L39-L42 PolarHBondContact O-N 2.99Å; L39-L42 VanDerWaalsContact O-N 3.11Å; L39-T43 PolarHBondContact O-N 2.88Å; L39-T43 PolarHBondContact O-OG1 2.94Å
40	R	58.9	Low	61.1	Low	124 Å²	124	97.9 Å²	97.9	47%	0.468	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-39.3	175.4	-75.9	-178.1	-163.5	151.3	9.7	112.5	V36 Y37 L42 S50	V36-R40 WeakPolarHBondContact O-CB 3.43Å; V36-R40 WeakPolarHBondContact O-CG 3.24Å; V36-R40 PolarHBondContact O-N 3.36Å; Y37-R40 PolarHBondContact O-N 3.23Å; R40-L42 VanDerWaalsContact C-N 3.3Å; R40-L42 PolarHBondContact O-N 2.96Å; R40-S50 VanDerWaalsContact NH1-CB 3.25Å; R40-S50 PolarHBondContact NH1-OG 3.5Å
41	K	63.8	Low	60.3	Low	160 Å²	160	94.2 Å²	94.2	70%	0.696	50%	0.499	S	S	*	.	H	α-helix	trans	-66.7	-33.6	176.2	-168	176.9	179.5	-173.5	0	112	Y37 A38 L39	Y37-K41 HydrophobicContact CE1-CD 4.48Å; Y37-K41 WeakPolarHBondContact O-CB 3.31Å; Y37-K41 PolarHBondContact O-N 3.27Å; A38-K41 PolarHBondContact O-N 2.94Å; L39-K41 VanDerWaalsContact C-N 3.31Å; L39-K41 PolarHBondContact O-N 3.38Å
42	L	63.8	Low	59	Low	147 Å²	147	97 Å²	97	77%	0.77	50%	0.503	S	S	*	.	H	α-helix	trans	-79.8	-33.7	177	-88.6	148.3	0	0	0	113.2	A38 L39 R40 G44	A38-L42 WeakPolarHBondContact O-CB 3.27Å; A38-L42 WeakPolarHBondContact O-CD1 3.37Å; A38-L42 PolarHBondContact O-N 3.24Å; L39-L42 CarbonylContact O-C 3.55Å; L39-L42 PolarHBondContact O-N 2.99Å; L39-L42 VanDerWaalsContact O-N 3.11Å; R40-L42 VanDerWaalsContact C-N 3.3Å; R40-L42 PolarHBondContact O-N 2.96Å; L42-G44 VanDerWaalsContact C-N 3.3Å; L42-G44 PolarHBondContact O-N 2.76Å
43	T	57	Low	58.1	Low	102 Å²	102	97.7 Å²	97.7	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-78.9	-8.5	-176.8	16.3	0	0	0	0	114.1	L39 D45	L39-T43 PolarHBondContact O-N 2.88Å; L39-T43 PolarHBondContact O-OG1 2.94Å; T43-D45 PolarHBondContact O-N 3.05Å
44	G	47.5	Very low	57.3	Low	59 Å²	59	95.2 Å²	95.2	61%	0.608	49%	0.494	S	S	*	.			trans	56	6.7	166.3	0	0	0	0	0	116.6	L42 K46	L42-G44 VanDerWaalsContact C-N 3.3Å; L42-G44 PolarHBondContact O-N 2.76Å; G44-K46 PolarHBondContact O-N 2.82Å
45	D	48.2	Very low	56.3	Low	86 Å²	86	100.5 Å²	100.5	46%	0.46	52%	0.515	S	S	.	.			trans	-86.6	99	-169	-161.3	-6	0	0	0	109	T43 N47 Q48	T43-D45 PolarHBondContact O-N 3.05Å; D45-N47 PolarHBondContact O-N 3.11Å; D45-Q48 PolarHBondContact O-N 3.38Å; D45-Q48 VanDerWaalsContact O-N 3.16Å
46	K	53.5	Low	55.1	Low	155 Å²	155	104 Å²	104	67%	0.674	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-8.1	-176.3	-59.6	176.6	-175.3	175.1	0	113	G44 R49	G44-K46 PolarHBondContact O-N 2.82Å; K46-R49 WeakPolarHBondContact O-CG 3.46Å
47	N	50.4	Low	54.2	Low	147 Å²	147	104.8 Å²	104.8	79%	0.786	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.7	-177.9	-66.5	-26.6	0	0	0	114	D45	D45-N47 PolarHBondContact O-N 3.11Å
48	Q	48.3	Very low	53.5	Low	151 Å²	151	102.1 Å²	102.1	71%	0.706	54%	0.542	S	S	*	.			trans	-105.8	47.6	175.1	-64.4	-160.5	10.8	0	0	112.5	D45 S50	D45-Q48 PolarHBondContact O-N 3.38Å; D45-Q48 VanDerWaalsContact O-N 3.16Å; Q48-S50 PolarHBondContact O-N 2.89Å
49	R	48.8	Very low	52.6	Low	86 Å²	86	109.3 Å²	109.3	33%	0.325	56%	0.561	S	S	.	*			trans	-68	104.2	177.4	-68.1	-157.7	169.7	120.9	4.8	110.3	K46 D53	K46-R49 WeakPolarHBondContact O-CG 3.46Å; R49-D53 HydrophobicContact CB-CB 3.96Å; R49-D53 WeakPolarHBondContact CD-OD2 3.28Å; R49-D53 HydrophobicContact CG-CB 4.08Å; R49-D53 WeakPolarHBondContact CG-OD2 3.37Å; R49-D53 IonicContact NE-OD2 2.96Å; R49-D53 PolarHBondContact NE-OD2 2.84Å
50	S	50.5	Low	51.9	Low	32 Å²	32	113.8 Å²	113.8	22%	0.224	58%	0.579	C	S	.	*			trans	-56.6	152.9	162.1	48.1	0	0	0	0	110.2	R40 Q48 W52 D53	R40-S50 VanDerWaalsContact NH1-CB 3.25Å; R40-S50 PolarHBondContact NH1-OG 3.5Å; Q48-S50 PolarHBondContact O-N 2.89Å; S50-W52 PolarHBondContact O-N 3.38Å; S50-D53 PolarHBondContact O-N 2.88Å
51	A	51.1	Low	51.7	Low	41 Å²	41	110.3 Å²	110.3	34%	0.339	57%	0.568	S	S	.	*	H	α-helix	trans	-48.4	-22.6	-179.2	0	0	0	0	0	115.1	D53	A51-D53 VanDerWaalsContact C-N 3.34Å
52	W	45.9	Very low	51.6	Low	155 Å²	155	105.8 Å²	105.8	59%	0.587	55%	0.554	S	S	*	*	H	α-helix	trans	-65.3	-28.7	172.1	-65.5	101.2	0	0	0	115.2	I10 S50	I10-W52 HydrophobicContact CD1-CE3 4.25Å; I10-W52 HydrophobicContact CD1-CZ3 4.12Å; I10-W52 HydrophobicContact CG1-CE3 4.38Å; I10-W52 HydrophobicContact CG1-CZ3 3.75Å; I10-W52 HydrophobicContact CG2-CZ3 4.33Å; S50-W52 PolarHBondContact O-N 3.38Å
53	D	50.4	Low	51.4	Low	64 Å²	64	103.7 Å²	103.7	34%	0.342	55%	0.549	S	S	.	.	H	α-helix	trans	-93.7	-16.1	-178.9	-156.3	31.2	0	0	0	111.9	R49 S50 A51 F56	R49-D53 HydrophobicContact CB-CB 3.96Å; R49-D53 WeakPolarHBondContact CD-OD2 3.28Å; R49-D53 HydrophobicContact CG-CB 4.08Å; R49-D53 WeakPolarHBondContact CG-OD2 3.37Å; R49-D53 IonicContact NE-OD2 2.96Å; R49-D53 PolarHBondContact NE-OD2 2.84Å; S50-D53 PolarHBondContact O-N 2.88Å; A51-D53 VanDerWaalsContact C-N 3.34Å; D53-F56 PolarHBondContact O-N 3.37Å
54	M	50.2	Low	51.8	Low	36 Å²	36	102.7 Å²	102.7	18%	0.177	55%	0.546	C	S	.	.	H	α-helix	trans	-69.7	-31.4	176.5	-81.1	-57.9	-42.3	0	0	113.2	F56 E61	M54-F56 PolarHBondContact O-N 3.42Å; M54-E61 HydrophobicContact CE-CG 3.31Å; M54-E61 WeakPolarHBondContact CE-OE1 3.33Å; M54-E61 WeakPolarHBondContact CG-OE1 3.45Å; M54-E61 VanDerWaalsContact SD-OE1 3.32Å
55	N	52.3	Low	52.5	Low	145 Å²	145	104.2 Å²	104.2	78%	0.775	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-9.5	175.3	-76.1	-27.5	0	0	0	113.4
56	F	47.5	Very low	53	Low	151 Å²	151	107.4 Å²	107.4	66%	0.662	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-14.9	-174.9	-118.7	-85.8	0	0	0	114.2	D53 M54	D53-F56 PolarHBondContact O-N 3.37Å; M54-F56 PolarHBondContact O-N 3.42Å
57	I	48.5	Very low	53.4	Low	71 Å²	71	107.5 Å²	107.5	36%	0.364	54%	0.543	S	S	.	.	S	Bend	trans	-126.2	113.1	-178.8	-64.4	163.7	0	0	0	104.4	R59	I57-R59 PolarHBondContact O-N 3.31Å
58	G	50.6	Low	53.9	Low	90 Å²	90	105.3 Å²	105.3	93%	0.928	53%	0.528	S	S	*	.			trans	-63.4	48.5	-175	0	0	0	0	0	115.2
59	R	48.8	Very low	54.4	Low	192 Å²	192	104.1 Å²	104.1	73%	0.725	52%	0.518	S	S	*	.			trans	-82.8	113	170.4	-162.7	179.7	-158.4	174.8	5.2	106.4	I57 E61	I57-R59 PolarHBondContact O-N 3.31Å; R59-E61 PolarHBondContact O-N 2.83Å
60	Q	53.1	Low	55	Low	195 Å²	195	104.3 Å²	104.3	91%	0.911	53%	0.525	S	S	*	.			trans	-62.9	104.9	166.7	-75.2	-172.8	13.4	0	0	107.8
61	E	55.3	Low	55.5	Low	52 Å²	52	106.4 Å²	106.4	24%	0.243	53%	0.533	C	S	.	.			trans	-70.5	141.4	167.7	-71.6	-172.5	144.7	0	0	109.7	M54 R59 R66	M54-E61 HydrophobicContact CE-CG 3.31Å; M54-E61 WeakPolarHBondContact CE-OE1 3.33Å; M54-E61 WeakPolarHBondContact CG-OE1 3.45Å; M54-E61 VanDerWaalsContact SD-OE1 3.32Å; R59-E61 PolarHBondContact O-N 2.83Å; E61-R66 HydrophobicContact CB-CB 4.49Å; E61-R66 WeakPolarHBondContact OE2-CB 3.42Å
62	T	61.4	Low	56	Low	65 Å²	65	108 Å²	108	40%	0.399	54%	0.536	S	S	.	.			trans	-65.1	143.1	165.7	60	0	0	0	0	108.9	S64 E65 R66	T62-S64 PolarHBondContact O-N 3.45Å; T62-S64 PolarHBondContact OG1-OG 3.24Å; T62-S64 VanDerWaalsContact OG1-OG 3.12Å; T62-E65 PolarHBondContact N-OE2 3.24Å; T62-E65 PolarHBondContact O-N 3.47Å; T62-E65 VanDerWaalsContact OG1-CD 3.25Å; T62-E65 VanDerWaalsContact OG1-CG 3.27Å; T62-E65 WeakPolarHBondContact OG1-CG 3.43Å; T62-E65 PolarHBondContact OG1-OE2 3.28Å; T62-R66 PolarHBondContact O-N 3.46Å
63	P	60.2	Low	56.7	Low	103 Å²	103	102.4 Å²	102.4	67%	0.669	52%	0.523	S	S	*	.	H	α-helix	trans	-59.7	-18.7	-178.4	22.4	-32.7	0	0	0	113.4	K67	P63-K67 WeakPolarHBondContact O-CG 3.31Å; P63-K67 PolarHBondContact O-N 2.97Å
64	S	64.9	Low	57.1	Low	80 Å²	80	103 Å²	103	56%	0.559	52%	0.521	S	S	*	.	H	α-helix	trans	-73.3	-45	172.9	41.4	0	0	0	0	113.4	T62 K67 Q68	T62-S64 PolarHBondContact O-N 3.45Å; T62-S64 PolarHBondContact OG1-OG 3.24Å; T62-S64 VanDerWaalsContact OG1-OG 3.12Å; S64-K67 PolarHBondContact O-N 2.86Å; S64-Q68 PolarHBondContact O-N 3.17Å; S64-Q68 VanDerWaalsContact O-N 3.16Å
65	E	62.6	Low	57.8	Low	92 Å²	92	104.3 Å²	104.3	43%	0.43	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-45.4	-179.7	-73.2	168.4	143.2	0	0	110.4	T62 K67 Q68 Y69	T62-E65 PolarHBondContact N-OE2 3.24Å; T62-E65 PolarHBondContact O-N 3.47Å; T62-E65 VanDerWaalsContact OG1-CD 3.25Å; T62-E65 VanDerWaalsContact OG1-CG 3.27Å; T62-E65 WeakPolarHBondContact OG1-CG 3.43Å; T62-E65 PolarHBondContact OG1-OE2 3.28Å; E65-K67 VanDerWaalsContact C-N 3.27Å; E65-K67 PolarHBondContact O-N 3.21Å; E65-Q68 PolarHBondContact O-N 2.6Å; E65-Y69 HydrophobicContact CB-CD2 4.36Å; E65-Y69 HydrophobicContact CB-CE2 4.29Å; E65-Y69 WeakPolarHBondContact O-CD2 3.22Å; E65-Y69 PolarHBondContact O-N 2.95Å
66	R	58.2	Low	58.3	Low	153 Å²	153	100.5 Å²	100.5	58%	0.577	52%	0.516	S	S	*	.	H	α-helix	trans	-55.3	-42.5	176.5	-171.3	177.4	178.3	-168.3	0.6	112	E61 T62 L70	E61-R66 HydrophobicContact CB-CB 4.49Å; E61-R66 WeakPolarHBondContact OE2-CB 3.42Å; T62-R66 PolarHBondContact O-N 3.46Å; R66-L70 HydrophobicContact CG-CD1 4.11Å; R66-L70 WeakPolarHBondContact O-CB 3.39Å; R66-L70 WeakPolarHBondContact O-CG 3.44Å; R66-L70 PolarHBondContact O-N 3.48Å
67	K	62	Low	58.9	Low	156 Å²	156	97.8 Å²	97.8	68%	0.678	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-42.7	176.5	-79	179.6	-178.7	-175.5	0	111.9	P63 S64 E65 L70 L71	P63-K67 WeakPolarHBondContact O-CG 3.31Å; P63-K67 PolarHBondContact O-N 2.97Å; S64-K67 PolarHBondContact O-N 2.86Å; E65-K67 VanDerWaalsContact C-N 3.27Å; E65-K67 PolarHBondContact O-N 3.21Å; K67-L70 PolarHBondContact O-N 3.39Å; K67-L71 VanDerWaalsContact O-CB 3.28Å; K67-L71 WeakPolarHBondContact O-CB 3.5Å; K67-L71 PolarHBondContact O-N 3.29Å
68	Q	62.2	Low	59.6	Low	102 Å²	102	95.5 Å²	95.5	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-69.1	-39.7	-179.5	-165.6	169.7	12.3	0	0	112	S64 E65 L71 N72 Y142	S64-Q68 PolarHBondContact O-N 3.17Å; S64-Q68 VanDerWaalsContact O-N 3.16Å; E65-Q68 PolarHBondContact O-N 2.6Å; Q68-L71 PolarHBondContact O-N 3.19Å; Q68-N72 WeakPolarHBondContact O-CB 3.4Å; Q68-N72 PolarHBondContact O-N 2.84Å; Q68-Y142 PolarHBondContact NE2-OH 3.42Å
69	Y	58.6	Low	60.3	Low	126 Å²	126	99.4 Å²	99.4	49%	0.494	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-43.4	173.7	-77.5	-68.1	0	0	0	112.5	E65 L71 N72 A73	E65-Y69 HydrophobicContact CB-CD2 4.36Å; E65-Y69 HydrophobicContact CB-CE2 4.29Å; E65-Y69 WeakPolarHBondContact O-CD2 3.22Å; E65-Y69 PolarHBondContact O-N 2.95Å; Y69-L71 VanDerWaalsContact C-N 3.31Å; Y69-L71 PolarHBondContact O-N 3.09Å; Y69-N72 PolarHBondContact O-N 2.93Å; Y69-A73 VanDerWaalsContact O-CB 3.29Å; Y69-A73 WeakPolarHBondContact O-CB 3.35Å; Y69-A73 PolarHBondContact O-N 3.49Å
70	L	60.7	Low	61	Low	90 Å²	90	94.9 Å²	94.9	47%	0.471	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-42.1	174.4	-73.7	173.7	0	0	0	110.9	R66 K67 N72 A73 Y74	R66-L70 HydrophobicContact CG-CD1 4.11Å; R66-L70 WeakPolarHBondContact O-CB 3.39Å; R66-L70 WeakPolarHBondContact O-CG 3.44Å; R66-L70 PolarHBondContact O-N 3.48Å; K67-L70 PolarHBondContact O-N 3.39Å; L70-N72 PolarHBondContact O-N 3.42Å; L70-A73 PolarHBondContact O-N 3.37Å; L70-Y74 WeakPolarHBondContact O-CB 3.35Å; L70-Y74 PolarHBondContact O-N 3.01Å
71	L	60.9	Low	61.4	Low	75 Å²	75	88.3 Å²	88.3	39%	0.393	44%	0.439	S	S	.	.	H	α-helix	trans	-63.9	-41.4	176.9	-159.8	115.3	0	0	0	111.4	K67 Q68 Y69 Y74 T75 T134	K67-L71 VanDerWaalsContact O-CB 3.28Å; K67-L71 WeakPolarHBondContact O-CB 3.5Å; K67-L71 PolarHBondContact O-N 3.29Å; Q68-L71 PolarHBondContact O-N 3.19Å; Y69-L71 VanDerWaalsContact C-N 3.31Å; Y69-L71 PolarHBondContact O-N 3.09Å; L71-Y74 PolarHBondContact O-N 2.79Å; L71-T75 HydrophobicContact CD2-CG2 4.43Å; L71-T75 WeakPolarHBondContact O-CB 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.45Å; L71-T75 PolarHBondContact O-N 3.02Å; L71-T75 PolarHBondContact O-OG1 2.86Å; L71-T134 HydrophobicContact CD1-CG2 3.92Å
72	N	62.7	Low	61.9	Low	75 Å²	75	90.1 Å²	90.1	40%	0.401	45%	0.447	S	S	.	.	H	α-helix	trans	-69.6	-41.2	177.2	-76.6	-7.9	0	0	0	113.1	Q68 Y69 L70 Y74 T75 S76	Q68-N72 WeakPolarHBondContact O-CB 3.4Å; Q68-N72 PolarHBondContact O-N 2.84Å; Y69-N72 PolarHBondContact O-N 2.93Å; L70-N72 PolarHBondContact O-N 3.42Å; N72-Y74 VanDerWaalsContact C-N 3.27Å; N72-Y74 PolarHBondContact O-N 3.48Å; N72-T75 WeakPolarHBondContact CA-OG1 3.38Å; N72-T75 PolarHBondContact O-OG1 3.22Å; N72-T75 VanDerWaalsContact O-OG1 3.08Å; N72-S76 WeakPolarHBondContact O-CB 3.05Å; N72-S76 PolarHBondContact O-N 3.12Å; N72-S76 PolarHBondContact O-OG 2.84Å
73	A	59.5	Low	62.3	Low	37 Å²	37	90.2 Å²	90.2	31%	0.306	44%	0.443	S	S	.	.	H	α-helix	trans	-63.4	-38.9	173.1	0	0	0	0	0	110.7	Y69 L70 S76 N77	Y69-A73 VanDerWaalsContact O-CB 3.29Å; Y69-A73 WeakPolarHBondContact O-CB 3.35Å; Y69-A73 PolarHBondContact O-N 3.49Å; L70-A73 PolarHBondContact O-N 3.37Å; A73-S76 WeakPolarHBondContact CA-OG 3.4Å; A73-S76 PolarHBondContact O-OG 2.91Å; A73-N77 WeakPolarHBondContact O-CB 3.36Å; A73-N77 PolarHBondContact O-N 3.36Å; A73-N77 VanDerWaalsContact O-N 3.1Å; A73-N77 PolarHBondContact O-ND2 3.27Å; A73-N77 VanDerWaalsContact O-ND2 3.13Å
74	Y	58.5	Low	62.4	Low	76 Å²	76	88.4 Å²	88.4	30%	0.298	43%	0.427	S	S	.	.	H	α-helix	trans	-72.5	-44.3	179.4	-167.9	-83	0	0	0	112	L70 L71 N72 S76 N77 I78 E126 I130	L70-Y74 WeakPolarHBondContact O-CB 3.35Å; L70-Y74 PolarHBondContact O-N 3.01Å; L71-Y74 PolarHBondContact O-N 2.79Å; N72-Y74 VanDerWaalsContact C-N 3.27Å; N72-Y74 PolarHBondContact O-N 3.48Å; Y74-S76 PolarHBondContact O-N 2.91Å; Y74-N77 WeakPolarHBondContact O-CB 3.43Å; Y74-N77 PolarHBondContact O-N 3.44Å; Y74-I78 HydrophobicContact CD1-CD1 3.56Å; Y74-I78 HydrophobicContact CD1-CG1 3.88Å; Y74-I78 HydrophobicContact CE1-CD1 3.2Å; Y74-I78 HydrophobicContact CE1-CG1 3.39Å; Y74-I78 WeakPolarHBondContact O-CG1 3.37Å; Y74-I78 PolarHBondContact O-N 3.31Å; Y74-E126 WeakPolarHBondContact OH-CB 3.45Å; Y74-E126 PolarHBondContact OH-OE2 2.88Å; Y74-I130 HydrophobicContact CD1-CD1 3.56Å; Y74-I130 HydrophobicContact CE1-CD1 2.87Å; Y74-I130 HydrophobicContact CE1-CG1 4.22Å; Y74-I130 HydrophobicContact CE2-CD1 4.41Å; Y74-I130 WeakPolarHBondContact OH-CD1 3.16Å
75	T	65.4	Low	62.5	Low	65 Å²	65	85.5 Å²	85.5	40%	0.399	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-40	176.8	53.1	0	0	0	0	112.2	L71 N72 I78 W79	L71-T75 HydrophobicContact CD2-CG2 4.43Å; L71-T75 WeakPolarHBondContact O-CB 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.45Å; L71-T75 PolarHBondContact O-N 3.02Å; L71-T75 PolarHBondContact O-OG1 2.86Å; N72-T75 WeakPolarHBondContact CA-OG1 3.38Å; N72-T75 PolarHBondContact O-OG1 3.22Å; N72-T75 VanDerWaalsContact O-OG1 3.08Å; T75-I78 PolarHBondContact O-N 3.37Å; T75-W79 WeakPolarHBondContact O-CB 3.46Å; T75-W79 PolarHBondContact O-N 3.47Å
76	S	62.8	Low	62.8	Low	65 Å²	65	89.2 Å²	89.2	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-63.6	-39.8	173.8	54.8	0	0	0	0	112.3	N72 A73 Y74 W79 F80	N72-S76 WeakPolarHBondContact O-CB 3.05Å; N72-S76 PolarHBondContact O-N 3.12Å; N72-S76 PolarHBondContact O-OG 2.84Å; A73-S76 WeakPolarHBondContact CA-OG 3.4Å; A73-S76 PolarHBondContact O-OG 2.91Å; Y74-S76 PolarHBondContact O-N 2.91Å; S76-W79 PolarHBondContact O-N 3.11Å; S76-F80 WeakPolarHBondContact O-CB 3.28Å; S76-F80 PolarHBondContact O-N 3.14Å
77	N	59.5	Low	63.1	Low	93 Å²	93	85 Å²	85	50%	0.497	41%	0.407	S	S	.	.	H	α-helix	trans	-63.8	-44.7	173.6	-74.7	-25.8	0	0	0	112.1	A73 Y74 W79 F80 Q81	A73-N77 WeakPolarHBondContact O-CB 3.36Å; A73-N77 PolarHBondContact O-N 3.36Å; A73-N77 VanDerWaalsContact O-N 3.1Å; A73-N77 PolarHBondContact O-ND2 3.27Å; A73-N77 VanDerWaalsContact O-ND2 3.13Å; Y74-N77 WeakPolarHBondContact O-CB 3.43Å; Y74-N77 PolarHBondContact O-N 3.44Å; N77-W79 PolarHBondContact O-N 3.41Å; N77-F80 PolarHBondContact O-N 3.06Å; N77-Q81 WeakPolarHBondContact O-CG 3.37Å; N77-Q81 PolarHBondContact O-N 3.21Å
78	I	64.6	Low	63.1	Low	24 Å²	24	79.3 Å²	79.3	12%	0.123	38%	0.383	C	S	.	.	H	α-helix	trans	-59.5	-47.9	175.3	-62.9	166	0	0	0	110.6	Y74 T75 F80 Q81 Q82 M127 I130	Y74-I78 HydrophobicContact CD1-CD1 3.56Å; Y74-I78 HydrophobicContact CD1-CG1 3.88Å; Y74-I78 HydrophobicContact CE1-CD1 3.2Å; Y74-I78 HydrophobicContact CE1-CG1 3.39Å; Y74-I78 WeakPolarHBondContact O-CG1 3.37Å; Y74-I78 PolarHBondContact O-N 3.31Å; T75-I78 PolarHBondContact O-N 3.37Å; I78-F80 VanDerWaalsContact C-N 3.28Å; I78-F80 PolarHBondContact O-N 3.07Å; I78-Q81 PolarHBondContact O-N 3.09Å; I78-Q81 VanDerWaalsContact O-N 3.12Å; I78-Q82 HydrophobicContact CG2-CG 4.19Å; I78-Q82 WeakPolarHBondContact O-CG 3.34Å; I78-Q82 PolarHBondContact O-N 3.34Å; I78-M127 HydrophobicContact CG2-SD 4.42Å; I78-I130 HydrophobicContact CD1-CD1 4.41Å
79	W	64.5	Low	63.2	Low	171 Å²	171	79.5 Å²	79.5	65%	0.648	38%	0.383	S	S	*	.	H	α-helix	trans	-59.2	-43.7	-177.8	-171.7	86.8	0	0	0	110.9	T75 S76 N77 Q82 E83	T75-W79 WeakPolarHBondContact O-CB 3.46Å; T75-W79 PolarHBondContact O-N 3.47Å; S76-W79 PolarHBondContact O-N 3.11Å; N77-W79 PolarHBondContact O-N 3.41Å; W79-Q82 PolarHBondContact O-N 3.39Å; W79-E83 PolarHBondContact O-N 3.08Å
80	F	63.1	Low	63.6	Low	97 Å²	97	74.6 Å²	74.6	43%	0.425	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-43.6	174.5	-174.7	-98.2	0	0	0	112.4	V32 S76 N77 I78 Q82 E83 L84	V32-F80 HydrophobicContact CG1-CE1 4.09Å; V32-F80 HydrophobicContact CG1-CZ 3.75Å; V32-F80 HydrophobicContact CG2-CZ 4.27Å; S76-F80 WeakPolarHBondContact O-CB 3.28Å; S76-F80 PolarHBondContact O-N 3.14Å; N77-F80 PolarHBondContact O-N 3.06Å; I78-F80 VanDerWaalsContact C-N 3.28Å; I78-F80 PolarHBondContact O-N 3.07Å; F80-Q82 VanDerWaalsContact C-N 3.32Å; F80-Q82 PolarHBondContact O-N 3.37Å; F80-E83 PolarHBondContact O-N 3.01Å; F80-L84 HydrophobicContact CE1-CD1 4.14Å; F80-L84 HydrophobicContact CZ-CD1 4.34Å; F80-L84 WeakPolarHBondContact O-CB 3.46Å; F80-L84 PolarHBondContact O-N 3.43Å
81	Q	62.8	Low	63.8	Low	58 Å²	58	77.4 Å²	77.4	27%	0.271	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-38.7	176.2	-73.3	-170.9	4.2	0	0	112.2	N77 I78 L84 I85 F119	N77-Q81 WeakPolarHBondContact O-CG 3.37Å; N77-Q81 PolarHBondContact O-N 3.21Å; I78-Q81 PolarHBondContact O-N 3.09Å; I78-Q81 VanDerWaalsContact O-N 3.12Å; Q81-L84 PolarHBondContact O-N 2.96Å; Q81-I85 VanDerWaalsContact O-CG1 3.24Å; Q81-I85 WeakPolarHBondContact O-CG1 3.33Å; Q81-I85 PolarHBondContact O-N 2.84Å; Q81-F119 HydrophobicContact CB-CE1 4.36Å; Q81-F119 HydrophobicContact CB-CZ 4.25Å; Q81-F119 HydrophobicContact CG-CZ 4.01Å
82	Q	65.6	Low	63.8	Low	89 Å²	89	76 Å²	76	42%	0.416	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-43.6	174.7	-72.9	-175.5	10.9	0	0	111.7	I78 W79 F80 L84 I85 R86	I78-Q82 HydrophobicContact CG2-CG 4.19Å; I78-Q82 WeakPolarHBondContact O-CG 3.34Å; I78-Q82 PolarHBondContact O-N 3.34Å; W79-Q82 PolarHBondContact O-N 3.39Å; F80-Q82 VanDerWaalsContact C-N 3.32Å; F80-Q82 PolarHBondContact O-N 3.37Å; Q82-L84 VanDerWaalsContact C-N 3.31Å; Q82-L84 PolarHBondContact O-N 2.88Å; Q82-I85 PolarHBondContact O-N 3.49Å; Q82-R86 WeakPolarHBondContact O-CB 3.4Å; Q82-R86 PolarHBondContact O-N 2.92Å
83	E	68.7	Low	63.8	Low	68 Å²	68	77.8 Å²	77.8	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-68.3	-33.9	178.1	-162.5	57.7	-148.9	0	0	111.8	W79 F80 R86 T87	W79-E83 PolarHBondContact O-N 3.08Å; F80-E83 PolarHBondContact O-N 3.01Å; E83-R86 PolarHBondContact O-N 3.47Å; E83-R86 IonicContact OE1-NE 3.09Å; E83-R86 PolarHBondContact OE1-NE 3.04Å; E83-R86 VanDerWaalsContact OE1-NE 3.09Å; E83-R86 IonicContact OE2-NE 3.69Å; E83-T87 WeakPolarHBondContact O-CB 3.29Å; E83-T87 PolarHBondContact O-N 3.16Å; E83-T87 PolarHBondContact O-OG1 3.48Å
84	L	62.2	Low	63.9	Low	65 Å²	65	83 Å²	83	34%	0.34	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-47.9	172.3	-163.5	105.8	0	0	0	111.1	F80 Q81 Q82 R86 T87 L88	F80-L84 HydrophobicContact CE1-CD1 4.14Å; F80-L84 HydrophobicContact CZ-CD1 4.34Å; F80-L84 WeakPolarHBondContact O-CB 3.46Å; F80-L84 PolarHBondContact O-N 3.43Å; Q81-L84 PolarHBondContact O-N 2.96Å; Q82-L84 VanDerWaalsContact C-N 3.31Å; Q82-L84 PolarHBondContact O-N 2.88Å; L84-R86 VanDerWaalsContact C-N 3.28Å; L84-R86 PolarHBondContact O-N 3.47Å; L84-T87 PolarHBondContact O-N 2.81Å; L84-L88 HydrophobicContact CD2-CD1 3.75Å; L84-L88 HydrophobicContact CG-CD1 4.1Å; L84-L88 WeakPolarHBondContact O-CB 3.22Å; L84-L88 VanDerWaalsContact O-CG 3.27Å; L84-L88 WeakPolarHBondContact O-CG 3.24Å; L84-L88 PolarHBondContact O-N 3.02Å
85	I	66.5	Low	63.8	Low	18 Å²	18	83.3 Å²	83.3	9%	0.092	40%	0.395	C	S	.	.	H	α-helix	trans	-57.7	-44.2	174.9	-70.1	164.1	0	0	0	110.1	Q81 Q82 L88 K89 F119 V123	Q81-I85 VanDerWaalsContact O-CG1 3.24Å; Q81-I85 WeakPolarHBondContact O-CG1 3.33Å; Q81-I85 PolarHBondContact O-N 2.84Å; Q82-I85 PolarHBondContact O-N 3.49Å; I85-L88 PolarHBondContact O-N 3.31Å; I85-K89 HydrophobicContact CG2-CD 4.12Å; I85-K89 HydrophobicContact CG2-CG 4.37Å; I85-K89 WeakPolarHBondContact O-CB 3.43Å; I85-K89 VanDerWaalsContact O-CG 3.32Å; I85-K89 WeakPolarHBondContact O-CG 3.4Å; I85-K89 PolarHBondContact O-N 3.38Å; I85-F119 HydrophobicContact CD1-CD1 3.69Å; I85-F119 HydrophobicContact CD1-CE1 3.63Å; I85-F119 HydrophobicContact CG1-CD1 3.63Å; I85-F119 HydrophobicContact CG1-CE1 3.61Å; I85-V123 HydrophobicContact CD1-CG2 4.39Å
86	R	69	Low	63.7	Low	171 Å²	171	86 Å²	86	65%	0.645	40%	0.401	S	S	*	.	H	α-helix	trans	-62.1	-45.2	178.8	-173.5	-179.9	126.4	90.4	2.4	111.3	Q82 E83 L84 K89 G90	Q82-R86 WeakPolarHBondContact O-CB 3.4Å; Q82-R86 PolarHBondContact O-N 2.92Å; E83-R86 PolarHBondContact O-N 3.47Å; E83-R86 IonicContact OE1-NE 3.09Å; E83-R86 PolarHBondContact OE1-NE 3.04Å; E83-R86 VanDerWaalsContact OE1-NE 3.09Å; E83-R86 IonicContact OE2-NE 3.69Å; L84-R86 VanDerWaalsContact C-N 3.28Å; L84-R86 PolarHBondContact O-N 3.47Å; R86-K89 PolarHBondContact O-N 3.49Å; R86-G90 PolarHBondContact O-N 2.82Å
87	T	65.9	Low	63.7	Low	64 Å²	64	86 Å²	86	39%	0.393	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-43.9	177.6	-60.8	0	0	0	0	111.7	E83 L84 G90 R91	E83-T87 WeakPolarHBondContact O-CB 3.29Å; E83-T87 PolarHBondContact O-N 3.16Å; E83-T87 PolarHBondContact O-OG1 3.48Å; L84-T87 PolarHBondContact O-N 2.81Å; T87-G90 PolarHBondContact O-N 2.82Å; T87-R91 PolarHBondContact O-N 3.26Å
88	L	61.7	Low	63.6	Low	36 Å²	36	85.9 Å²	85.9	19%	0.188	40%	0.396	C	S	.	.	H	α-helix	trans	-66.1	-41.6	177.7	-71.2	172.8	0	0	0	111.6	F25 L84 I85 G90 R91 L92 L116	F25-L88 HydrophobicContact CE1-CD1 3.93Å; F25-L88 HydrophobicContact CE1-CD2 4.14Å; L84-L88 HydrophobicContact CD2-CD1 3.75Å; L84-L88 HydrophobicContact CG-CD1 4.1Å; L84-L88 WeakPolarHBondContact O-CB 3.22Å; L84-L88 VanDerWaalsContact O-CG 3.27Å; L84-L88 WeakPolarHBondContact O-CG 3.24Å; L84-L88 PolarHBondContact O-N 3.02Å; I85-L88 PolarHBondContact O-N 3.31Å; L88-G90 VanDerWaalsContact C-N 3.33Å; L88-G90 PolarHBondContact O-N 3.13Å; L88-R91 PolarHBondContact O-N 3.38Å; L88-L92 WeakPolarHBondContact O-CB 3.45Å; L88-L92 PolarHBondContact O-N 3.1Å; L88-L116 HydrophobicContact CB-CD1 4.47Å; L88-L116 HydrophobicContact CB-CD2 3.86Å; L88-L116 HydrophobicContact CD1-CD2 3.83Å; L88-L116 HydrophobicContact CG-CD2 4.49Å
89	K	64.5	Low	63.2	Low	107 Å²	107	87.3 Å²	87.3	47%	0.465	40%	0.403	S	S	.	.	H	α-helix	trans	-58.5	-44.4	171.4	-79.7	-179	177.4	-178.7	0	111.7	I85 R86 R91 L92 L93	I85-K89 HydrophobicContact CG2-CD 4.12Å; I85-K89 HydrophobicContact CG2-CG 4.37Å; I85-K89 WeakPolarHBondContact O-CB 3.43Å; I85-K89 VanDerWaalsContact O-CG 3.32Å; I85-K89 WeakPolarHBondContact O-CG 3.4Å; I85-K89 PolarHBondContact O-N 3.38Å; R86-K89 PolarHBondContact O-N 3.49Å; K89-R91 VanDerWaalsContact C-N 3.35Å; K89-R91 PolarHBondContact O-N 2.88Å; K89-L92 PolarHBondContact O-N 3.48Å; K89-L93 WeakPolarHBondContact O-CB 3.16Å; K89-L93 WeakPolarHBondContact O-CG 3.48Å; K89-L93 PolarHBondContact O-N 2.94Å
90	G	66	Low	63.1	Low	22 Å²	22	86.3 Å²	86.3	23%	0.227	41%	0.405	C	S	.	.	H	α-helix	trans	-60.8	-41.7	176.1	0	0	0	0	0	112.7	R86 T87 L88 R94	R86-G90 PolarHBondContact O-N 2.82Å; T87-G90 PolarHBondContact O-N 2.82Å; L88-G90 VanDerWaalsContact C-N 3.33Å; L88-G90 PolarHBondContact O-N 3.13Å; G90-R94 WeakPolarHBondContact O-CG 3.27Å; G90-R94 PolarHBondContact O-N 3.45Å; G90-R94 VanDerWaalsContact O-N 3.08Å
91	R	64.7	Low	62.7	Low	149 Å²	149	89 Å²	89	56%	0.562	42%	0.421	S	S	*	.	H	α-helix	trans	-67.2	-40.4	174.3	-73.5	-176	177.9	-162.6	-0.6	112.4	T87 L88 K89 R94 N95	T87-R91 PolarHBondContact O-N 3.26Å; L88-R91 PolarHBondContact O-N 3.38Å; K89-R91 VanDerWaalsContact C-N 3.35Å; K89-R91 PolarHBondContact O-N 2.88Å; R91-R94 VanDerWaalsContact CG-NH2 3.3Å; R91-R94 PolarHBondContact O-N 2.85Å; R91-N95 WeakPolarHBondContact O-CB 3.31Å; R91-N95 PolarHBondContact O-N 3.33Å
92	L	61.4	Low	62.4	Low	46 Å²	46	89.7 Å²	89.7	24%	0.241	43%	0.429	C	S	.	.	H	α-helix	trans	-65.5	-41.3	178.6	-164.5	113.4	0	0	0	111.6	L88 K89 N95 K96 I109 L112 L116	L88-L92 WeakPolarHBondContact O-CB 3.45Å; L88-L92 PolarHBondContact O-N 3.1Å; K89-L92 PolarHBondContact O-N 3.48Å; L92-N95 PolarHBondContact O-N 3.46Å; L92-K96 WeakPolarHBondContact O-CB 3.22Å; L92-K96 PolarHBondContact O-N 3.16Å; L92-I109 HydrophobicContact CD1-CG2 3.89Å; L92-I109 HydrophobicContact CG-CG2 4.39Å; L92-L112 HydrophobicContact CD1-CB 4.32Å; L92-L116 HydrophobicContact CD1-CD1 3.96Å
93	L	63.6	Low	62.1	Low	113 Å²	113	92.8 Å²	92.8	59%	0.592	45%	0.449	S	S	*	.	H	α-helix	trans	-62.4	-45.1	173.6	-74.1	169.3	0	0	0	111.3	K89 N95 K96 V97	K89-L93 WeakPolarHBondContact O-CB 3.16Å; K89-L93 WeakPolarHBondContact O-CG 3.48Å; K89-L93 PolarHBondContact O-N 2.94Å; L93-N95 PolarHBondContact O-N 3.34Å; L93-K96 PolarHBondContact O-N 2.85Å; L93-V97 VanDerWaalsContact O-CG2 3.31Å; L93-V97 WeakPolarHBondContact O-CG2 3.41Å; L93-V97 PolarHBondContact O-N 2.86Å
94	R	61	Low	61.2	Low	145 Å²	145	95 Å²	95	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-60.1	-44.5	174.5	-74.8	-170.1	-65.9	-96.9	7.2	112.1	G90 R91 K96 V97 I98	G90-R94 WeakPolarHBondContact O-CG 3.27Å; G90-R94 PolarHBondContact O-N 3.45Å; G90-R94 VanDerWaalsContact O-N 3.08Å; R91-R94 VanDerWaalsContact CG-NH2 3.3Å; R91-R94 PolarHBondContact O-N 2.85Å; R94-K96 PolarHBondContact O-N 2.83Å; R94-V97 PolarHBondContact O-N 3Å; R94-I98 WeakPolarHBondContact O-CB 3.14Å; R94-I98 WeakPolarHBondContact O-CD1 3.3Å; R94-I98 VanDerWaalsContact O-CG1 3.22Å; R94-I98 WeakPolarHBondContact O-CG1 3.36Å; R94-I98 PolarHBondContact O-N 2.93Å
95	N	57.4	Low	60.8	Low	83 Å²	83	100.2 Å²	100.2	44%	0.444	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-39.6	177	-75.3	-10.3	0	0	0	112.1	R91 L92 L93 I98 Q99 I109	R91-N95 WeakPolarHBondContact O-CB 3.31Å; R91-N95 PolarHBondContact O-N 3.33Å; L92-N95 PolarHBondContact O-N 3.46Å; L93-N95 PolarHBondContact O-N 3.34Å; N95-I98 PolarHBondContact O-N 2.88Å; N95-Q99 WeakPolarHBondContact O-CG 3.14Å; N95-Q99 PolarHBondContact O-N 3.19Å; N95-I109 HydrophobicContact CB-CD1 4.31Å
96	K	63.1	Low	60	Low	121 Å²	121	107.1 Å²	107.1	53%	0.526	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-40.1	175.3	-169.1	176.7	-178.7	-179.6	0	111.9	L92 L93 R94 Q99 Q100	L92-K96 WeakPolarHBondContact O-CB 3.22Å; L92-K96 PolarHBondContact O-N 3.16Å; L93-K96 PolarHBondContact O-N 2.85Å; R94-K96 PolarHBondContact O-N 2.83Å; K96-Q99 PolarHBondContact O-N 2.86Å; K96-Q100 WeakPolarHBondContact O-CG 3.23Å; K96-Q100 PolarHBondContact O-N 3.35Å
97	V	61.8	Low	59	Low	67 Å²	67	105.8 Å²	105.8	41%	0.406	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-43.7	173.7	172.1	0	0	0	0	111	L93 R94 Q99 Q100 M101	L93-V97 VanDerWaalsContact O-CG2 3.31Å; L93-V97 WeakPolarHBondContact O-CG2 3.41Å; L93-V97 PolarHBondContact O-N 2.86Å; R94-V97 PolarHBondContact O-N 3Å; V97-Q99 VanDerWaalsContact C-N 3.34Å; V97-Q99 PolarHBondContact O-N 3.37Å; V97-Q100 PolarHBondContact O-N 3.43Å; V97-M101 HydrophobicContact CG1-CE 3.83Å; V97-M101 HydrophobicContact CG1-SD 4.32Å; V97-M101 WeakPolarHBondContact O-CG 3.31Å; V97-M101 PolarHBondContact O-N 2.89Å
98	I	56.9	Low	58.4	Low	89 Å²	89	108.2 Å²	108.2	46%	0.456	53%	0.531	S	S	.	.	H	α-helix	trans	-63.1	-40	176.1	-68	163.7	0	0	0	111	R94 N95 Q100 M101 T102	R94-I98 WeakPolarHBondContact O-CB 3.14Å; R94-I98 WeakPolarHBondContact O-CD1 3.3Å; R94-I98 VanDerWaalsContact O-CG1 3.22Å; R94-I98 WeakPolarHBondContact O-CG1 3.36Å; R94-I98 PolarHBondContact O-N 2.93Å; N95-I98 PolarHBondContact O-N 2.88Å; I98-Q100 PolarHBondContact O-N 3.13Å; I98-M101 PolarHBondContact O-N 2.81Å; I98-T102 HydrophobicContact CG2-CG2 4.11Å; I98-T102 WeakPolarHBondContact O-CB 3.4Å; I98-T102 WeakPolarHBondContact O-CG2 3.2Å; I98-T102 PolarHBondContact O-N 3Å; I98-T102 PolarHBondContact O-OG1 3.17Å
99	Q	57	Low	58	Low	55 Å²	55	107.9 Å²	107.9	26%	0.257	53%	0.529	S	S	.	.	H	α-helix	trans	-61.2	-43.2	174.8	-80.6	-175.2	-38.4	0	0	112	N95 K96 V97 M101 T102 N103 F107 I109	N95-Q99 WeakPolarHBondContact O-CG 3.14Å; N95-Q99 PolarHBondContact O-N 3.19Å; K96-Q99 PolarHBondContact O-N 2.86Å; V97-Q99 VanDerWaalsContact C-N 3.34Å; V97-Q99 PolarHBondContact O-N 3.37Å; Q99-M101 VanDerWaalsContact C-N 3.3Å; Q99-M101 PolarHBondContact O-N 3.12Å; Q99-T102 PolarHBondContact O-N 2.83Å; Q99-N103 PolarHBondContact O-N 3.49Å; Q99-F107 VanDerWaalsContact NE2-CB 3.33Å; Q99-I109 HydrophobicContact CG-CD1 4.36Å; Q99-I109 VanDerWaalsContact NE2-CD1 3.28Å; Q99-I109 VanDerWaalsContact OE1-CD1 3.28Å
100	Q	62.4	Low	57.5	Low	150 Å²	150	108.6 Å²	108.6	70%	0.701	54%	0.542	S	S	*	.	H	α-helix	trans	-65.5	-33.2	176.5	-73.2	-176	-37.3	0	0	112.5	K96 V97 I98	K96-Q100 WeakPolarHBondContact O-CG 3.23Å; K96-Q100 PolarHBondContact O-N 3.35Å; V97-Q100 PolarHBondContact O-N 3.43Å; I98-Q100 PolarHBondContact O-N 3.13Å
101	M	54.2	Low	57.2	Low	153 Å²	153	109.3 Å²	109.3	75%	0.754	55%	0.549	S	S	*	.	H	α-helix	trans	-77.7	-29.1	176.7	-71.9	-177.5	179.5	0	0	113.8	V97 I98 Q99	V97-M101 HydrophobicContact CG1-CE 3.83Å; V97-M101 HydrophobicContact CG1-SD 4.32Å; V97-M101 WeakPolarHBondContact O-CG 3.31Å; V97-M101 PolarHBondContact O-N 2.89Å; I98-M101 PolarHBondContact O-N 2.81Å; Q99-M101 VanDerWaalsContact C-N 3.3Å; Q99-M101 PolarHBondContact O-N 3.12Å
102	T	57.9	Low	56.7	Low	73 Å²	73	105.5 Å²	105.5	45%	0.448	54%	0.539	S	S	.	.	H	α-helix	trans	-98.9	-4.4	-171.1	53.6	0	0	0	0	114.7	I98 Q99 M104	I98-T102 HydrophobicContact CG2-CG2 4.11Å; I98-T102 WeakPolarHBondContact O-CB 3.4Å; I98-T102 WeakPolarHBondContact O-CG2 3.2Å; I98-T102 PolarHBondContact O-N 3Å; I98-T102 PolarHBondContact O-OG1 3.17Å; Q99-T102 PolarHBondContact O-N 2.83Å; T102-M104 PolarHBondContact O-N 3.05Å
103	N	58.8	Low	56.5	Low	153 Å²	153	106 Å²	106	82%	0.818	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	24.4	-177.9	-123.9	-2	0	0	0	113.7	Q99 E105	Q99-N103 PolarHBondContact O-N 3.49Å; N103-E105 PolarHBondContact O-N 3.28Å
104	M	50.1	Low	56.3	Low	116 Å²	116	102.9 Å²	102.9	57%	0.571	54%	0.537	S	S	*	.			trans	-86.3	103.5	-178	-71.7	-86.2	-75.1	0	0	109.2	T102 H106	T102-M104 PolarHBondContact O-N 3.05Å; M104-H106 VanDerWaalsContact C-N 3.27Å; M104-H106 PolarHBondContact O-N 2.9Å
105	E	52.3	Low	56.2	Low	174 Å²	174	99.9 Å²	99.9	81%	0.813	53%	0.53	S	S	*	.			trans	-71	-6.9	-173.9	-74.5	-168.7	151.3	0	0	115.8	N103	N103-E105 PolarHBondContact O-N 3.28Å
106	H	51.3	Low	56.4	Low	162 Å²	162	97.2 Å²	97.2	75%	0.75	52%	0.515	S	S	*	.			trans	-137.1	87.4	-170	-74.8	75	0	0	0	113.1	M104	M104-H106 VanDerWaalsContact C-N 3.27Å; M104-H106 PolarHBondContact O-N 2.9Å
107	F	47.7	Very low	56.2	Low	143 Å²	143	95.8 Å²	95.8	63%	0.627	51%	0.513	S	S	*	.			trans	-128.7	130.3	157	-114.5	-86.4	0	0	0	108.3	Q99 I109	Q99-F107 VanDerWaalsContact NE2-CB 3.33Å; F107-I109 HydrophobicContact CB-CG1 4.17Å; F107-I109 PolarHBondContact O-N 2.82Å
108	P	52.9	Low	56.4	Low	115 Å²	115	97.8 Å²	97.8	75%	0.747	52%	0.521	S	S	*	.			trans	-75.3	67.5	-175.4	31.7	-35.5	0	0	0	111.4	V110	P108-V110 VanDerWaalsContact C-N 3.33Å
109	I	53.2	Low	56.6	Low	30 Å²	30	96.6 Å²	96.6	15%	0.154	51%	0.513	C	S	.	.	H	α-helix	trans	-81.6	-17.6	177.7	-56.1	-169.7	0	0	0	111.5	L92 N95 Q99 F107 G111 L112 S113	L92-I109 HydrophobicContact CD1-CG2 3.89Å; L92-I109 HydrophobicContact CG-CG2 4.39Å; N95-I109 HydrophobicContact CB-CD1 4.31Å; Q99-I109 HydrophobicContact CG-CD1 4.36Å; Q99-I109 VanDerWaalsContact NE2-CD1 3.28Å; Q99-I109 VanDerWaalsContact OE1-CD1 3.28Å; F107-I109 HydrophobicContact CB-CG1 4.17Å; F107-I109 PolarHBondContact O-N 2.82Å; I109-G111 PolarHBondContact O-N 2.88Å; I109-L112 PolarHBondContact O-N 2.99Å; I109-L112 VanDerWaalsContact O-N 3.12Å; I109-S113 PolarHBondContact O-N 2.88Å; I109-S113 VanDerWaalsContact O-N 3.09Å
110	V	55	Low	56.9	Low	122 Å²	122	99.9 Å²	99.9	74%	0.739	52%	0.523	S	S	*	.	H	α-helix	trans	-55.7	-41	-179.4	-177.5	0	0	0	0	111	P108 S113 A114	P108-V110 VanDerWaalsContact C-N 3.33Å; V110-S113 PolarHBondContact O-OG 3.44Å; V110-A114 PolarHBondContact O-N 3.47Å
111	G	57.8	Low	57.2	Low	37 Å²	37	96.7 Å²	96.7	38%	0.381	51%	0.511	S	S	.	.	H	α-helix	trans	-68.1	-41.6	177.2	0	0	0	0	0	114.3	I109 S113 A114 Q115	I109-G111 PolarHBondContact O-N 2.88Å; G111-S113 VanDerWaalsContact C-N 3.34Å; G111-S113 PolarHBondContact O-N 3.37Å; G111-A114 PolarHBondContact O-N 2.79Å; G111-Q115 WeakPolarHBondContact O-CB 3.34Å; G111-Q115 VanDerWaalsContact O-CG 3.23Å; G111-Q115 WeakPolarHBondContact O-CG 3.42Å; G111-Q115 PolarHBondContact O-N 2.85Å
112	L	56.2	Low	57.7	Low	68 Å²	68	91.8 Å²	91.8	36%	0.356	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-37.7	179.7	-88	156	0	0	0	112.2	F25 L92 I109 L116	F25-L112 HydrophobicContact CE2-CD2 3.95Å; F25-L112 HydrophobicContact CZ-CD2 3.75Å; L92-L112 HydrophobicContact CD1-CB 4.32Å; I109-L112 PolarHBondContact O-N 2.99Å; I109-L112 VanDerWaalsContact O-N 3.12Å; L112-L116 WeakPolarHBondContact O-CB 3.23Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 3.38Å
113	S	57.2	Low	57.8	Low	56 Å²	56	88.8 Å²	88.8	39%	0.392	48%	0.476	S	S	.	.	H	α-helix	trans	-67.7	-41.4	178.3	70.8	0	0	0	0	112.5	I109 V110 G111 L116 L117	I109-S113 PolarHBondContact O-N 2.88Å; I109-S113 VanDerWaalsContact O-N 3.09Å; V110-S113 PolarHBondContact O-OG 3.44Å; G111-S113 VanDerWaalsContact C-N 3.34Å; G111-S113 PolarHBondContact O-N 3.37Å; S113-L116 PolarHBondContact O-N 2.77Å; S113-L117 WeakPolarHBondContact O-CB 2.93Å; S113-L117 PolarHBondContact O-N 2.91Å
114	A	57.6	Low	58	Low	48 Å²	48	84 Å²	84	40%	0.397	45%	0.454	S	S	.	.	H	α-helix	trans	-67.6	-41.3	175.7	0	0	0	0	0	111.8	V110 G111 L117 N118	V110-A114 PolarHBondContact O-N 3.47Å; G111-A114 PolarHBondContact O-N 2.79Å; A114-L117 PolarHBondContact O-N 3Å; A114-N118 WeakPolarHBondContact O-CB 3.38Å; A114-N118 PolarHBondContact O-N 2.89Å
115	Q	60.5	Low	58.9	Low	83 Å²	83	85.1 Å²	85.1	39%	0.388	46%	0.456	S	S	.	.	H	α-helix	trans	-63.9	-42.1	175.7	-74	169.9	-1.7	0	0	112	P22 G111 L117 N118 F119	P22-Q115 HydrophobicContact CG-CG 4.35Å; G111-Q115 WeakPolarHBondContact O-CB 3.34Å; G111-Q115 VanDerWaalsContact O-CG 3.23Å; G111-Q115 WeakPolarHBondContact O-CG 3.42Å; G111-Q115 PolarHBondContact O-N 2.85Å; Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 3.35Å; Q115-N118 PolarHBondContact O-N 3.12Å; Q115-F119 VanDerWaalsContact O-CB 3.31Å; Q115-F119 WeakPolarHBondContact O-CB 3.23Å; Q115-F119 PolarHBondContact O-N 3.4Å
116	L	59.9	Low	59.4	Low	26 Å²	26	80.8 Å²	80.8	14%	0.136	44%	0.436	C	S	.	.	H	α-helix	trans	-65.1	-35.5	174.3	-81.5	165.4	0	0	0	112.6	L88 L92 L112 S113 R120	L88-L116 HydrophobicContact CB-CD1 4.47Å; L88-L116 HydrophobicContact CB-CD2 3.86Å; L88-L116 HydrophobicContact CD1-CD2 3.83Å; L88-L116 HydrophobicContact CG-CD2 4.49Å; L92-L116 HydrophobicContact CD1-CD1 3.96Å; L112-L116 WeakPolarHBondContact O-CB 3.23Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 3.38Å; S113-L116 PolarHBondContact O-N 2.77Å; L116-R120 WeakPolarHBondContact O-CB 3.48Å; L116-R120 PolarHBondContact O-N 3.39Å
117	L	60.7	Low	59.8	Low	91 Å²	91	76 Å²	76	48%	0.476	41%	0.414	S	S	.	.	H	α-helix	trans	-69.8	-44	176.4	-166.9	72.8	0	0	0	111.3	S113 A114 Q115 R120 N121	S113-L117 WeakPolarHBondContact O-CB 2.93Å; S113-L117 PolarHBondContact O-N 2.91Å; A114-L117 PolarHBondContact O-N 3Å; Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 3.35Å; L117-R120 WeakPolarHBondContact O-CB 3.49Å; L117-R120 PolarHBondContact O-N 3.34Å; L117-N121 VanDerWaalsContact O-CG 3.25Å; L117-N121 PolarHBondContact O-N 3.38Å
118	N	65.9	Low	60.5	Low	110 Å²	110	73.8 Å²	73.8	59%	0.588	41%	0.409	S	S	*	.	H	α-helix	trans	-62.1	-43.8	174.5	-79.9	-9.2	0	0	0	111.5	A114 Q115 R120 N121 A122	A114-N118 WeakPolarHBondContact O-CB 3.38Å; A114-N118 PolarHBondContact O-N 2.89Å; Q115-N118 PolarHBondContact O-N 3.12Å; N118-R120 PolarHBondContact O-N 3.04Å; N118-N121 PolarHBondContact O-N 3.45Å; N118-A122 PolarHBondContact O-N 2.98Å
119	F	60.3	Low	61	Low	63 Å²	63	73.1 Å²	73.1	28%	0.276	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-46.5	175.1	-172.3	-101.1	0	0	0	111.3	Q81 I85 Q115 N121 A122 V123	Q81-F119 HydrophobicContact CB-CE1 4.36Å; Q81-F119 HydrophobicContact CB-CZ 4.25Å; Q81-F119 HydrophobicContact CG-CZ 4.01Å; I85-F119 HydrophobicContact CD1-CD1 3.69Å; I85-F119 HydrophobicContact CD1-CE1 3.63Å; I85-F119 HydrophobicContact CG1-CD1 3.63Å; I85-F119 HydrophobicContact CG1-CE1 3.61Å; Q115-F119 VanDerWaalsContact O-CB 3.31Å; Q115-F119 WeakPolarHBondContact O-CB 3.23Å; Q115-F119 PolarHBondContact O-N 3.4Å; F119-N121 VanDerWaalsContact C-N 3.31Å; F119-N121 PolarHBondContact O-N 2.95Å; F119-A122 PolarHBondContact O-N 3.06Å; F119-V123 HydrophobicContact CD1-CG2 4.16Å; F119-V123 HydrophobicContact CE1-CG2 3.84Å; F119-V123 HydrophobicContact CZ-CG2 4.03Å; F119-V123 WeakPolarHBondContact O-CG2 3.29Å; F119-V123 PolarHBondContact O-N 3.29Å
120	R	63.2	Low	61.2	Low	124 Å²	124	74 Å²	74	47%	0.468	40%	0.4	S	S	.	.	H	α-helix	trans	-56.5	-45.5	174.6	179.5	-167.6	172.7	-161.1	-3.5	111.8	L116 L117 N118 A122 V123 C124	L116-R120 WeakPolarHBondContact O-CB 3.48Å; L116-R120 PolarHBondContact O-N 3.39Å; L117-R120 WeakPolarHBondContact O-CB 3.49Å; L117-R120 PolarHBondContact O-N 3.34Å; N118-R120 PolarHBondContact O-N 3.04Å; R120-A122 VanDerWaalsContact C-N 3.34Å; R120-V123 PolarHBondContact O-N 2.76Å; R120-C124 WeakPolarHBondContact O-CB 3.36Å; R120-C124 PolarHBondContact O-N 2.95Å; R120-C124 PolarHBondContact O-SG 3.44Å; R120-C124 VanDerWaalsContact O-SG 3.36Å
121	N	67.9	Low	61.4	Low	83 Å²	83	75 Å²	75	44%	0.444	40%	0.395	S	S	.	.	H	α-helix	trans	-65.5	-38.1	-178.7	-69.8	-13.8	0	0	0	111.6	L117 N118 F119 K125	L117-N121 VanDerWaalsContact O-CG 3.25Å; L117-N121 PolarHBondContact O-N 3.38Å; N118-N121 PolarHBondContact O-N 3.45Å; F119-N121 VanDerWaalsContact C-N 3.31Å; F119-N121 PolarHBondContact O-N 2.95Å; N121-K125 WeakPolarHBondContact O-CB 3.27Å; N121-K125 PolarHBondContact O-N 2.78Å
122	A	64.7	Low	61.4	Low	51 Å²	51	80.8 Å²	80.8	42%	0.421	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-48.4	174.1	0	0	0	0	0	111.7	N118 F119 R120 C124 K125 E126	N118-A122 PolarHBondContact O-N 2.98Å; F119-A122 PolarHBondContact O-N 3.06Å; R120-A122 VanDerWaalsContact C-N 3.34Å; A122-C124 PolarHBondContact O-N 3.48Å; A122-K125 PolarHBondContact O-N 3.31Å; A122-E126 PolarHBondContact O-N 2.83Å
123	V	60.9	Low	61.2	Low	10 Å²	10	85 Å²	85	6%	0.061	44%	0.436	C	S	.	.	H	α-helix	trans	-62.7	-42.3	178	177.6	0	0	0	0	111.9	I85 F119 R120 E126 M127	I85-V123 HydrophobicContact CD1-CG2 4.39Å; F119-V123 HydrophobicContact CD1-CG2 4.16Å; F119-V123 HydrophobicContact CE1-CG2 3.84Å; F119-V123 HydrophobicContact CZ-CG2 4.03Å; F119-V123 WeakPolarHBondContact O-CG2 3.29Å; F119-V123 PolarHBondContact O-N 3.29Å; R120-V123 PolarHBondContact O-N 2.76Å; V123-E126 PolarHBondContact O-N 3.33Å; V123-M127 WeakPolarHBondContact O-CG 3.43Å; V123-M127 PolarHBondContact O-N 3.04Å
124	C	63.4	Low	60.7	Low	53 Å²	53	85 Å²	85	36%	0.358	43%	0.434	S	S	.	.	H	α-helix	trans	-64.7	-41	177.1	-73.6	0	0	0	0	112.1	R120 A122 M127 D128	R120-C124 WeakPolarHBondContact O-CB 3.36Å; R120-C124 PolarHBondContact O-N 2.95Å; R120-C124 PolarHBondContact O-SG 3.44Å; R120-C124 VanDerWaalsContact O-SG 3.36Å; A122-C124 PolarHBondContact O-N 3.48Å; C124-M127 PolarHBondContact O-N 3.08Å; C124-D128 PolarHBondContact O-N 3.45Å; C124-D128 VanDerWaalsContact O-N 3.1Å
125	K	68.8	Low	60	Low	139 Å²	139	87.2 Å²	87.2	60%	0.604	44%	0.444	S	S	*	.	H	α-helix	trans	-62.2	-43.8	177.5	-173.1	-179.3	175.2	-171.3	0	111.5	N121 A122 M127 D128 E129	N121-K125 WeakPolarHBondContact O-CB 3.27Å; N121-K125 PolarHBondContact O-N 2.78Å; A122-K125 PolarHBondContact O-N 3.31Å; K125-M127 PolarHBondContact O-N 3.21Å; K125-D128 PolarHBondContact O-N 3.24Å; K125-E129 PolarHBondContact O-N 2.6Å; K125-E129 VanDerWaalsContact O-N 3.12Å
126	E	62	Low	59.7	Low	83 Å²	83	93.5 Å²	93.5	39%	0.388	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-39.9	175	-82.3	-174.2	-164	0	0	112.7	Y74 A122 V123 D128 E129 I130	Y74-E126 WeakPolarHBondContact OH-CB 3.45Å; Y74-E126 PolarHBondContact OH-OE2 2.88Å; A122-E126 PolarHBondContact O-N 2.83Å; V123-E126 PolarHBondContact O-N 3.33Å; E126-D128 VanDerWaalsContact C-N 3.3Å; E126-D128 PolarHBondContact O-N 3.47Å; E126-E129 PolarHBondContact O-N 2.78Å; E126-I130 VanDerWaalsContact O-CD1 3.28Å; E126-I130 WeakPolarHBondContact O-CD1 3.38Å; E126-I130 WeakPolarHBondContact O-CG1 3.49Å; E126-I130 PolarHBondContact O-N 3.11Å; E126-I130 VanDerWaalsContact O-N 3.17Å
127	M	59.5	Low	59.1	Low	60 Å²	60	96.7 Å²	96.7	30%	0.296	50%	0.495	S	S	.	.	H	α-helix	trans	-62.5	-35.7	175.3	-74.8	-171.2	75.8	0	0	113	I78 V123 C124 K125 K131	I78-M127 HydrophobicContact CG2-SD 4.42Å; V123-M127 WeakPolarHBondContact O-CG 3.43Å; V123-M127 PolarHBondContact O-N 3.04Å; C124-M127 PolarHBondContact O-N 3.08Å; K125-M127 PolarHBondContact O-N 3.21Å; M127-K131 WeakPolarHBondContact O-CG 3.1Å; M127-K131 PolarHBondContact O-N 3.34Å; M127-K131 VanDerWaalsContact O-N 3.17Å
128	D	62.9	Low	58.4	Low	98 Å²	98	96.3 Å²	96.3	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-72	-36.6	178.1	-71.8	-24.2	0	0	0	111.6	C124 K125 E126 I130 K131 L132	C124-D128 PolarHBondContact O-N 3.45Å; C124-D128 VanDerWaalsContact O-N 3.1Å; K125-D128 PolarHBondContact O-N 3.24Å; E126-D128 VanDerWaalsContact C-N 3.3Å; E126-D128 PolarHBondContact O-N 3.47Å; D128-I130 VanDerWaalsContact C-N 3.31Å; D128-I130 PolarHBondContact O-N 3.16Å; D128-K131 PolarHBondContact O-N 2.95Å; D128-L132 PolarHBondContact O-N 2.64Å
129	E	64.5	Low	57.4	Low	100 Å²	100	101.6 Å²	101.6	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-36	174.1	-71.5	177.9	-169.4	0	0	112	K125 E126 L132 M133	K125-E129 PolarHBondContact O-N 2.6Å; K125-E129 VanDerWaalsContact O-N 3.12Å; E126-E129 PolarHBondContact O-N 2.78Å; E129-L132 WeakPolarHBondContact O-CB 3.45Å; E129-L132 PolarHBondContact O-N 2.96Å; E129-M133 PolarHBondContact O-N 2.88Å
130	I	57	Low	56.4	Low	48 Å²	48	107.5 Å²	107.5	25%	0.246	54%	0.535	C	S	.	.	H	α-helix	trans	-77.3	-35.5	-179.5	-67.1	156.4	0	0	0	113	Y74 I78 E126 D128 L132 M133 T134	Y74-I130 HydrophobicContact CD1-CD1 3.56Å; Y74-I130 HydrophobicContact CE1-CD1 2.87Å; Y74-I130 HydrophobicContact CE1-CG1 4.22Å; Y74-I130 HydrophobicContact CE2-CD1 4.41Å; Y74-I130 WeakPolarHBondContact OH-CD1 3.16Å; I78-I130 HydrophobicContact CD1-CD1 4.41Å; E126-I130 VanDerWaalsContact O-CD1 3.28Å; E126-I130 WeakPolarHBondContact O-CD1 3.38Å; E126-I130 WeakPolarHBondContact O-CG1 3.49Å; E126-I130 PolarHBondContact O-N 3.11Å; E126-I130 VanDerWaalsContact O-N 3.17Å; D128-I130 VanDerWaalsContact C-N 3.31Å; D128-I130 PolarHBondContact O-N 3.16Å; I130-L132 PolarHBondContact O-N 3.49Å; I130-M133 PolarHBondContact O-N 3.4Å; I130-M133 VanDerWaalsContact O-N 3.11Å; I130-T134 HydrophobicContact CG2-CG2 4.38Å; I130-T134 PolarHBondContact O-N 3.23Å; I130-T134 PolarHBondContact O-OG1 3.32Å
131	K	58.3	Low	55.3	Low	144 Å²	144	105.9 Å²	105.9	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-61.2	-28.2	170.6	-77.2	176.7	-176.1	168.8	0	111.6	M127 D128	M127-K131 WeakPolarHBondContact O-CG 3.1Å; M127-K131 PolarHBondContact O-N 3.34Å; M127-K131 VanDerWaalsContact O-N 3.17Å; D128-K131 PolarHBondContact O-N 2.95Å
132	L	57.9	Low	54.2	Low	158 Å²	158	109.3 Å²	109.3	83%	0.827	55%	0.551	S	S	*	*	H	α-helix	trans	-75	-32.7	174.3	-134.7	82.7	0	0	0	112.6	D128 E129 I130	D128-L132 PolarHBondContact O-N 2.64Å; E129-L132 WeakPolarHBondContact O-CB 3.45Å; E129-L132 PolarHBondContact O-N 2.96Å; I130-L132 PolarHBondContact O-N 3.49Å
133	M	53.3	Low	53.2	Low	156 Å²	156	113 Å²	113	77%	0.768	57%	0.568	S	S	*	*	H	α-helix	trans	-87.9	-13.9	-177.7	-69	-172.4	-174.7	0	0	114.8	E129 I130	E129-M133 PolarHBondContact O-N 2.88Å; I130-M133 PolarHBondContact O-N 3.4Å; I130-M133 VanDerWaalsContact O-N 3.11Å
134	T	45	Very low	52.2	Low	56 Å²	56	116.7 Å²	116.7	34%	0.344	60%	0.6	S	S	.	*	S	Bend	trans	-100.9	114.8	-178.8	44	0	0	0	0	111.8	L71 I130	L71-T134 HydrophobicContact CD1-CG2 3.92Å; I130-T134 HydrophobicContact CG2-CG2 4.38Å; I130-T134 PolarHBondContact O-N 3.23Å; I130-T134 PolarHBondContact O-OG1 3.32Å
135	P	44.2	Very low	51.2	Low	95 Å²	95	120.7 Å²	120.7	62%	0.617	62%	0.623	S	S	*	*			trans	-63	138.8	171.4	23.7	-30.1	0	0	0	110.2	S137	P135-S137 PolarHBondContact O-N 3.17Å
136	K	53.6	Low	50	Low	215 Å²	215	119.4 Å²	119.4	94%	0.935	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-0.5	-174	-80.3	176.7	174.2	173.4	0	116.6
137	S	47.2	Very low	49	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-19.3	-172.9	61.4	0	0	0	0	115.5	P135	P135-S137 PolarHBondContact O-N 3.17Å
138	T	46.7	Very low	48.3	Very low	83 Å²	83	124.2 Å²	124.2	51%	0.509	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-85.3	-15	-170.8	-46.1	0	0	0	0	114.3	K140	T138-K140 VanDerWaalsContact C-N 3.31Å; T138-K140 PolarHBondContact O-N 2.71Å
139	Y	43.7	Very low	47.5	Very low	220 Å²	220	128.3 Å²	128.3	86%	0.863	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-74.4	-13.1	-174.9	-116.6	-88.8	0	0	0	115
140	K	40.5	Very low	46.5	Very low	188 Å²	188	131.7 Å²	131.7	82%	0.817	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-87.2	-10.9	-178.3	-88.5	-173.7	174.2	-176.4	0	115.3	T138	T138-K140 VanDerWaalsContact C-N 3.31Å; T138-K140 PolarHBondContact O-N 2.71Å
141	S	40.3	Very low	46.4	Very low	90 Å²	90	138 Å²	138	63%	0.629	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-8.8	-169.4	-165.5	0	0	0	0	115.6
142	Y	44.4	Very low	45.8	Very low	155 Å²	155	137.7 Å²	137.7	61%	0.608	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	8.7	-171.9	-74.1	-78.6	0	0	0	115.1	Q68	Q68-Y142 PolarHBondContact NE2-OH 3.42Å
143	T	44	Very low	45.1	Very low	128 Å²	128	136.6 Å²	136.6	79%	0.785	78%	0.781	S	S	*	*	S	Bend	trans	-120	10.3	-177.7	30	0	0	0	0	114.7
144	A	40.2	Very low	44.7	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	78%	0.782	S	S	*	*	S	Bend	trans	-115	9.3	-173.3	0	0	0	0	0	116.2
145	T	42.4	Very low	44.7	Very low	137 Å²	137	140.2 Å²	140.2	84%	0.84	81%	0.808	S	S	*	*	S	Bend	trans	-126.4	68	178	39.7	0	0	0	0	111.6
146	S	42.6	Very low	44.7	Very low	112 Å²	112	143 Å²	143	78%	0.783	82%	0.82	S	S	*	*	S	Bend	trans	-161.7	82.8	156.7	67.8	0	0	0	0	109.1
147	S	41.9	Very low	44.1	Very low	124 Å²	124	138.2 Å²	138.2	87%	0.867	81%	0.812	S	S	*	*			trans	161.4	91.7	162.1	168.7	0	0	0	0	109
148	S	45	Very low	43.9	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	82%	0.823	S	S	*	*			trans	-169.3	64.7	150.9	64.8	0	0	0	0	108.7
149	E	44.5	Very low	43.7	Very low	184 Å²	184	145.8 Å²	145.8	86%	0.86	85%	0.847	S	S	*	*			trans	-106.9	116.9	147.1	-77.5	-179.8	139	0	0	103.7
150	D	44.9	Very low	43.7	Very low	172 Å²	172	139.7 Å²	139.7	92%	0.92	85%	0.846	S	S	*	*			trans	148.2	88.3	162.4	-77	-20.6	0	0	0	110
151	A	53.6	Low	44	Very low	179 Å²	179	135.3 Å²	135.3	100%	1.479	85%	0.848	S	S	*	*			trans	-162.1	0	148.9	0	0	0	0	0	108.8

Retrieved 151 of 151 residues in 102.8 ms (Link to these results)

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