A0A077YWM8_TRITR Loading...

7TM GPCR Srw domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWM8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 185 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	44.1	Very low	57.2	Low	245 Å²	245	145.5 Å²	145.5	100%	1.207	72%	0.721	S	S	*	*				0	121.3	0	-79.7	-178.5	-176.4	0	0	108.7
2	R	52.5	Low	58.1	Low	237 Å²	237	140.9 Å²	140.9	89%	0.894	70%	0.701	S	S	*	*			trans	103.6	34.5	-177.9	-64.2	-161.8	-106.9	-165.2	-6.9	119.6
3	E	55.7	Low	59	Low	170 Å²	170	140.9 Å²	140.9	79%	0.794	69%	0.689	S	S	*	*	S	Bend	trans	-104.5	-20.1	162.5	-66.6	-164.2	112.6	0	0	113.8	S5 Q6	E3-S5 VanDerWaalsContact C-N 3.27Å; E3-S5 PolarHBondContact O-N 3.43Å; E3-Q6 PolarHBondContact O-N 3.43Å
4	I	54.9	Low	59.8	Low	154 Å²	154	141.9 Å²	141.9	79%	0.79	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-19.9	-175.2	-55.8	173.1	0	0	0	112.7
5	S	56.7	Low	60.9	Low	101 Å²	101	141.9 Å²	141.9	71%	0.706	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-8.4	-177.2	-179.6	0	0	0	0	114.9	E3	E3-S5 VanDerWaalsContact C-N 3.27Å; E3-S5 PolarHBondContact O-N 3.43Å
6	Q	55.6	Low	62	Low	149 Å²	149	137.4 Å²	137.4	70%	0.696	67%	0.668	S	S	*	*	S	Bend	trans	-81.5	-24.7	-175.9	-69.8	-153.7	-63	0	0	114.1	E3	E3-Q6 PolarHBondContact O-N 3.43Å
7	A	56.9	Low	62.7	Low	86 Å²	86	133.9 Å²	133.9	71%	0.711	65%	0.65	S	S	*	*	S	Bend	trans	-81.7	-24.4	-174.3	0	0	0	0	0	113.9	H9	A7-H9 PolarHBondContact O-N 2.88Å
8	E	61	Low	63	Low	137 Å²	137	131.1 Å²	131.1	64%	0.64	64%	0.641	S	S	*	*	S	Bend	trans	-68	-38.5	-165.7	-61.3	-86.9	131.5	0	0	112.6
9	H	62.4	Low	63.6	Low	88 Å²	88	125.8 Å²	125.8	41%	0.407	62%	0.619	S	S	.	*			trans	-145.5	80.7	-174.9	-70.1	-44.1	0	0	0	113.9	A7 W11 L12 Y13	A7-H9 PolarHBondContact O-N 2.88Å; H9-W11 HydrophobicContact CB-CZ2 4.49Å; H9-W11 AromaticContact CE1-CZ2 3.61Å; H9-W11 AromaticContact CG-CE2 3.89Å; H9-W11 AromaticContact CG-NE1 3.63Å; H9-W11 AromaticContact ND1-CE2 3.2Å; H9-W11 AromaticContact ND1-CH2 3.85Å; H9-W11 AromaticContact ND1-CZ2 2.92Å; H9-W11 WeakPolarHBondContact ND1-CZ2 3.43Å; H9-W11 AromaticContact ND1-NE1 3.3Å; H9-W11 PolarHBondContact ND1-NE1 3.47Å; H9-W11 PolarHBondContact O-N 2.91Å; H9-L12 HydrophobicContact CB-CB 3.93Å; H9-L12 HydrophobicContact CB-CD1 3.58Å; H9-L12 HydrophobicContact CB-CG 3.71Å; H9-L12 WeakPolarHBondContact O-CB 3.39Å; H9-L12 PolarHBondContact O-N 2.93Å; H9-Y13 PolarHBondContact O-N 3.32Å
10	P	65.4	Low	63.8	Low	75 Å²	75	125.2 Å²	125.2	49%	0.487	62%	0.617	S	S	.	*	H	α-helix	trans	-60.2	-27.5	177.1	22.5	-32.8	0	0	0	113.4	K14	P10-K14 PolarHBondContact O-N 3.47Å
11	W	63.9	Low	63.9	Low	159 Å²	159	126.5 Å²	126.5	60%	0.602	62%	0.62	S	S	*	*	H	α-helix	trans	-68.4	-35.5	173.8	46.8	85.8	0	0	0	112.7	H9 K14 F15	H9-W11 HydrophobicContact CB-CZ2 4.49Å; H9-W11 AromaticContact CE1-CZ2 3.61Å; H9-W11 AromaticContact CG-CE2 3.89Å; H9-W11 AromaticContact CG-NE1 3.63Å; H9-W11 AromaticContact ND1-CE2 3.2Å; H9-W11 AromaticContact ND1-CH2 3.85Å; H9-W11 AromaticContact ND1-CZ2 2.92Å; H9-W11 WeakPolarHBondContact ND1-CZ2 3.43Å; H9-W11 AromaticContact ND1-NE1 3.3Å; H9-W11 PolarHBondContact ND1-NE1 3.47Å; H9-W11 PolarHBondContact O-N 2.91Å; W11-K14 PolarHBondContact O-N 2.95Å; W11-F15 WeakPolarHBondContact O-CB 3.45Å; W11-F15 PolarHBondContact O-N 2.9Å
12	L	67.9	Low	64.9	Low	90 Å²	90	119.1 Å²	119.1	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-65.3	-42.2	176.3	-73.2	179.5	0	0	0	110.7	H9 F15 V16	H9-L12 HydrophobicContact CB-CB 3.93Å; H9-L12 HydrophobicContact CB-CD1 3.58Å; H9-L12 HydrophobicContact CB-CG 3.71Å; H9-L12 WeakPolarHBondContact O-CB 3.39Å; H9-L12 PolarHBondContact O-N 2.93Å; L12-F15 PolarHBondContact O-N 3.35Å; L12-V16 VanDerWaalsContact O-CB 3.27Å; L12-V16 WeakPolarHBondContact O-CB 3.18Å; L12-V16 WeakPolarHBondContact O-CG2 3.36Å; L12-V16 PolarHBondContact O-N 3.49Å
13	Y	69.7	Low	65.7	Low	141 Å²	141	112.1 Å²	112.1	55%	0.553	57%	0.568	S	S	*	*	H	α-helix	trans	-63.2	-46.4	177.6	-179.1	-98.3	0	0	0	112.3	H9 F15 V16 H17	H9-Y13 PolarHBondContact O-N 3.32Å; Y13-F15 VanDerWaalsContact C-N 3.34Å; Y13-F15 PolarHBondContact O-N 3.22Å; Y13-V16 PolarHBondContact O-N 3.38Å; Y13-H17 AromaticContact CD1-CD2 3.93Å; Y13-H17 AromaticContact CD2-CD2 3.87Å; Y13-H17 AromaticContact CE1-CD2 3.45Å; Y13-H17 VanDerWaalsContact CE1-CD2 3.45Å; Y13-H17 WeakPolarHBondContact CE1-CD2 3.23Å; Y13-H17 AromaticContact CE1-NE2 3.85Å; Y13-H17 AromaticContact CE2-CD2 3.38Å; Y13-H17 WeakPolarHBondContact CE2-CD2 3.44Å; Y13-H17 AromaticContact CE2-NE2 3.33Å; Y13-H17 VanDerWaalsContact CE2-NE2 3.33Å; Y13-H17 WeakPolarHBondContact CE2-NE2 3.21Å; Y13-H17 AromaticContact CZ-CD2 3.16Å; Y13-H17 AromaticContact CZ-NE2 3.1Å; Y13-H17 WeakPolarHBondContact O-CB 3.46Å; Y13-H17 PolarHBondContact O-N 3.28Å; Y13-H17 PolarHBondContact OH-NE2 3.4Å
14	K	70.9	Confident	66	Low	155 Å²	155	107.1 Å²	107.1	67%	0.674	55%	0.55	S	S	*	*	H	α-helix	trans	-61.6	-43.1	174.6	-78.1	-171.8	177.1	-179.6	0	111.6	P10 W11 H17 V18	P10-K14 PolarHBondContact O-N 3.47Å; W11-K14 PolarHBondContact O-N 2.95Å; K14-H17 PolarHBondContact O-N 3.5Å; K14-V18 WeakPolarHBondContact O-CB 3.44Å; K14-V18 VanDerWaalsContact O-CG2 3.24Å; K14-V18 WeakPolarHBondContact O-CG2 3.17Å; K14-V18 PolarHBondContact O-N 2.84Å
15	F	76.4	Confident	66.4	Low	141 Å²	141	104.1 Å²	104.1	62%	0.618	54%	0.536	S	S	*	.	H	α-helix	trans	-64.5	-43.5	178.1	-175.5	-97.8	0	0	0	111.8	W11 L12 Y13 V18 S19	W11-F15 WeakPolarHBondContact O-CB 3.45Å; W11-F15 PolarHBondContact O-N 2.9Å; L12-F15 PolarHBondContact O-N 3.35Å; Y13-F15 VanDerWaalsContact C-N 3.34Å; Y13-F15 PolarHBondContact O-N 3.22Å; F15-V18 PolarHBondContact O-N 3.43Å; F15-S19 WeakPolarHBondContact O-CB 3.41Å; F15-S19 PolarHBondContact O-N 3.37Å; F15-S19 PolarHBondContact O-OG 3.07Å
16	V	77.6	Confident	67.1	Low	71 Å²	71	103.6 Å²	103.6	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-44.9	176.1	169.5	0	0	0	0	110	L12 Y13 S19 L20	L12-V16 VanDerWaalsContact O-CB 3.27Å; L12-V16 WeakPolarHBondContact O-CB 3.18Å; L12-V16 WeakPolarHBondContact O-CG2 3.36Å; L12-V16 PolarHBondContact O-N 3.49Å; Y13-V16 PolarHBondContact O-N 3.38Å; V16-S19 PolarHBondContact O-N 2.98Å; V16-L20 HydrophobicContact CG1-CD1 3.63Å; V16-L20 HydrophobicContact CG1-CG 4.11Å; V16-L20 VanDerWaalsContact O-CB 3.22Å; V16-L20 WeakPolarHBondContact O-CB 3.4Å; V16-L20 WeakPolarHBondContact O-CG 3.23Å; V16-L20 PolarHBondContact O-N 3.03Å
17	H	73.6	Confident	67.6	Low	78 Å²	78	100.4 Å²	100.4	36%	0.361	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-42.8	177.5	-98.1	-78.6	0	0	0	113.5	Y13 K14 K21	Y13-H17 AromaticContact CD1-CD2 3.93Å; Y13-H17 AromaticContact CD2-CD2 3.87Å; Y13-H17 AromaticContact CE1-CD2 3.45Å; Y13-H17 VanDerWaalsContact CE1-CD2 3.45Å; Y13-H17 WeakPolarHBondContact CE1-CD2 3.23Å; Y13-H17 AromaticContact CE1-NE2 3.85Å; Y13-H17 AromaticContact CE2-CD2 3.38Å; Y13-H17 WeakPolarHBondContact CE2-CD2 3.44Å; Y13-H17 AromaticContact CE2-NE2 3.33Å; Y13-H17 VanDerWaalsContact CE2-NE2 3.33Å; Y13-H17 WeakPolarHBondContact CE2-NE2 3.21Å; Y13-H17 AromaticContact CZ-CD2 3.16Å; Y13-H17 AromaticContact CZ-NE2 3.1Å; Y13-H17 WeakPolarHBondContact O-CB 3.46Å; Y13-H17 PolarHBondContact O-N 3.28Å; Y13-H17 PolarHBondContact OH-NE2 3.4Å; K14-H17 PolarHBondContact O-N 3.5Å; H17-K21 WeakPolarHBondContact O-CG 3.46Å; H17-K21 PolarHBondContact O-N 2.89Å
18	V	68.5	Low	67.9	Low	82 Å²	82	99.9 Å²	99.9	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-67.3	-42.6	177.3	169	0	0	0	0	110.2	K14 F15 K21 L22	K14-V18 WeakPolarHBondContact O-CB 3.44Å; K14-V18 VanDerWaalsContact O-CG2 3.24Å; K14-V18 WeakPolarHBondContact O-CG2 3.17Å; K14-V18 PolarHBondContact O-N 2.84Å; F15-V18 PolarHBondContact O-N 3.43Å; V18-K21 PolarHBondContact O-N 3.2Å; V18-L22 HydrophobicContact CG1-CD1 3.47Å; V18-L22 VanDerWaalsContact CG1-CD1 3.47Å; V18-L22 HydrophobicContact CG1-CG 4.31Å; V18-L22 VanDerWaalsContact O-CB 3.29Å; V18-L22 WeakPolarHBondContact O-CB 3.16Å; V18-L22 WeakPolarHBondContact O-CG 3.41Å; V18-L22 PolarHBondContact O-N 2.81Å
19	S	74.3	Confident	68.1	Low	31 Å²	31	96.4 Å²	96.4	22%	0.217	50%	0.495	C	S	.	.	H	α-helix	trans	-65.1	-44.9	175.6	-60.9	0	0	0	0	111.7	F15 V16 K21 L22 V23	F15-S19 WeakPolarHBondContact O-CB 3.41Å; F15-S19 PolarHBondContact O-N 3.37Å; F15-S19 PolarHBondContact O-OG 3.07Å; V16-S19 PolarHBondContact O-N 2.98Å; S19-K21 PolarHBondContact O-N 3.05Å; S19-L22 PolarHBondContact O-N 3.27Å; S19-V23 WeakPolarHBondContact O-CA 3.43Å; S19-V23 WeakPolarHBondContact O-CB 3.31Å; S19-V23 WeakPolarHBondContact O-CG2 3.47Å; S19-V23 PolarHBondContact O-N 3.12Å
20	L	67.6	Low	68.4	Low	113 Å²	113	97.2 Å²	97.2	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-61.3	-31.3	177.9	-76.9	171.5	0	0	0	112.6	V16 P24	V16-L20 HydrophobicContact CG1-CD1 3.63Å; V16-L20 HydrophobicContact CG1-CG 4.11Å; V16-L20 VanDerWaalsContact O-CB 3.22Å; V16-L20 WeakPolarHBondContact O-CB 3.4Å; V16-L20 WeakPolarHBondContact O-CG 3.23Å; V16-L20 PolarHBondContact O-N 3.03Å; L20-P24 WeakPolarHBondContact O-CD 3.44Å; L20-P24 WeakPolarHBondContact O-CG 3.5Å
21	K	66	Low	68.6	Low	153 Å²	153	96.9 Å²	96.9	67%	0.665	50%	0.499	S	S	*	.	H	α-helix	trans	-82.1	-40.3	174.8	-73	-175.8	177	-177.1	0	112.8	H17 V18 S19 N25	H17-K21 WeakPolarHBondContact O-CG 3.46Å; H17-K21 PolarHBondContact O-N 2.89Å; V18-K21 PolarHBondContact O-N 3.2Å; S19-K21 PolarHBondContact O-N 3.05Å; K21-N25 PolarHBondContact O-OD1 2.74Å
22	L	65.6	Low	68.7	Low	90 Å²	90	90.8 Å²	90.8	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-82.3	-40.9	-176	-74.3	172.2	0	0	0	113	V18 S19 N25 I26	V18-L22 HydrophobicContact CG1-CD1 3.47Å; V18-L22 VanDerWaalsContact CG1-CD1 3.47Å; V18-L22 HydrophobicContact CG1-CG 4.31Å; V18-L22 VanDerWaalsContact O-CB 3.29Å; V18-L22 WeakPolarHBondContact O-CB 3.16Å; V18-L22 WeakPolarHBondContact O-CG 3.41Å; V18-L22 PolarHBondContact O-N 2.81Å; S19-L22 PolarHBondContact O-N 3.27Å; L22-N25 PolarHBondContact O-N 2.81Å; L22-N25 VanDerWaalsContact O-N 3.15Å; L22-I26 HydrophobicContact CB-CG1 4.4Å; L22-I26 HydrophobicContact CD2-CG1 4.37Å; L22-I26 WeakPolarHBondContact O-CB 3.28Å; L22-I26 VanDerWaalsContact O-CG1 3.26Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.14Å
23	V	68.2	Low	68.7	Low	91 Å²	91	91.1 Å²	91.1	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-55.3	-52.3	-175.6	171	0	0	0	0	112.2	S19 N25 S27	S19-V23 WeakPolarHBondContact O-CA 3.43Å; S19-V23 WeakPolarHBondContact O-CB 3.31Å; S19-V23 WeakPolarHBondContact O-CG2 3.47Å; S19-V23 PolarHBondContact O-N 3.12Å; V23-N25 VanDerWaalsContact C-N 3.33Å; V23-N25 PolarHBondContact O-N 2.86Å; V23-S27 WeakPolarHBondContact O-CB 3.42Å; V23-S27 PolarHBondContact O-N 2.87Å
24	P	63.4	Low	68.5	Low	64 Å²	64	88.4 Å²	88.4	42%	0.416	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-34.6	178.2	24.7	-31.7	0	0	0	112.1	L20 T28	L20-P24 WeakPolarHBondContact O-CD 3.44Å; L20-P24 WeakPolarHBondContact O-CG 3.5Å; P24-T28 WeakPolarHBondContact O-CB 3.42Å; P24-T28 VanDerWaalsContact O-CG2 3.23Å; P24-T28 WeakPolarHBondContact O-CG2 2.95Å; P24-T28 PolarHBondContact O-N 3.07Å; P24-T28 PolarHBondContact O-OG1 3.32Å
25	N	63.2	Low	68.3	Low	91 Å²	91	84 Å²	84	49%	0.487	46%	0.461	S	S	.	.	H	α-helix	trans	-72	-45.1	-177.7	-69.4	31.3	0	0	0	111.7	K21 L22 V23 T28 T29	K21-N25 PolarHBondContact O-OD1 2.74Å; L22-N25 PolarHBondContact O-N 2.81Å; L22-N25 VanDerWaalsContact O-N 3.15Å; V23-N25 VanDerWaalsContact C-N 3.33Å; V23-N25 PolarHBondContact O-N 2.86Å; N25-T28 PolarHBondContact O-OG1 3.18Å; N25-T28 VanDerWaalsContact O-OG1 3.06Å; N25-T29 VanDerWaalsContact O-CB 3.32Å; N25-T29 WeakPolarHBondContact O-CB 3.03Å; N25-T29 PolarHBondContact O-N 3.44Å; N25-T29 PolarHBondContact O-OG1 2.76Å
26	I	71.3	Confident	67.8	Low	90 Å²	90	80.2 Å²	80.2	46%	0.462	45%	0.446	S	S	.	.	H	α-helix	trans	-75.1	-43.1	-179.4	-58.9	-61.4	0	0	0	111	L22 T28 T29 I30	L22-I26 HydrophobicContact CB-CG1 4.4Å; L22-I26 HydrophobicContact CD2-CG1 4.37Å; L22-I26 WeakPolarHBondContact O-CB 3.28Å; L22-I26 VanDerWaalsContact O-CG1 3.26Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.14Å; I26-T28 PolarHBondContact O-N 3.37Å; I26-T29 PolarHBondContact O-N 3.39Å; I26-T29 VanDerWaalsContact O-N 3.1Å; I26-I30 HydrophobicContact CG2-CD1 4.12Å; I26-I30 PolarHBondContact O-N 3Å
27	S	66.1	Low	67.5	Low	83 Å²	83	81 Å²	81	58%	0.58	45%	0.451	S	S	*	.	H	α-helix	trans	-61.6	-32.6	179.1	-175	0	0	0	0	112	V23 P31	V23-S27 WeakPolarHBondContact O-CB 3.42Å; V23-S27 PolarHBondContact O-N 2.87Å; S27-P31 WeakPolarHBondContact O-CD 3.28Å; S27-P31 VanDerWaalsContact O-CG 3.23Å; S27-P31 WeakPolarHBondContact O-CG 3.32Å
28	T	61.8	Low	66.8	Low	75 Å²	75	81.6 Å²	81.6	46%	0.46	46%	0.457	S	S	.	.	H	α-helix	trans	-79.1	-39.2	172	54.8	0	0	0	0	112.2	P24 N25 I26 I30 P31 L32	P24-T28 WeakPolarHBondContact O-CB 3.42Å; P24-T28 VanDerWaalsContact O-CG2 3.23Å; P24-T28 WeakPolarHBondContact O-CG2 2.95Å; P24-T28 PolarHBondContact O-N 3.07Å; P24-T28 PolarHBondContact O-OG1 3.32Å; N25-T28 PolarHBondContact O-OG1 3.18Å; N25-T28 VanDerWaalsContact O-OG1 3.06Å; I26-T28 PolarHBondContact O-N 3.37Å; T28-I30 PolarHBondContact O-N 3.27Å; T28-P31 WeakPolarHBondContact O-CD 3.47Å; T28-P31 WeakPolarHBondContact O-CG 3.16Å; T28-L32 VanDerWaalsContact O-CB 3.28Å; T28-L32 WeakPolarHBondContact O-CB 3.44Å; T28-L32 WeakPolarHBondContact O-CD1 3.13Å; T28-L32 WeakPolarHBondContact O-CG 3.23Å; T28-L32 PolarHBondContact O-N 3.06Å
29	T	66.2	Low	66.5	Low	63 Å²	63	78.1 Å²	78.1	39%	0.387	44%	0.435	S	S	.	.	H	α-helix	trans	-63.7	-42.6	-172.9	-61.4	0	0	0	0	113.9	N25 I26 L32 L33	N25-T29 VanDerWaalsContact O-CB 3.32Å; N25-T29 WeakPolarHBondContact O-CB 3.03Å; N25-T29 PolarHBondContact O-N 3.44Å; N25-T29 PolarHBondContact O-OG1 2.76Å; I26-T29 PolarHBondContact O-N 3.39Å; I26-T29 VanDerWaalsContact O-N 3.1Å; T29-L32 CarbonylContact O-C 3.58Å; T29-L32 WeakPolarHBondContact O-CB 3.36Å; T29-L32 PolarHBondContact O-N 2.77Å; T29-L33 HydrophobicContact CG2-CD1 4.08Å; T29-L33 HydrophobicContact CG2-CG 4.1Å; T29-L33 WeakPolarHBondContact O-CG 3.35Å; T29-L33 PolarHBondContact O-N 3.25Å
30	I	69	Low	66.2	Low	106 Å²	106	79.4 Å²	79.4	54%	0.544	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-53.9	-176.3	-63.3	173.7	0	0	0	112.8	I26 T28 L32 L33 V34	I26-I30 HydrophobicContact CG2-CD1 4.12Å; I26-I30 PolarHBondContact O-N 3Å; T28-I30 PolarHBondContact O-N 3.27Å; I30-L32 PolarHBondContact O-N 3.14Å; I30-L33 PolarHBondContact O-N 3.41Å; I30-V34 PolarHBondContact O-N 3.1Å
31	P	68.7	Low	66.1	Low	67 Å²	67	79.5 Å²	79.5	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-62.2	-34.6	175.2	23.2	-31.7	0	0	0	110.9	S27 T28 V34 L35	S27-P31 WeakPolarHBondContact O-CD 3.28Å; S27-P31 VanDerWaalsContact O-CG 3.23Å; S27-P31 WeakPolarHBondContact O-CG 3.32Å; T28-P31 WeakPolarHBondContact O-CD 3.47Å; T28-P31 WeakPolarHBondContact O-CG 3.16Å; P31-V34 PolarHBondContact O-N 3.37Å; P31-L35 WeakPolarHBondContact O-CB 3.25Å; P31-L35 WeakPolarHBondContact O-CD1 3.16Å; P31-L35 WeakPolarHBondContact O-CG 3.39Å; P31-L35 PolarHBondContact O-N 3.14Å
32	L	66.5	Low	66	Low	32 Å²	32	75.6 Å²	75.6	17%	0.168	43%	0.434	C	S	.	.	H	α-helix	trans	-62	-43.9	175.7	-72.6	169.4	0	0	0	112.8	T28 T29 I30 L35 I36 F81	T28-L32 VanDerWaalsContact O-CB 3.28Å; T28-L32 WeakPolarHBondContact O-CB 3.44Å; T28-L32 WeakPolarHBondContact O-CD1 3.13Å; T28-L32 WeakPolarHBondContact O-CG 3.23Å; T28-L32 PolarHBondContact O-N 3.06Å; T29-L32 CarbonylContact O-C 3.58Å; T29-L32 WeakPolarHBondContact O-CB 3.36Å; T29-L32 PolarHBondContact O-N 2.77Å; I30-L32 PolarHBondContact O-N 3.14Å; L32-L35 CarbonylContact O-C 3.53Å; L32-L35 WeakPolarHBondContact O-CA 3.14Å; L32-L35 WeakPolarHBondContact O-CB 3.35Å; L32-L35 PolarHBondContact O-N 3.36Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.33Å; L32-I36 PolarHBondContact O-N 3.14Å; L32-F81 HydrophobicContact CD1-CE1 3.42Å; L32-F81 VanDerWaalsContact CD1-CE1 3.42Å; L32-F81 HydrophobicContact CD1-CZ 3.77Å; L32-F81 HydrophobicContact CD2-CD1 3.52Å; L32-F81 HydrophobicContact CD2-CE1 3.22Å; L32-F81 HydrophobicContact CD2-CZ 3.99Å; L32-F81 HydrophobicContact CG-CE1 3.93Å
33	L	67.8	Low	66	Low	97 Å²	97	76.3 Å²	76.3	51%	0.508	44%	0.438	S	S	.	.	H	α-helix	trans	-61.3	-45.4	178.4	-75.4	175.9	0	0	0	112.4	T29 I30 L35 I36 V37	T29-L33 HydrophobicContact CG2-CD1 4.08Å; T29-L33 HydrophobicContact CG2-CG 4.1Å; T29-L33 WeakPolarHBondContact O-CG 3.35Å; T29-L33 PolarHBondContact O-N 3.25Å; I30-L33 PolarHBondContact O-N 3.41Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.86Å; L33-I36 HydrophobicContact CD2-CD1 3.84Å; L33-I36 WeakPolarHBondContact O-CB 3.48Å; L33-I36 PolarHBondContact O-N 2.71Å; L33-I36 VanDerWaalsContact O-N 3.11Å; L33-V37 PolarHBondContact O-N 3.05Å; L33-V37 VanDerWaalsContact O-N 3.16Å
34	V	66.6	Low	65.9	Low	83 Å²	83	79.2 Å²	79.2	50%	0.503	45%	0.445	S	S	.	.	H	α-helix	trans	-60	-45.7	175.2	175.8	0	0	0	0	109.5	I30 P31 I36 V37 L38	I30-V34 PolarHBondContact O-N 3.1Å; P31-V34 PolarHBondContact O-N 3.37Å; V34-I36 VanDerWaalsContact C-N 3.31Å; V34-I36 PolarHBondContact O-N 3.26Å; V34-V37 PolarHBondContact O-N 2.77Å; V34-L38 HydrophobicContact CG1-CD1 3.88Å; V34-L38 WeakPolarHBondContact O-CD1 3.18Å; V34-L38 PolarHBondContact O-N 2.91Å
35	L	65.3	Low	65.6	Low	63 Å²	63	78.1 Å²	78.1	33%	0.33	44%	0.439	S	S	.	.	H	α-helix	trans	-61	-36.8	175.3	-66.5	169.7	0	0	0	111.7	P31 L32 L33 L38 N39 I78	P31-L35 WeakPolarHBondContact O-CB 3.25Å; P31-L35 WeakPolarHBondContact O-CD1 3.16Å; P31-L35 WeakPolarHBondContact O-CG 3.39Å; P31-L35 PolarHBondContact O-N 3.14Å; L32-L35 CarbonylContact O-C 3.53Å; L32-L35 WeakPolarHBondContact O-CA 3.14Å; L32-L35 WeakPolarHBondContact O-CB 3.35Å; L32-L35 PolarHBondContact O-N 3.36Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.86Å; L35-L38 PolarHBondContact O-N 3.49Å; L35-N39 VanDerWaalsContact O-CB 3.26Å; L35-N39 WeakPolarHBondContact O-CB 3.09Å; L35-N39 PolarHBondContact O-N 3.14Å; L35-N39 PolarHBondContact O-ND2 3.28Å; L35-I78 HydrophobicContact CB-CD1 4.17Å; L35-I78 HydrophobicContact CB-CG2 4.06Å; L35-I78 HydrophobicContact CD1-CD1 4.3Å; L35-I78 HydrophobicContact CD2-CD1 3.81Å; L35-I78 HydrophobicContact CG-CD1 4.3Å
36	I	66	Low	65.5	Low	61 Å²	61	75.4 Å²	75.4	31%	0.313	43%	0.425	S	S	.	.	H	α-helix	trans	-56.7	-54.3	174.9	-68.5	165.7	0	0	0	110.9	L32 L33 V34 L38 N39 A40 L82	L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.33Å; L32-I36 PolarHBondContact O-N 3.14Å; L33-I36 HydrophobicContact CD2-CD1 3.84Å; L33-I36 WeakPolarHBondContact O-CB 3.48Å; L33-I36 PolarHBondContact O-N 2.71Å; L33-I36 VanDerWaalsContact O-N 3.11Å; V34-I36 VanDerWaalsContact C-N 3.31Å; V34-I36 PolarHBondContact O-N 3.26Å; I36-L38 VanDerWaalsContact C-N 3.32Å; I36-L38 PolarHBondContact O-N 2.95Å; I36-N39 PolarHBondContact O-N 2.77Å; I36-A40 WeakPolarHBondContact O-CB 3.34Å; I36-A40 PolarHBondContact O-N 2.93Å; I36-L82 HydrophobicContact CB-CD1 4.06Å; I36-L82 HydrophobicContact CB-CD2 4.5Å; I36-L82 HydrophobicContact CD1-CD2 3.56Å; I36-L82 HydrophobicContact CG1-CD1 3.49Å; I36-L82 VanDerWaalsContact CG1-CD1 3.49Å; I36-L82 HydrophobicContact CG1-CD2 3.15Å; I36-L82 HydrophobicContact CG1-CG 3.87Å; I36-L82 HydrophobicContact CG2-CD1 4.15Å
37	V	72.2	Confident	65.2	Low	87 Å²	87	75.3 Å²	75.3	53%	0.527	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-47.2	-175.4	176.2	0	0	0	0	109.5	L33 V34 N39 A40 L41	L33-V37 PolarHBondContact O-N 3.05Å; L33-V37 VanDerWaalsContact O-N 3.16Å; V34-V37 PolarHBondContact O-N 2.77Å; V37-N39 VanDerWaalsContact C-N 3.33Å; V37-N39 PolarHBondContact O-N 3.34Å; V37-A40 PolarHBondContact O-N 3.42Å; V37-L41 HydrophobicContact CG1-CD1 4.13Å; V37-L41 VanDerWaalsContact O-CG 3.23Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 3.1Å
38	L	59.4	Low	65.1	Low	91 Å²	91	79.8 Å²	79.8	48%	0.476	44%	0.441	S	S	.	.	H	α-helix	trans	-61.3	-41.4	178.1	-88.2	69.8	0	0	0	111.6	V34 L35 I36 L41 L42	V34-L38 HydrophobicContact CG1-CD1 3.88Å; V34-L38 WeakPolarHBondContact O-CD1 3.18Å; V34-L38 PolarHBondContact O-N 2.91Å; L35-L38 PolarHBondContact O-N 3.49Å; I36-L38 VanDerWaalsContact C-N 3.32Å; I36-L38 PolarHBondContact O-N 2.95Å; L38-L41 PolarHBondContact O-N 3.04Å; L38-L42 WeakPolarHBondContact O-CB 2.98Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.26Å; L38-L42 PolarHBondContact O-N 2.85Å
39	N	61.7	Low	64.9	Low	10 Å²	10	81.8 Å²	81.8	5%	0.053	44%	0.44	C	S	.	.	H	α-helix	trans	-76.9	-29.8	-178.8	-73.3	-62.2	0	0	0	114.3	L35 I36 V37 L42 L43 A75 I78	L35-N39 VanDerWaalsContact O-CB 3.26Å; L35-N39 WeakPolarHBondContact O-CB 3.09Å; L35-N39 PolarHBondContact O-N 3.14Å; L35-N39 PolarHBondContact O-ND2 3.28Å; I36-N39 PolarHBondContact O-N 2.77Å; V37-N39 VanDerWaalsContact C-N 3.33Å; V37-N39 PolarHBondContact O-N 3.34Å; N39-L42 PolarHBondContact O-N 3.39Å; N39-L43 WeakPolarHBondContact O-CB 3.46Å; N39-L43 PolarHBondContact O-N 3.11Å; N39-A75 WeakPolarHBondContact OD1-CA 3.45Å; N39-A75 WeakPolarHBondContact OD1-CB 3.15Å; N39-I78 HydrophobicContact CB-CB 4.4Å; N39-I78 HydrophobicContact CB-CG2 4.09Å; N39-I78 VanDerWaalsContact ND2-CB 3.32Å; N39-I78 WeakPolarHBondContact ND2-CB 3.44Å; N39-I78 WeakPolarHBondContact ND2-CD1 3.27Å; N39-I78 WeakPolarHBondContact ND2-CG2 3.49Å
40	A	67.8	Low	64.6	Low	58 Å²	58	87.7 Å²	87.7	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-64.8	-45	169.7	0	0	0	0	0	110.6	I36 V37 L42 L43 H44	I36-A40 WeakPolarHBondContact O-CB 3.34Å; I36-A40 PolarHBondContact O-N 2.93Å; V37-A40 PolarHBondContact O-N 3.42Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 2.68Å; A40-L43 PolarHBondContact O-N 3.22Å; A40-H44 VanDerWaalsContact O-CB 3.25Å; A40-H44 WeakPolarHBondContact O-CB 3.2Å; A40-H44 PolarHBondContact O-N 3.06Å
41	L	66.4	Low	64.4	Low	114 Å²	114	93.1 Å²	93.1	60%	0.597	47%	0.469	S	S	*	.	H	α-helix	trans	-61.2	-42.7	174.3	-68.2	171.6	0	0	0	111.3	V37 L38 S45	V37-L41 HydrophobicContact CG1-CD1 4.13Å; V37-L41 VanDerWaalsContact O-CG 3.23Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 3.1Å; L38-L41 PolarHBondContact O-N 3.04Å; L41-S45 WeakPolarHBondContact O-CB 3.23Å; L41-S45 PolarHBondContact O-N 2.68Å
42	L	62.8	Low	64.3	Low	71 Å²	71	93.5 Å²	93.5	37%	0.372	47%	0.465	S	S	.	.	H	α-helix	trans	-63.2	-49.5	175.1	-73.5	173.4	0	0	0	111.5	L38 N39 A40 H44 S45 L46 A75	L38-L42 WeakPolarHBondContact O-CB 2.98Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.26Å; L38-L42 PolarHBondContact O-N 2.85Å; N39-L42 PolarHBondContact O-N 3.39Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 2.68Å; L42-H44 VanDerWaalsContact C-N 3.33Å; L42-H44 PolarHBondContact O-N 3.17Å; L42-S45 CarbonylContact O-C 3.6Å; L42-S45 PolarHBondContact O-N 2.94Å; L42-S45 PolarHBondContact O-OG 3.07Å; L42-L46 WeakPolarHBondContact O-CB 3.27Å; L42-L46 PolarHBondContact O-N 3.49Å; L42-A75 HydrophobicContact CB-CB 4.4Å; L42-A75 HydrophobicContact CD1-CB 3.96Å
43	L	65.2	Low	64.1	Low	105 Å²	105	94.6 Å²	94.6	55%	0.55	47%	0.467	S	S	.	.	H	α-helix	trans	-63.1	-38.7	179.3	-176.1	64.1	0	0	0	112.3	N39 A40 S45 L46 S47	N39-L43 WeakPolarHBondContact O-CB 3.46Å; N39-L43 PolarHBondContact O-N 3.11Å; A40-L43 PolarHBondContact O-N 3.22Å; L43-S45 VanDerWaalsContact C-N 3.35Å; L43-L46 PolarHBondContact O-N 2.96Å; L43-S47 PolarHBondContact O-N 3.34Å; L43-S47 PolarHBondContact O-OG 3.03Å
44	H	66.7	Low	63.8	Low	153 Å²	153	93.3 Å²	93.3	71%	0.708	47%	0.466	S	S	*	.	H	α-helix	trans	-61.3	-46	174.3	-173.7	78.7	0	0	0	110.6	A40 L42	A40-H44 VanDerWaalsContact O-CB 3.25Å; A40-H44 WeakPolarHBondContact O-CB 3.2Å; A40-H44 PolarHBondContact O-N 3.06Å; L42-H44 VanDerWaalsContact C-N 3.33Å; L42-H44 PolarHBondContact O-N 3.17Å
45	S	58.1	Low	63.7	Low	41 Å²	41	95.5 Å²	95.5	29%	0.287	47%	0.469	S	S	.	.	H	α-helix	trans	-62.3	-44.9	173.4	81	0	0	0	0	111.2	L41 L42 L43 S47 K48 W49	L41-S45 WeakPolarHBondContact O-CB 3.23Å; L41-S45 PolarHBondContact O-N 2.68Å; L42-S45 CarbonylContact O-C 3.6Å; L42-S45 PolarHBondContact O-N 2.94Å; L42-S45 PolarHBondContact O-OG 3.07Å; L43-S45 VanDerWaalsContact C-N 3.35Å; S45-S47 VanDerWaalsContact C-N 3.34Å; S45-S47 PolarHBondContact O-N 3.35Å; S45-K48 WeakPolarHBondContact O-CB 3.35Å; S45-K48 PolarHBondContact O-N 3.44Å; S45-K48 VanDerWaalsContact O-N 3.14Å; S45-W49 PolarHBondContact O-N 2.85Å; S45-W49 VanDerWaalsContact O-N 3.1Å
46	L	59.1	Low	63.5	Low	34 Å²	34	95.8 Å²	95.8	18%	0.178	47%	0.469	C	S	.	.	H	α-helix	trans	-66.5	-32.2	-176.7	-120	152.9	0	0	0	112.8	L42 L43 K48 W49 R50 Y53 L72	L42-L46 WeakPolarHBondContact O-CB 3.27Å; L42-L46 PolarHBondContact O-N 3.49Å; L43-L46 PolarHBondContact O-N 2.96Å; L46-K48 PolarHBondContact O-N 3.18Å; L46-W49 CarbonylContact O-C 3.58Å; L46-W49 PolarHBondContact O-N 3.43Å; L46-R50 WeakPolarHBondContact O-CA 3.35Å; L46-R50 WeakPolarHBondContact O-CB 3.45Å; L46-R50 PolarHBondContact O-N 3.43Å; L46-Y53 HydrophobicContact CD2-CD2 4.09Å; L46-Y53 HydrophobicContact CG-CD2 4.33Å; L46-Y53 HydrophobicContact CG-CE2 4.39Å; L46-L72 HydrophobicContact CD1-CB 4.47Å; L46-L72 HydrophobicContact CD1-CD1 3.97Å; L46-L72 HydrophobicContact CD1-CG 3.96Å; L46-L72 HydrophobicContact CD2-CD1 4Å
47	S	65.9	Low	63.2	Low	88 Å²	88	95 Å²	95	62%	0.615	47%	0.466	S	S	*	.	H	α-helix	trans	-60.7	-39	175.7	-62	0	0	0	0	110.8	L43 S45	L43-S47 PolarHBondContact O-N 3.34Å; L43-S47 PolarHBondContact O-OG 3.03Å; S45-S47 VanDerWaalsContact C-N 3.34Å; S45-S47 PolarHBondContact O-N 3.35Å
48	K	64.6	Low	62.7	Low	177 Å²	177	94.6 Å²	94.6	77%	0.77	47%	0.471	S	S	*	.	H	α-helix	trans	-69.3	-36	172.8	-166.3	174.7	-178.7	177.2	0	111.9	S45 L46	S45-K48 WeakPolarHBondContact O-CB 3.35Å; S45-K48 PolarHBondContact O-N 3.44Å; S45-K48 VanDerWaalsContact O-N 3.14Å; L46-K48 PolarHBondContact O-N 3.18Å
49	W	56.1	Low	63	Low	117 Å²	117	92.7 Å²	92.7	44%	0.443	47%	0.466	S	S	.	.	H	α-helix	trans	-97.9	-6.1	-172.5	-61.8	119	0	0	0	116.1	S45 L46 R51 E52 Y53	S45-W49 PolarHBondContact O-N 2.85Å; S45-W49 VanDerWaalsContact O-N 3.1Å; L46-W49 CarbonylContact O-C 3.58Å; L46-W49 PolarHBondContact O-N 3.43Å; W49-R51 PolarHBondContact O-N 3.47Å; W49-E52 HydrophobicContact CE3-CB 3.97Å; W49-E52 HydrophobicContact CE3-CG 4.21Å; W49-E52 HydrophobicContact CZ3-CG 4.37Å; W49-E52 CarbonylContact O-C 3.58Å; W49-E52 WeakPolarHBondContact O-CA 3.05Å; W49-E52 PolarHBondContact O-N 2.88Å; W49-Y53 HydrophobicContact CB-CD2 3.18Å; W49-Y53 HydrophobicContact CB-CE2 3.34Å; W49-Y53 HydrophobicContact CB-CG 4.34Å; W49-Y53 HydrophobicContact CG-CD2 4.15Å; W49-Y53 AromaticContact CG-CE2 3.84Å; W49-Y53 HydrophobicContact CG-CE2 3.84Å; W49-Y53 WeakPolarHBondContact O-CB 3.33Å; W49-Y53 PolarHBondContact O-N 3.16Å
50	R	60.8	Low	63	Low	187 Å²	187	98.5 Å²	98.5	71%	0.706	50%	0.504	S	S	*	.	H	α-helix	trans	-53.2	-38.6	-170.8	-174.4	176.7	178	-166.3	-0.1	113.4	L46 S54	L46-R50 WeakPolarHBondContact O-CA 3.35Å; L46-R50 WeakPolarHBondContact O-CB 3.45Å; L46-R50 PolarHBondContact O-N 3.43Å; R50-S54 PolarHBondContact O-N 2.95Å; R50-S54 PolarHBondContact O-OG 3.35Å
51	R	64.2	Low	62.8	Low	220 Å²	220	102.9 Å²	102.9	83%	0.83	52%	0.519	S	S	*	.	H	α-helix	trans	-69.4	-43.3	175	-73.1	-175.4	166.8	-149.2	-2.8	111.9	W49	W49-R51 PolarHBondContact O-N 3.47Å
52	E	67	Low	62.5	Low	74 Å²	74	100.2 Å²	100.2	35%	0.346	51%	0.506	S	S	.	.	H	α-helix	trans	-74.5	-39.6	-177.4	-153.9	57	-151.9	0	0	112.3	W49 S54 K55 M56	W49-E52 HydrophobicContact CE3-CB 3.97Å; W49-E52 HydrophobicContact CE3-CG 4.21Å; W49-E52 HydrophobicContact CZ3-CG 4.37Å; W49-E52 CarbonylContact O-C 3.58Å; W49-E52 WeakPolarHBondContact O-CA 3.05Å; W49-E52 PolarHBondContact O-N 2.88Å; E52-S54 VanDerWaalsContact C-N 3.32Å; E52-S54 PolarHBondContact O-N 2.84Å; E52-K55 WeakPolarHBondContact O-CB 2.98Å; E52-K55 PolarHBondContact O-N 2.81Å; E52-K55 VanDerWaalsContact O-N 3.14Å; E52-K55 IonicContact OE1-NZ 2.68Å; E52-K55 IonicContact OE2-NZ 3.97Å; E52-K55 PolarHBondContact OE2-NZ 2.66Å; E52-M56 HydrophobicContact CG-CE 4.2Å; E52-M56 WeakPolarHBondContact O-CG 3.26Å; E52-M56 PolarHBondContact O-N 3.5Å
53	Y	63.1	Low	62.6	Low	55 Å²	55	105.3 Å²	105.3	22%	0.216	53%	0.528	C	S	.	.	H	α-helix	trans	-61.9	-38	174.5	-94.4	-63.2	0	0	0	112.5	L46 W49 K55 M56 L57 I68	L46-Y53 HydrophobicContact CD2-CD2 4.09Å; L46-Y53 HydrophobicContact CG-CD2 4.33Å; L46-Y53 HydrophobicContact CG-CE2 4.39Å; W49-Y53 HydrophobicContact CB-CD2 3.18Å; W49-Y53 HydrophobicContact CB-CE2 3.34Å; W49-Y53 HydrophobicContact CB-CG 4.34Å; W49-Y53 HydrophobicContact CG-CD2 4.15Å; W49-Y53 AromaticContact CG-CE2 3.84Å; W49-Y53 HydrophobicContact CG-CE2 3.84Å; W49-Y53 WeakPolarHBondContact O-CB 3.33Å; W49-Y53 PolarHBondContact O-N 3.16Å; Y53-K55 PolarHBondContact O-N 3.3Å; Y53-M56 HydrophobicContact CD1-SD 4.39Å; Y53-M56 HydrophobicContact CE1-SD 4.5Å; Y53-M56 PolarHBondContact O-N 3.2Å; Y53-L57 WeakPolarHBondContact O-CB 3.43Å; Y53-L57 VanDerWaalsContact O-CG 3.28Å; Y53-L57 WeakPolarHBondContact O-CG 3.48Å; Y53-L57 PolarHBondContact O-N 3.13Å; Y53-I68 HydrophobicContact CD1-CG2 3.55Å; Y53-I68 HydrophobicContact CE1-CB 4.29Å; Y53-I68 HydrophobicContact CE1-CD1 4.02Å; Y53-I68 HydrophobicContact CE1-CG1 4.23Å; Y53-I68 HydrophobicContact CE1-CG2 3.15Å
54	S	60.5	Low	62.4	Low	70 Å²	70	108.7 Å²	108.7	49%	0.49	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-36	177.2	-60.2	0	0	0	0	111	R50 E52 A58	R50-S54 PolarHBondContact O-N 2.95Å; R50-S54 PolarHBondContact O-OG 3.35Å; E52-S54 VanDerWaalsContact C-N 3.32Å; E52-S54 PolarHBondContact O-N 2.84Å; S54-A58 VanDerWaalsContact O-CB 3.23Å; S54-A58 WeakPolarHBondContact O-CB 3.42Å; S54-A58 PolarHBondContact O-N 3.42Å
55	K	64.8	Low	62.3	Low	129 Å²	129	102.4 Å²	102.4	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-70.3	-44.3	172.6	-58.1	174.4	-167.3	160.7	0	111.7	E52 Y53 L57 A58 S59	E52-K55 WeakPolarHBondContact O-CB 2.98Å; E52-K55 PolarHBondContact O-N 2.81Å; E52-K55 VanDerWaalsContact O-N 3.14Å; E52-K55 IonicContact OE1-NZ 2.68Å; E52-K55 IonicContact OE2-NZ 3.97Å; E52-K55 PolarHBondContact OE2-NZ 2.66Å; Y53-K55 PolarHBondContact O-N 3.3Å; K55-L57 VanDerWaalsContact C-N 3.32Å; K55-L57 PolarHBondContact O-N 3.05Å; K55-A58 PolarHBondContact O-N 2.94Å; K55-S59 PolarHBondContact O-N 3.27Å
56	M	61.6	Low	62.8	Low	69 Å²	69	102.9 Å²	102.9	34%	0.34	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-36.7	177.5	-67.6	-179.4	177.9	0	0	113.1	E52 Y53	E52-M56 HydrophobicContact CG-CE 4.2Å; E52-M56 WeakPolarHBondContact O-CG 3.26Å; E52-M56 PolarHBondContact O-N 3.5Å; Y53-M56 HydrophobicContact CD1-SD 4.39Å; Y53-M56 HydrophobicContact CE1-SD 4.5Å; Y53-M56 PolarHBondContact O-N 3.2Å
57	L	58.7	Low	63.3	Low	46 Å²	46	108 Å²	108	24%	0.241	53%	0.531	C	S	.	.	H	α-helix	trans	-78.9	-26.7	177.5	-72.7	164.9	0	0	0	113.5	Y53 K55 S59 S65 R69	Y53-L57 WeakPolarHBondContact O-CB 3.43Å; Y53-L57 VanDerWaalsContact O-CG 3.28Å; Y53-L57 WeakPolarHBondContact O-CG 3.48Å; Y53-L57 PolarHBondContact O-N 3.13Å; K55-L57 VanDerWaalsContact C-N 3.32Å; K55-L57 PolarHBondContact O-N 3.05Å; L57-S59 VanDerWaalsContact C-N 3.34Å; L57-S65 WeakPolarHBondContact CD2-O 3.15Å; L57-R69 HydrophobicContact CD2-CB 4.22Å
58	A	62.1	Low	63.6	Low	77 Å²	77	105.8 Å²	105.8	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-75.9	-26	173.4	0	0	0	0	0	111.8	S54 K55 P60	S54-A58 VanDerWaalsContact O-CB 3.23Å; S54-A58 WeakPolarHBondContact O-CB 3.42Å; S54-A58 PolarHBondContact O-N 3.42Å; K55-A58 PolarHBondContact O-N 2.94Å; A58-P60 WeakPolarHBondContact O-CD 3.37Å
59	S	65.7	Low	63.9	Low	52 Å²	52	101.6 Å²	101.6	36%	0.364	49%	0.492	S	S	.	.			trans	-70.6	111.1	175.6	-170.9	0	0	0	0	110.6	K55 L57 N61	K55-S59 PolarHBondContact O-N 3.27Å; L57-S59 VanDerWaalsContact C-N 3.34Å; S59-N61 PolarHBondContact O-N 3.17Å
60	P	61.4	Low	64.7	Low	131 Å²	131	100.1 Å²	100.1	85%	0.851	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.2	-179.3	28.5	-33.9	0	0	0	112.8	A58	A58-P60 WeakPolarHBondContact O-CD 3.37Å
61	N	64.1	Low	65.4	Low	151 Å²	151	93.8 Å²	93.8	81%	0.807	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.2	-171.8	-154.3	29.6	0	0	0	114.2	S59	S59-N61 PolarHBondContact O-N 3.17Å
62	N	60.9	Low	65.8	Low	58 Å²	58	85.1 Å²	85.1	31%	0.31	45%	0.453	S	S	.	.			trans	-98.1	102.5	-176.1	-152.9	10	0	0	0	110.7	R64 S65	N62-R64 PolarHBondContact O-N 3.46Å; N62-S65 VanDerWaalsContact O-CB 3.31Å; N62-S65 WeakPolarHBondContact O-CB 2.9Å; N62-S65 PolarHBondContact O-N 3.44Å; N62-S65 PolarHBondContact O-OG 3.37Å
63	Q	63.6	Low	66.1	Low	178 Å²	178	82.6 Å²	82.6	83%	0.832	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-20.6	176.1	-82.3	174.3	-10.4	0	0	113.7	P66	Q63-P66 WeakPolarHBondContact O-CD 3.17Å; Q63-P66 VanDerWaalsContact O-CG 3.23Å; Q63-P66 WeakPolarHBondContact O-CG 3.3Å
64	R	61.2	Low	66.7	Low	175 Å²	175	83.7 Å²	83.7	66%	0.66	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.6	176.7	-63.2	-178	-179.7	149.1	0.6	114.1	N62 E67 I68	N62-R64 PolarHBondContact O-N 3.46Å; R64-E67 PolarHBondContact O-N 2.91Å; R64-I68 HydrophobicContact CB-CD1 4.25Å; R64-I68 WeakPolarHBondContact O-CD1 3.34Å; R64-I68 WeakPolarHBondContact O-CG1 3.41Å; R64-I68 PolarHBondContact O-N 3.06Å
65	S	65.2	Low	67.3	Low	22 Å²	22	80.8 Å²	80.8	15%	0.154	43%	0.433	C	S	.	.	H	α-helix	trans	-58.9	-38.4	-179.2	66.8	0	0	0	0	115.1	L57 N62 R69	L57-S65 WeakPolarHBondContact CD2-O 3.15Å; N62-S65 VanDerWaalsContact O-CB 3.31Å; N62-S65 WeakPolarHBondContact O-CB 2.9Å; N62-S65 PolarHBondContact O-N 3.44Å; N62-S65 PolarHBondContact O-OG 3.37Å; S65-R69 WeakPolarHBondContact O-CB 3.41Å; S65-R69 PolarHBondContact O-N 3.48Å; S65-R69 VanDerWaalsContact O-N 3.14Å
66	P	67.7	Low	67.7	Low	51 Å²	51	78.1 Å²	78.1	33%	0.331	43%	0.425	S	S	.	.	H	α-helix	trans	-67.3	-42.4	175.3	24.7	-36.9	0	0	0	114.5	Q63 R69 V70	Q63-P66 WeakPolarHBondContact O-CD 3.17Å; Q63-P66 VanDerWaalsContact O-CG 3.23Å; Q63-P66 WeakPolarHBondContact O-CG 3.3Å; P66-R69 WeakPolarHBondContact O-CB 3.12Å; P66-R69 PolarHBondContact O-N 3.06Å; P66-V70 WeakPolarHBondContact O-CG2 3.18Å; P66-V70 PolarHBondContact O-N 3.32Å
67	E	71.3	Confident	68.3	Low	141 Å²	141	76.8 Å²	76.8	66%	0.659	42%	0.42	S	S	*	.	H	α-helix	trans	-62.5	-48.3	-178.6	-64.1	173.7	170.9	0	0	110.8	R64 R69 V70 A71	R64-E67 PolarHBondContact O-N 2.91Å; E67-R69 VanDerWaalsContact C-N 3.27Å; E67-R69 PolarHBondContact O-N 3.14Å; E67-V70 PolarHBondContact O-N 3.44Å; E67-V70 VanDerWaalsContact O-N 3.11Å; E67-A71 PolarHBondContact O-N 2.99Å
68	I	71	Confident	69.1	Low	42 Å²	42	75.4 Å²	75.4	22%	0.215	41%	0.413	C	S	.	.	H	α-helix	trans	-56.3	-42.9	173.9	-73.5	162.7	0	0	0	111	Y53 R64 V70 A71 L72	Y53-I68 HydrophobicContact CD1-CG2 3.55Å; Y53-I68 HydrophobicContact CE1-CB 4.29Å; Y53-I68 HydrophobicContact CE1-CD1 4.02Å; Y53-I68 HydrophobicContact CE1-CG1 4.23Å; Y53-I68 HydrophobicContact CE1-CG2 3.15Å; R64-I68 HydrophobicContact CB-CD1 4.25Å; R64-I68 WeakPolarHBondContact O-CD1 3.34Å; R64-I68 WeakPolarHBondContact O-CG1 3.41Å; R64-I68 PolarHBondContact O-N 3.06Å; I68-V70 VanDerWaalsContact C-N 3.32Å; I68-V70 PolarHBondContact O-N 3.37Å; I68-A71 PolarHBondContact O-N 3.02Å; I68-L72 WeakPolarHBondContact O-CB 3.3Å; I68-L72 PolarHBondContact O-N 3.39Å
69	R	70.6	Confident	69.7	Low	89 Å²	89	73.2 Å²	73.2	34%	0.336	40%	0.395	S	S	.	.	H	α-helix	trans	-59.8	-43.9	178.1	-175.3	-176.2	74.8	-110.3	1.6	110.7	L57 S65 P66 E67 L72 M73	L57-R69 HydrophobicContact CD2-CB 4.22Å; S65-R69 WeakPolarHBondContact O-CB 3.41Å; S65-R69 PolarHBondContact O-N 3.48Å; S65-R69 VanDerWaalsContact O-N 3.14Å; P66-R69 WeakPolarHBondContact O-CB 3.12Å; P66-R69 PolarHBondContact O-N 3.06Å; E67-R69 VanDerWaalsContact C-N 3.27Å; E67-R69 PolarHBondContact O-N 3.14Å; R69-L72 PolarHBondContact O-N 2.81Å; R69-M73 WeakPolarHBondContact O-CG 3.41Å; R69-M73 PolarHBondContact O-N 3.39Å; R69-M73 VanDerWaalsContact O-N 3.07Å
70	V	73	Confident	70	Confident	86 Å²	86	71.5 Å²	71.5	52%	0.521	38%	0.383	S	S	.	.	H	α-helix	trans	-64.5	-45.7	179.1	175.6	0	0	0	0	110.9	P66 E67 I68 L72 M73 V74	P66-V70 WeakPolarHBondContact O-CG2 3.18Å; P66-V70 PolarHBondContact O-N 3.32Å; E67-V70 PolarHBondContact O-N 3.44Å; E67-V70 VanDerWaalsContact O-N 3.11Å; I68-V70 VanDerWaalsContact C-N 3.32Å; I68-V70 PolarHBondContact O-N 3.37Å; V70-L72 PolarHBondContact O-N 2.86Å; V70-M73 WeakPolarHBondContact O-CB 3.42Å; V70-M73 PolarHBondContact O-N 2.85Å; V70-M73 VanDerWaalsContact O-N 3.14Å; V70-V74 WeakPolarHBondContact O-CG2 3.17Å; V70-V74 PolarHBondContact O-N 3.16Å
71	A	76.2	Confident	70.7	Confident	53 Å²	53	67.2 Å²	67.2	44%	0.438	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-44.7	177.8	0	0	0	0	0	112.3	E67 I68 M73 V74 A75	E67-A71 PolarHBondContact O-N 2.99Å; I68-A71 PolarHBondContact O-N 3.02Å; A71-M73 PolarHBondContact O-N 3.39Å; A71-V74 PolarHBondContact O-N 2.91Å; A71-A75 PolarHBondContact O-N 3.19Å
72	L	71.4	Confident	71.1	Confident	38 Å²	38	61.4 Å²	61.4	20%	0.199	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-38.5	175.9	179.4	159.6	0	0	0	111.4	L46 I68 R69 V70 A75 I76	L46-L72 HydrophobicContact CD1-CB 4.47Å; L46-L72 HydrophobicContact CD1-CD1 3.97Å; L46-L72 HydrophobicContact CD1-CG 3.96Å; L46-L72 HydrophobicContact CD2-CD1 4Å; I68-L72 WeakPolarHBondContact O-CB 3.3Å; I68-L72 PolarHBondContact O-N 3.39Å; R69-L72 PolarHBondContact O-N 2.81Å; V70-L72 PolarHBondContact O-N 2.86Å; L72-A75 CarbonylContact O-C 3.57Å; L72-A75 WeakPolarHBondContact O-CA 3.23Å; L72-A75 WeakPolarHBondContact O-CB 3.5Å; L72-A75 PolarHBondContact O-N 3.11Å; L72-A75 VanDerWaalsContact O-N 3.16Å; L72-I76 HydrophobicContact CD2-CD1 3.34Å; L72-I76 HydrophobicContact CD2-CG1 3.95Å; L72-I76 HydrophobicContact CG-CD1 4.37Å; L72-I76 WeakPolarHBondContact O-CG1 3.02Å; L72-I76 PolarHBondContact O-N 2.79Å
73	M	73.8	Confident	71.7	Confident	22 Å²	22	64.7 Å²	64.7	11%	0.108	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-47	179.9	-77	-58	-47.7	0	0	113.6	R69 V70 A71 A75 I76 T77 I128 S132	R69-M73 WeakPolarHBondContact O-CG 3.41Å; R69-M73 PolarHBondContact O-N 3.39Å; R69-M73 VanDerWaalsContact O-N 3.07Å; V70-M73 WeakPolarHBondContact O-CB 3.42Å; V70-M73 PolarHBondContact O-N 2.85Å; V70-M73 VanDerWaalsContact O-N 3.14Å; A71-M73 PolarHBondContact O-N 3.39Å; M73-A75 PolarHBondContact O-N 2.93Å; M73-I76 PolarHBondContact O-N 3.29Å; M73-T77 WeakPolarHBondContact O-CB 3.26Å; M73-T77 PolarHBondContact O-N 3.25Å; M73-T77 PolarHBondContact O-OG1 2.87Å; M73-T77 VanDerWaalsContact O-OG1 3.11Å; M73-I128 HydrophobicContact CE-CG2 3.34Å; M73-I128 VanDerWaalsContact CE-O 3.3Å; M73-I128 WeakPolarHBondContact CE-O 3.33Å; M73-I128 HydrophobicContact SD-CG2 4.45Å; M73-S132 WeakPolarHBondContact CG-OG 3.4Å; M73-S132 WeakPolarHBondContact SD-CB 3.41Å; M73-S132 PolarHBondContact SD-OG 3.26Å
74	V	75.8	Confident	72.2	Confident	78 Å²	78	58 Å²	58	47%	0.473	31%	0.305	S	S	.	.	H	α-helix	trans	-53.2	-41.4	170.7	173.4	0	0	0	0	109	V70 A71 T77 I78	V70-V74 WeakPolarHBondContact O-CG2 3.17Å; V70-V74 PolarHBondContact O-N 3.16Å; A71-V74 PolarHBondContact O-N 2.91Å; V74-T77 PolarHBondContact O-N 3.35Å; V74-I78 HydrophobicContact CG1-CD1 3.57Å; V74-I78 VanDerWaalsContact O-CD1 3.32Å; V74-I78 WeakPolarHBondContact O-CD1 3.21Å; V74-I78 WeakPolarHBondContact O-CG1 3.42Å; V74-I78 PolarHBondContact O-N 3.06Å
75	A	74	Confident	72.9	Confident	8 Å²	8	53.1 Å²	53.1	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-67.9	-42.8	179.6	0	0	0	0	0	115.5	N39 L42 A71 L72 M73 I78 A79	N39-A75 WeakPolarHBondContact OD1-CA 3.45Å; N39-A75 WeakPolarHBondContact OD1-CB 3.15Å; L42-A75 HydrophobicContact CB-CB 4.4Å; L42-A75 HydrophobicContact CD1-CB 3.96Å; A71-A75 PolarHBondContact O-N 3.19Å; L72-A75 CarbonylContact O-C 3.57Å; L72-A75 WeakPolarHBondContact O-CA 3.23Å; L72-A75 WeakPolarHBondContact O-CB 3.5Å; L72-A75 PolarHBondContact O-N 3.11Å; L72-A75 VanDerWaalsContact O-N 3.16Å; M73-A75 PolarHBondContact O-N 2.93Å; A75-I78 PolarHBondContact O-N 3.47Å; A75-A79 WeakPolarHBondContact O-CB 3.32Å; A75-A79 PolarHBondContact O-N 3.3Å
76	I	71.9	Confident	73.3	Confident	73 Å²	73	55.5 Å²	55.5	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-65.8	-43	175.5	-66.4	-179.8	0	0	0	110.7	L72 M73 I78 A79 S80 I128	L72-I76 HydrophobicContact CD2-CD1 3.34Å; L72-I76 HydrophobicContact CD2-CG1 3.95Å; L72-I76 HydrophobicContact CG-CD1 4.37Å; L72-I76 WeakPolarHBondContact O-CG1 3.02Å; L72-I76 PolarHBondContact O-N 2.79Å; M73-I76 PolarHBondContact O-N 3.29Å; I76-I78 VanDerWaalsContact C-N 3.28Å; I76-I78 PolarHBondContact O-N 3.45Å; I76-A79 PolarHBondContact O-N 3.21Å; I76-S80 WeakPolarHBondContact O-CB 3.45Å; I76-S80 PolarHBondContact O-N 2.93Å; I76-S80 PolarHBondContact O-OG 3.5Å; I76-I128 HydrophobicContact CB-CG2 4.19Å; I76-I128 HydrophobicContact CG2-CD1 3.91Å; I76-I128 HydrophobicContact CG2-CG1 4.1Å; I76-I128 HydrophobicContact CG2-CG2 3.66Å
77	T	75	Confident	73.8	Confident	41 Å²	41	54.7 Å²	54.7	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-58	-44	176.4	-69.1	0	0	0	0	110.6	M73 V74 S80 F81 N125	M73-T77 WeakPolarHBondContact O-CB 3.26Å; M73-T77 PolarHBondContact O-N 3.25Å; M73-T77 PolarHBondContact O-OG1 2.87Å; M73-T77 VanDerWaalsContact O-OG1 3.11Å; V74-T77 PolarHBondContact O-N 3.35Å; T77-S80 PolarHBondContact O-N 3.07Å; T77-F81 WeakPolarHBondContact O-CB 3.17Å; T77-F81 PolarHBondContact O-N 2.89Å; T77-N125 VanDerWaalsContact CA-OD1 3.31Å; T77-N125 WeakPolarHBondContact CA-OD1 3.32Å; T77-N125 HydrophobicContact CG2-CB 4.06Å; T77-N125 WeakPolarHBondContact CG2-OD1 3.32Å; T77-N125 PolarHBondContact O-OD1 3.04Å
78	I	75.7	Confident	74.1	Confident	17 Å²	17	49 Å²	49	9%	0.087	27%	0.274	C	S	.	.	H	α-helix	trans	-69.8	-46.9	178.1	-65.6	159.6	0	0	0	110.8	L35 N39 V74 A75 I76 S80 F81 L82	L35-I78 HydrophobicContact CB-CD1 4.17Å; L35-I78 HydrophobicContact CB-CG2 4.06Å; L35-I78 HydrophobicContact CD1-CD1 4.3Å; L35-I78 HydrophobicContact CD2-CD1 3.81Å; L35-I78 HydrophobicContact CG-CD1 4.3Å; N39-I78 HydrophobicContact CB-CB 4.4Å; N39-I78 HydrophobicContact CB-CG2 4.09Å; N39-I78 VanDerWaalsContact ND2-CB 3.32Å; N39-I78 WeakPolarHBondContact ND2-CB 3.44Å; N39-I78 WeakPolarHBondContact ND2-CD1 3.27Å; N39-I78 WeakPolarHBondContact ND2-CG2 3.49Å; V74-I78 HydrophobicContact CG1-CD1 3.57Å; V74-I78 VanDerWaalsContact O-CD1 3.32Å; V74-I78 WeakPolarHBondContact O-CD1 3.21Å; V74-I78 WeakPolarHBondContact O-CG1 3.42Å; V74-I78 PolarHBondContact O-N 3.06Å; A75-I78 PolarHBondContact O-N 3.47Å; I76-I78 VanDerWaalsContact C-N 3.28Å; I76-I78 PolarHBondContact O-N 3.45Å; I78-S80 PolarHBondContact O-N 2.71Å; I78-F81 WeakPolarHBondContact O-CB 3.36Å; I78-F81 PolarHBondContact O-N 2.76Å; I78-F81 VanDerWaalsContact O-N 3.09Å; I78-L82 HydrophobicContact CG2-CD1 4.05Å; I78-L82 HydrophobicContact CG2-CG 4.27Å; I78-L82 VanDerWaalsContact O-CG 3.26Å; I78-L82 WeakPolarHBondContact O-CG 3.26Å; I78-L82 PolarHBondContact O-N 3.06Å
79	A	73.8	Confident	74.4	Confident	31 Å²	31	48.8 Å²	48.8	26%	0.256	28%	0.283	S	S	.	.	H	α-helix	trans	-54.9	-40.9	176.3	0	0	0	0	0	112	A75 I76 L82 L83	A75-A79 WeakPolarHBondContact O-CB 3.32Å; A75-A79 PolarHBondContact O-N 3.3Å; I76-A79 PolarHBondContact O-N 3.21Å; A79-L82 PolarHBondContact O-N 3.13Å; A79-L83 WeakPolarHBondContact O-CG 3.35Å; A79-L83 PolarHBondContact O-N 3.23Å
80	S	71.6	Confident	74.8	Confident	16 Å²	16	49.3 Å²	49.3	11%	0.112	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-50.8	175.8	-56.5	0	0	0	0	110.6	I76 T77 I78 L82 L83 F84 I128	I76-S80 WeakPolarHBondContact O-CB 3.45Å; I76-S80 PolarHBondContact O-N 2.93Å; I76-S80 PolarHBondContact O-OG 3.5Å; T77-S80 PolarHBondContact O-N 3.07Å; I78-S80 PolarHBondContact O-N 2.71Å; S80-L82 PolarHBondContact O-N 3.21Å; S80-L82 VanDerWaalsContact O-N 3.15Å; S80-L83 PolarHBondContact O-N 2.82Å; S80-L83 VanDerWaalsContact O-N 3.08Å; S80-F84 WeakPolarHBondContact O-CD2 3.31Å; S80-F84 PolarHBondContact O-N 3.41Å; S80-F84 VanDerWaalsContact O-N 3.1Å; S80-I128 WeakPolarHBondContact OG-CD1 3.44Å
81	F	75.8	Confident	75	Confident	41 Å²	41	47.3 Å²	47.3	18%	0.18	28%	0.277	C	S	.	.	H	α-helix	trans	-51.5	-41	175.1	-179	-90.9	0	0	0	112	L32 T77 I78 F84 Q85	L32-F81 HydrophobicContact CD1-CE1 3.42Å; L32-F81 VanDerWaalsContact CD1-CE1 3.42Å; L32-F81 HydrophobicContact CD1-CZ 3.77Å; L32-F81 HydrophobicContact CD2-CD1 3.52Å; L32-F81 HydrophobicContact CD2-CE1 3.22Å; L32-F81 HydrophobicContact CD2-CZ 3.99Å; L32-F81 HydrophobicContact CG-CE1 3.93Å; T77-F81 WeakPolarHBondContact O-CB 3.17Å; T77-F81 PolarHBondContact O-N 2.89Å; I78-F81 WeakPolarHBondContact O-CB 3.36Å; I78-F81 PolarHBondContact O-N 2.76Å; I78-F81 VanDerWaalsContact O-N 3.09Å; F81-F84 PolarHBondContact O-N 3Å; F81-Q85 HydrophobicContact CD1-CB 4.3Å; F81-Q85 HydrophobicContact CE1-CB 3.89Å; F81-Q85 HydrophobicContact CE1-CG 3.94Å; F81-Q85 HydrophobicContact CZ-CB 4.28Å; F81-Q85 HydrophobicContact CZ-CG 4.17Å; F81-Q85 WeakPolarHBondContact O-CB 3.35Å; F81-Q85 PolarHBondContact O-N 2.88Å
82	L	73.9	Confident	74.9	Confident	29 Å²	29	52.6 Å²	52.6	15%	0.152	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-45.1	177.3	-63.4	171.8	0	0	0	113.5	I36 I78 A79 S80 F84 Q85 T86	I36-L82 HydrophobicContact CB-CD1 4.06Å; I36-L82 HydrophobicContact CB-CD2 4.5Å; I36-L82 HydrophobicContact CD1-CD2 3.56Å; I36-L82 HydrophobicContact CG1-CD1 3.49Å; I36-L82 VanDerWaalsContact CG1-CD1 3.49Å; I36-L82 HydrophobicContact CG1-CD2 3.15Å; I36-L82 HydrophobicContact CG1-CG 3.87Å; I36-L82 HydrophobicContact CG2-CD1 4.15Å; I78-L82 HydrophobicContact CG2-CD1 4.05Å; I78-L82 HydrophobicContact CG2-CG 4.27Å; I78-L82 VanDerWaalsContact O-CG 3.26Å; I78-L82 WeakPolarHBondContact O-CG 3.26Å; I78-L82 PolarHBondContact O-N 3.06Å; A79-L82 PolarHBondContact O-N 3.13Å; S80-L82 PolarHBondContact O-N 3.21Å; S80-L82 VanDerWaalsContact O-N 3.15Å; L82-F84 PolarHBondContact O-N 3.46Å; L82-Q85 PolarHBondContact O-N 2.8Å; L82-T86 VanDerWaalsContact O-CB 3.26Å; L82-T86 WeakPolarHBondContact O-CB 3.44Å; L82-T86 PolarHBondContact O-N 2.81Å; L82-T86 PolarHBondContact O-OG1 3.44Å
83	L	74.2	Confident	75.2	Confident	128 Å²	128	55.9 Å²	55.9	67%	0.67	30%	0.304	S	S	*	.	H	α-helix	trans	-57	-35.6	176.6	-72.1	172.9	0	0	0	111.5	A79 S80 P87	A79-L83 WeakPolarHBondContact O-CG 3.35Å; A79-L83 PolarHBondContact O-N 3.23Å; S80-L83 PolarHBondContact O-N 2.82Å; S80-L83 VanDerWaalsContact O-N 3.08Å; L83-P87 WeakPolarHBondContact O-CD 3.15Å
84	F	73.4	Confident	75.3	Confident	37 Å²	37	62.9 Å²	62.9	16%	0.162	33%	0.329	C	S	.	.	H	α-helix	trans	-86.1	-29.6	178.7	-66.5	-72.5	0	0	0	113.8	S80 F81 L82 P87 L117 I120 G121 L124	S80-F84 WeakPolarHBondContact O-CD2 3.31Å; S80-F84 PolarHBondContact O-N 3.41Å; S80-F84 VanDerWaalsContact O-N 3.1Å; F81-F84 PolarHBondContact O-N 3Å; L82-F84 PolarHBondContact O-N 3.46Å; F84-P87 WeakPolarHBondContact O-CD 3.25Å; F84-P87 WeakPolarHBondContact O-CG 3.28Å; F84-L117 WeakPolarHBondContact CB-O 3.37Å; F84-L117 HydrophobicContact CD1-CB 4.25Å; F84-L117 HydrophobicContact CD1-CD1 3.72Å; F84-L117 HydrophobicContact CD1-CG 3.62Å; F84-L117 WeakPolarHBondContact CD1-O 2.99Å; F84-L117 HydrophobicContact CE1-CD1 3.8Å; F84-L117 HydrophobicContact CE1-CG 4.21Å; F84-L117 WeakPolarHBondContact CG-O 3.41Å; F84-I120 HydrophobicContact CE1-CG2 4.1Å; F84-I120 HydrophobicContact CZ-CG2 4.48Å; F84-G121 VanDerWaalsContact CG-CA 3.48Å; F84-L124 HydrophobicContact CD2-CD1 4.37Å; F84-L124 HydrophobicContact CE1-CD1 4Å; F84-L124 HydrophobicContact CE2-CB 4.44Å; F84-L124 HydrophobicContact CE2-CD1 3.3Å; F84-L124 HydrophobicContact CE2-CG 4.5Å; F84-L124 HydrophobicContact CZ-CD1 3.1Å
85	Q	74.8	Confident	75.2	Confident	72 Å²	72	61.7 Å²	61.7	34%	0.336	32%	0.32	S	S	.	.	H	α-helix	trans	-79.1	-33.7	178.9	-168.4	68.2	31.7	0	0	112.6	F81 L82 S88 G89	F81-Q85 HydrophobicContact CD1-CB 4.3Å; F81-Q85 HydrophobicContact CE1-CB 3.89Å; F81-Q85 HydrophobicContact CE1-CG 3.94Å; F81-Q85 HydrophobicContact CZ-CB 4.28Å; F81-Q85 HydrophobicContact CZ-CG 4.17Å; F81-Q85 WeakPolarHBondContact O-CB 3.35Å; F81-Q85 PolarHBondContact O-N 2.88Å; L82-Q85 PolarHBondContact O-N 2.8Å; Q85-S88 PolarHBondContact O-N 3.21Å; Q85-G89 PolarHBondContact O-N 3.37Å
86	T	74.9	Confident	75.2	Confident	72 Å²	72	64.7 Å²	64.7	44%	0.442	35%	0.345	S	S	.	.	H	α-helix	trans	-54	-51.3	-179.2	-61	0	0	0	0	113.4	L82 S88 G89 I90	L82-T86 VanDerWaalsContact O-CB 3.26Å; L82-T86 WeakPolarHBondContact O-CB 3.44Å; L82-T86 PolarHBondContact O-N 2.81Å; L82-T86 PolarHBondContact O-OG1 3.44Å; T86-S88 VanDerWaalsContact C-N 3.34Å; T86-S88 PolarHBondContact O-N 2.78Å; T86-G89 PolarHBondContact O-N 3.44Å; T86-I90 HydrophobicContact CG2-CD1 3.57Å; T86-I90 HydrophobicContact CG2-CG1 4.26Å; T86-I90 VanDerWaalsContact O-CG1 3.27Å; T86-I90 WeakPolarHBondContact O-CG1 3.47Å; T86-I90 PolarHBondContact O-N 2.99Å
87	P	78.3	Confident	75.5	Confident	35 Å²	35	67 Å²	67	23%	0.227	36%	0.357	C	S	.	.	H	α-helix	trans	-60.6	-41.6	179.2	20.4	-31.6	0	0	0	112.5	L83 F84 G89 I90 L91 L117	L83-P87 WeakPolarHBondContact O-CD 3.15Å; F84-P87 WeakPolarHBondContact O-CD 3.25Å; F84-P87 WeakPolarHBondContact O-CG 3.28Å; P87-G89 VanDerWaalsContact C-N 3.35Å; P87-G89 PolarHBondContact O-N 3.16Å; P87-I90 PolarHBondContact O-N 2.78Å; P87-L91 WeakPolarHBondContact O-CG 3.39Å; P87-L91 PolarHBondContact O-N 2.96Å; P87-L117 HydrophobicContact CB-CD2 3.95Å; P87-L117 HydrophobicContact CG-CD2 3.39Å; P87-L117 HydrophobicContact CG-CG 4.18Å
88	S	77.8	Confident	75.5	Confident	20 Å²	20	68.8 Å²	68.8	14%	0.14	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-42.8	175.9	-49.7	0	0	0	0	112.3	Q85 T86 Y92 S114 V118	Q85-S88 PolarHBondContact O-N 3.21Å; T86-S88 VanDerWaalsContact C-N 3.34Å; T86-S88 PolarHBondContact O-N 2.78Å; S88-Y92 WeakPolarHBondContact O-CB 3.3Å; S88-Y92 PolarHBondContact O-N 3.3Å; S88-Y92 VanDerWaalsContact O-N 3.14Å; S88-S114 WeakPolarHBondContact OG-CB 3.19Å; S88-S114 PolarHBondContact OG-O 3.37Å; S88-V118 VanDerWaalsContact OG-CG2 3.25Å; S88-V118 WeakPolarHBondContact OG-CG2 3.34Å
89	G	76	Confident	74.6	Confident	39 Å²	39	69.4 Å²	69.4	40%	0.402	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-40.8	176.9	0	0	0	0	0	112.8	Q85 T86 P87 Y92 L93	Q85-G89 PolarHBondContact O-N 3.37Å; T86-G89 PolarHBondContact O-N 3.44Å; P87-G89 VanDerWaalsContact C-N 3.35Å; P87-G89 PolarHBondContact O-N 3.16Å; G89-Y92 PolarHBondContact O-N 3.11Å; G89-L93 WeakPolarHBondContact O-CB 3.08Å; G89-L93 PolarHBondContact O-N 2.68Å
90	I	79.8	Confident	74	Confident	100 Å²	100	72.7 Å²	72.7	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-63.5	-46	177.6	-68.6	164.6	0	0	0	110.7	T86 P87 Y92 L93 W94	T86-I90 HydrophobicContact CG2-CD1 3.57Å; T86-I90 HydrophobicContact CG2-CG1 4.26Å; T86-I90 VanDerWaalsContact O-CG1 3.27Å; T86-I90 WeakPolarHBondContact O-CG1 3.47Å; T86-I90 PolarHBondContact O-N 2.99Å; P87-I90 PolarHBondContact O-N 2.78Å; I90-Y92 VanDerWaalsContact C-N 3.31Å; I90-Y92 PolarHBondContact O-N 3.42Å; I90-L93 PolarHBondContact O-N 2.88Å; I90-W94 VanDerWaalsContact O-CB 3.31Å; I90-W94 WeakPolarHBondContact O-CB 3.26Å; I90-W94 PolarHBondContact O-N 3.35Å
91	L	76	Confident	73.3	Confident	43 Å²	43	82.8 Å²	82.8	23%	0.225	43%	0.432	C	S	.	.	H	α-helix	trans	-62.5	-40.1	177.9	-70.6	-173.2	0	0	0	112.3	P87 W94 D95 A110 S114	P87-L91 WeakPolarHBondContact O-CG 3.39Å; P87-L91 PolarHBondContact O-N 2.96Å; L91-W94 PolarHBondContact O-N 3.46Å; L91-D95 PolarHBondContact O-N 3.47Å; L91-A110 HydrophobicContact CD1-CB 3.47Å; L91-A110 VanDerWaalsContact CD1-CB 3.47Å; L91-A110 WeakPolarHBondContact CD1-O 3.45Å; L91-A110 HydrophobicContact CD2-CB 3.95Å; L91-A110 HydrophobicContact CG-CB 4.39Å; L91-S114 WeakPolarHBondContact CD1-OG 3.4Å
92	Y	74.6	Confident	72.3	Confident	164 Å²	164	86.3 Å²	86.3	64%	0.643	45%	0.453	S	S	*	.	H	α-helix	trans	-66.8	-41.5	177.6	-170.1	-101.1	0	0	0	112	S88 G89 I90 W94 D95 A96	S88-Y92 WeakPolarHBondContact O-CB 3.3Å; S88-Y92 PolarHBondContact O-N 3.3Å; S88-Y92 VanDerWaalsContact O-N 3.14Å; G89-Y92 PolarHBondContact O-N 3.11Å; I90-Y92 VanDerWaalsContact C-N 3.31Å; I90-Y92 PolarHBondContact O-N 3.42Å; Y92-W94 VanDerWaalsContact C-N 3.33Å; Y92-D95 PolarHBondContact O-N 2.93Å; Y92-A96 WeakPolarHBondContact O-CB 3.17Å; Y92-A96 PolarHBondContact O-N 3.47Å
93	L	77.2	Confident	71.5	Confident	107 Å²	107	92.6 Å²	92.6	56%	0.56	47%	0.474	S	S	*	.	H	α-helix	trans	-64.5	-39.6	174.8	-176.4	62.9	0	0	0	111.5	G89 I90 A96 I97	G89-L93 WeakPolarHBondContact O-CB 3.08Å; G89-L93 PolarHBondContact O-N 2.68Å; I90-L93 PolarHBondContact O-N 2.88Å; L93-A96 PolarHBondContact O-N 2.95Å; L93-I97 HydrophobicContact CD1-CD1 4.11Å; L93-I97 HydrophobicContact CD1-CG1 4.39Å; L93-I97 HydrophobicContact CG-CD1 3.89Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.26Å; L93-I97 PolarHBondContact O-N 3.49Å
94	W	77.7	Confident	70.8	Confident	170 Å²	170	90.6 Å²	90.6	64%	0.644	46%	0.464	S	S	*	.	H	α-helix	trans	-62.1	-43.5	176.1	-175	-87.9	0	0	0	112.2	I90 L91 Y92 I97 N98	I90-W94 VanDerWaalsContact O-CB 3.31Å; I90-W94 WeakPolarHBondContact O-CB 3.26Å; I90-W94 PolarHBondContact O-N 3.35Å; L91-W94 PolarHBondContact O-N 3.46Å; Y92-W94 VanDerWaalsContact C-N 3.33Å; W94-I97 PolarHBondContact O-N 2.81Å; W94-N98 WeakPolarHBondContact CZ2-ND2 3.42Å; W94-N98 PolarHBondContact NE1-ND2 3.32Å; W94-N98 WeakPolarHBondContact O-CB 3.4Å; W94-N98 PolarHBondContact O-N 3.08Å
95	D	72.8	Confident	70.7	Confident	53 Å²	53	95.1 Å²	95.1	28%	0.283	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-43	173.5	-167.9	47.9	0	0	0	111.8	L91 Y92 I97 G99 F107	L91-D95 PolarHBondContact O-N 3.47Å; Y92-D95 PolarHBondContact O-N 2.93Å; D95-I97 PolarHBondContact O-N 3.19Å; D95-G99 WeakPolarHBondContact O-CA 2.98Å; D95-G99 PolarHBondContact O-N 2.9Å; D95-F107 HydrophobicContact CB-CE2 3.55Å; D95-F107 HydrophobicContact CB-CZ 3.56Å
96	A	75.1	Confident	70.6	Confident	70 Å²	70	101.3 Å²	101.3	58%	0.579	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-38.4	178.8	0	0	0	0	0	112.8	Y92 L93	Y92-A96 WeakPolarHBondContact O-CB 3.17Å; Y92-A96 PolarHBondContact O-N 3.47Å; L93-A96 PolarHBondContact O-N 2.95Å
97	I	77.8	Confident	70.6	Confident	123 Å²	123	100.2 Å²	100.2	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-76	-46.4	179.6	-67.1	167.7	0	0	0	111.3	L93 W94 D95 G99	L93-I97 HydrophobicContact CD1-CD1 4.11Å; L93-I97 HydrophobicContact CD1-CG1 4.39Å; L93-I97 HydrophobicContact CG-CD1 3.89Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.26Å; L93-I97 PolarHBondContact O-N 3.49Å; W94-I97 PolarHBondContact O-N 2.81Å; D95-I97 PolarHBondContact O-N 3.19Å; I97-G99 VanDerWaalsContact C-N 3.31Å; I97-G99 PolarHBondContact O-N 3Å
98	N	73.7	Confident	70.4	Confident	78 Å²	78	104.6 Å²	104.6	42%	0.417	51%	0.512	S	S	.	.	H	α-helix	trans	-81.9	-13	-175	-72	-31.8	0	0	0	113.3	W94	W94-N98 WeakPolarHBondContact CZ2-ND2 3.42Å; W94-N98 PolarHBondContact NE1-ND2 3.32Å; W94-N98 WeakPolarHBondContact O-CB 3.4Å; W94-N98 PolarHBondContact O-N 3.08Å
99	G	58.4	Low	70.5	Confident	30 Å²	30	107.9 Å²	107.9	31%	0.309	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	62.3	171.5	179.3	0	0	0	0	0	112.8	D95 I97 R101	D95-G99 WeakPolarHBondContact O-CA 2.98Å; D95-G99 PolarHBondContact O-N 2.9Å; I97-G99 VanDerWaalsContact C-N 3.31Å; I97-G99 PolarHBondContact O-N 3Å; G99-R101 PolarHBondContact O-N 3.09Å
100	S	60.1	Low	70.6	Confident	99 Å²	99	107.4 Å²	107.4	69%	0.692	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-57.8	1.6	178.5	-173.1	0	0	0	0	115.1	N102	S100-N102 VanDerWaalsContact C-N 3.31Å; S100-N102 PolarHBondContact O-N 3.22Å
101	R	56.7	Low	70.5	Confident	229 Å²	229	105 Å²	105	86%	0.864	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-69.3	-29	-173.2	-143.3	171.9	-170.2	168	1.8	112.5	G99	G99-R101 PolarHBondContact O-N 3.09Å
102	N	55.8	Low	70.8	Confident	115 Å²	115	110.3 Å²	110.3	62%	0.615	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-128.6	60	179.2	-89.3	56.3	0	0	0	110.7	S100 L104	S100-N102 VanDerWaalsContact C-N 3.31Å; S100-N102 PolarHBondContact O-N 3.22Å; N102-L104 HydrophobicContact CB-CD1 3.57Å; N102-L104 WeakPolarHBondContact ND2-CD1 3.36Å; N102-L104 WeakPolarHBondContact O-CD1 3.48Å; N102-L104 PolarHBondContact O-N 2.77Å
103	R	56.7	Low	71.1	Confident	160 Å²	160	104.8 Å²	104.8	60%	0.604	52%	0.521	S	S	*	.			trans	-72.1	65.5	170.8	-156.9	169.2	74.7	152.8	2.9	110	Y108	R103-Y108 PolarHBondContact NH1-OH 2.85Å
104	L	60.4	Low	71.2	Confident	87 Å²	87	100 Å²	100	46%	0.455	50%	0.496	S	S	.	.			trans	-65.4	143.1	176.2	-86.8	81.6	0	0	0	109.1	N102 W106 F107	N102-L104 HydrophobicContact CB-CD1 3.57Å; N102-L104 WeakPolarHBondContact ND2-CD1 3.36Å; N102-L104 WeakPolarHBondContact O-CD1 3.48Å; N102-L104 PolarHBondContact O-N 2.77Å; L104-W106 PolarHBondContact O-N 2.71Å; L104-F107 WeakPolarHBondContact O-CB 3.36Å; L104-F107 PolarHBondContact O-N 3.13Å
105	D	70.5	Confident	71.4	Confident	132 Å²	132	96.1 Å²	96.1	71%	0.706	49%	0.488	S	S	*	.	H	α-helix	trans	-50.9	-32.1	177.1	-64.8	-38.9	0	0	0	113	F107 Y108	D105-F107 PolarHBondContact O-N 2.91Å; D105-F107 VanDerWaalsContact O-N 3.16Å; D105-Y108 PolarHBondContact O-N 3.48Å; D105-Y108 VanDerWaalsContact O-N 3.11Å
106	W	72.3	Confident	71.8	Confident	202 Å²	202	97 Å²	97	77%	0.765	49%	0.492	S	S	*	.	H	α-helix	trans	-56	-28.2	173.4	-65.9	98	0	0	0	114	L104 T109 A110	L104-W106 PolarHBondContact O-N 2.71Å; W106-T109 PolarHBondContact O-N 3.29Å; W106-A110 VanDerWaalsContact O-CB 3.31Å; W106-A110 WeakPolarHBondContact O-CB 3.27Å; W106-A110 PolarHBondContact O-N 3.37Å
107	F	75.4	Confident	72	Confident	49 Å²	49	96.4 Å²	96.4	22%	0.215	48%	0.479	C	S	.	.	H	α-helix	trans	-65	-38.8	177.4	-175.2	-101.7	0	0	0	112.2	D95 L104 D105 A110 T111	D95-F107 HydrophobicContact CB-CE2 3.55Å; D95-F107 HydrophobicContact CB-CZ 3.56Å; L104-F107 WeakPolarHBondContact O-CB 3.36Å; L104-F107 PolarHBondContact O-N 3.13Å; D105-F107 PolarHBondContact O-N 2.91Å; D105-F107 VanDerWaalsContact O-N 3.16Å; F107-A110 PolarHBondContact O-N 3.25Å; F107-T111 WeakPolarHBondContact O-CB 3.11Å; F107-T111 PolarHBondContact O-N 3.34Å; F107-T111 PolarHBondContact O-OG1 3.24Å
108	Y	74.9	Confident	72	Confident	127 Å²	127	92 Å²	92	50%	0.498	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-44.7	175.3	-77.1	-76.2	0	0	0	110.9	R103 D105 A110 T111 Y112	R103-Y108 PolarHBondContact NH1-OH 2.85Å; D105-Y108 PolarHBondContact O-N 3.48Å; D105-Y108 VanDerWaalsContact O-N 3.11Å; Y108-A110 VanDerWaalsContact C-N 3.34Å; Y108-A110 PolarHBondContact O-N 3.3Å; Y108-T111 PolarHBondContact O-N 3.19Å; Y108-Y112 WeakPolarHBondContact O-CB 3.47Å; Y108-Y112 PolarHBondContact O-N 3.26Å
109	T	78.8	Confident	72.3	Confident	88 Å²	88	93 Å²	93	54%	0.54	46%	0.462	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.2	-50.3	0	0	0	0	111.3	W106 Y112 A113	W106-T109 PolarHBondContact O-N 3.29Å; T109-Y112 PolarHBondContact O-N 2.83Å; T109-A113 WeakPolarHBondContact O-CB 3.39Å; T109-A113 PolarHBondContact O-N 3.23Å
110	A	77.1	Confident	73.2	Confident	29 Å²	29	95.4 Å²	95.4	24%	0.24	47%	0.467	C	S	.	.	H	α-helix	trans	-66	-42	179.7	0	0	0	0	0	111.7	L91 W106 F107 Y108 A113 S114	L91-A110 HydrophobicContact CD1-CB 3.47Å; L91-A110 VanDerWaalsContact CD1-CB 3.47Å; L91-A110 WeakPolarHBondContact CD1-O 3.45Å; L91-A110 HydrophobicContact CD2-CB 3.95Å; L91-A110 HydrophobicContact CG-CB 4.39Å; W106-A110 VanDerWaalsContact O-CB 3.31Å; W106-A110 WeakPolarHBondContact O-CB 3.27Å; W106-A110 PolarHBondContact O-N 3.37Å; F107-A110 PolarHBondContact O-N 3.25Å; Y108-A110 VanDerWaalsContact C-N 3.34Å; Y108-A110 PolarHBondContact O-N 3.3Å; A110-A113 PolarHBondContact O-N 3.23Å; A110-S114 WeakPolarHBondContact O-CB 3.1Å; A110-S114 PolarHBondContact O-N 2.88Å; A110-S114 PolarHBondContact O-OG 3.27Å
111	T	78.9	Confident	73.9	Confident	49 Å²	49	90.8 Å²	90.8	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-62.3	-44.6	175	-60.5	0	0	0	0	111.2	F107 Y108 S114 N115	F107-T111 WeakPolarHBondContact O-CB 3.11Å; F107-T111 PolarHBondContact O-N 3.34Å; F107-T111 PolarHBondContact O-OG1 3.24Å; Y108-T111 PolarHBondContact O-N 3.19Å; T111-S114 PolarHBondContact O-N 3.15Å; T111-N115 VanDerWaalsContact O-CG 3.31Å; T111-N115 PolarHBondContact O-N 3.21Å; T111-N115 PolarHBondContact O-ND2 3.41Å
112	Y	82.1	Confident	74.7	Confident	155 Å²	155	86.2 Å²	86.2	61%	0.608	42%	0.421	S	S	*	.	H	α-helix	trans	-62.8	-46.6	176.5	-176.1	-100.9	0	0	0	111.8	Y108 T109 S114 N115 L116	Y108-Y112 WeakPolarHBondContact O-CB 3.47Å; Y108-Y112 PolarHBondContact O-N 3.26Å; T109-Y112 PolarHBondContact O-N 2.83Å; Y112-S114 VanDerWaalsContact C-N 3.31Å; Y112-S114 PolarHBondContact O-N 2.81Å; Y112-N115 PolarHBondContact O-N 3.36Å; Y112-L116 HydrophobicContact CD1-CD1 3.89Å; Y112-L116 HydrophobicContact CD1-CG 4.25Å; Y112-L116 HydrophobicContact CE1-CD1 3.38Å; Y112-L116 HydrophobicContact CE1-CD2 4.42Å; Y112-L116 HydrophobicContact CE1-CG 3.89Å; Y112-L116 WeakPolarHBondContact O-CG 3.33Å; Y112-L116 PolarHBondContact O-N 2.76Å
113	A	81.7	Confident	75.6	Confident	49 Å²	49	84.3 Å²	84.3	41%	0.405	41%	0.414	S	S	.	.	H	α-helix	trans	-58.7	-43	176.2	0	0	0	0	0	111.6	T109 A110 L116 L117	T109-A113 WeakPolarHBondContact O-CB 3.39Å; T109-A113 PolarHBondContact O-N 3.23Å; A110-A113 PolarHBondContact O-N 3.23Å; A113-L116 WeakPolarHBondContact O-CB 3.48Å; A113-L116 PolarHBondContact O-N 2.64Å; A113-L117 WeakPolarHBondContact O-CB 3.08Å; A113-L117 PolarHBondContact O-N 3.12Å
114	S	78.2	Confident	76.3	Confident	7 Å²	7	79.2 Å²	79.2	5%	0.049	40%	0.398	C	S	.	.	H	α-helix	trans	-64.3	-41.3	176.5	-74.8	0	0	0	0	112.9	S88 L91 A110 T111 Y112 L117 V118	S88-S114 WeakPolarHBondContact OG-CB 3.19Å; S88-S114 PolarHBondContact OG-O 3.37Å; L91-S114 WeakPolarHBondContact CD1-OG 3.4Å; A110-S114 WeakPolarHBondContact O-CB 3.1Å; A110-S114 PolarHBondContact O-N 2.88Å; A110-S114 PolarHBondContact O-OG 3.27Å; T111-S114 PolarHBondContact O-N 3.15Å; Y112-S114 VanDerWaalsContact C-N 3.31Å; Y112-S114 PolarHBondContact O-N 2.81Å; S114-L117 VanDerWaalsContact O-CB 3.3Å; S114-L117 WeakPolarHBondContact O-CB 3.42Å; S114-L117 PolarHBondContact O-N 3.12Å; S114-V118 WeakPolarHBondContact O-CG2 3.23Å; S114-V118 PolarHBondContact O-N 3.1Å
115	N	81.4	Confident	76.8	Confident	88 Å²	88	76.4 Å²	76.4	47%	0.471	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-42.5	173.9	-72.6	-21.3	0	0	0	112	T111 Y112 L117 V118 I119	T111-N115 VanDerWaalsContact O-CG 3.31Å; T111-N115 PolarHBondContact O-N 3.21Å; T111-N115 PolarHBondContact O-ND2 3.41Å; Y112-N115 PolarHBondContact O-N 3.36Å; N115-L117 VanDerWaalsContact C-N 3.3Å; N115-L117 PolarHBondContact O-N 2.96Å; N115-V118 PolarHBondContact O-N 3.4Å; N115-I119 WeakPolarHBondContact O-CG1 3.41Å; N115-I119 PolarHBondContact O-N 3.2Å
116	L	81.5	Confident	76.8	Confident	70 Å²	70	76.4 Å²	76.4	37%	0.366	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-41.4	172.7	-72.2	-177.1	0	0	0	111.4	Y112 A113 V118 I119 I120	Y112-L116 HydrophobicContact CD1-CD1 3.89Å; Y112-L116 HydrophobicContact CD1-CG 4.25Å; Y112-L116 HydrophobicContact CE1-CD1 3.38Å; Y112-L116 HydrophobicContact CE1-CD2 4.42Å; Y112-L116 HydrophobicContact CE1-CG 3.89Å; Y112-L116 WeakPolarHBondContact O-CG 3.33Å; Y112-L116 PolarHBondContact O-N 2.76Å; A113-L116 WeakPolarHBondContact O-CB 3.48Å; A113-L116 PolarHBondContact O-N 2.64Å; L116-V118 VanDerWaalsContact C-N 3.31Å; L116-V118 PolarHBondContact O-N 3.1Å; L116-I119 PolarHBondContact O-N 3.39Å; L116-I120 WeakPolarHBondContact O-CB 3.28Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.4Å; L116-I120 PolarHBondContact O-N 3.06Å
117	L	79.8	Confident	76.6	Confident	58 Å²	58	71 Å²	71	30%	0.304	36%	0.363	S	S	.	.	H	α-helix	trans	-59.6	-43.2	177	-137.9	41.6	0	0	0	110.7	F84 P87 A113 S114 N115 I120 G121	F84-L117 WeakPolarHBondContact CB-O 3.37Å; F84-L117 HydrophobicContact CD1-CB 4.25Å; F84-L117 HydrophobicContact CD1-CD1 3.72Å; F84-L117 HydrophobicContact CD1-CG 3.62Å; F84-L117 WeakPolarHBondContact CD1-O 2.99Å; F84-L117 HydrophobicContact CE1-CD1 3.8Å; F84-L117 HydrophobicContact CE1-CG 4.21Å; F84-L117 WeakPolarHBondContact CG-O 3.41Å; P87-L117 HydrophobicContact CB-CD2 3.95Å; P87-L117 HydrophobicContact CG-CD2 3.39Å; P87-L117 HydrophobicContact CG-CG 4.18Å; A113-L117 WeakPolarHBondContact O-CB 3.08Å; A113-L117 PolarHBondContact O-N 3.12Å; S114-L117 VanDerWaalsContact O-CB 3.3Å; S114-L117 WeakPolarHBondContact O-CB 3.42Å; S114-L117 PolarHBondContact O-N 3.12Å; N115-L117 VanDerWaalsContact C-N 3.3Å; N115-L117 PolarHBondContact O-N 2.96Å; L117-I120 PolarHBondContact O-N 3.08Å; L117-G121 PolarHBondContact O-N 2.81Å
118	V	77.5	Confident	76.3	Confident	32 Å²	32	69.9 Å²	69.9	19%	0.194	36%	0.359	C	S	.	.	H	α-helix	trans	-62.6	-43.3	174.9	171.6	0	0	0	0	111.9	S88 S114 N115 L116 G121 K122	S88-V118 VanDerWaalsContact OG-CG2 3.25Å; S88-V118 WeakPolarHBondContact OG-CG2 3.34Å; S114-V118 WeakPolarHBondContact O-CG2 3.23Å; S114-V118 PolarHBondContact O-N 3.1Å; N115-V118 PolarHBondContact O-N 3.4Å; L116-V118 VanDerWaalsContact C-N 3.31Å; L116-V118 PolarHBondContact O-N 3.1Å; V118-G121 PolarHBondContact O-N 2.91Å; V118-K122 PolarHBondContact O-N 3.44Å; V118-K122 VanDerWaalsContact O-N 3.1Å
119	I	80.7	Confident	75.8	Confident	99 Å²	99	71.8 Å²	71.8	51%	0.508	37%	0.366	S	S	.	.	H	α-helix	trans	-64.5	-46.7	176.9	-65.5	164.4	0	0	0	110.4	N115 L116 G121 K122 T123	N115-I119 WeakPolarHBondContact O-CG1 3.41Å; N115-I119 PolarHBondContact O-N 3.2Å; L116-I119 PolarHBondContact O-N 3.39Å; I119-G121 VanDerWaalsContact C-N 3.26Å; I119-G121 PolarHBondContact O-N 3.37Å; I119-K122 WeakPolarHBondContact O-CB 3.16Å; I119-K122 PolarHBondContact O-N 3.25Å; I119-K122 VanDerWaalsContact O-N 3.08Å; I119-T123 PolarHBondContact O-N 3.04Å; I119-T123 PolarHBondContact O-OG1 2.92Å
120	I	77.6	Confident	74.8	Confident	80 Å²	80	67.9 Å²	67.9	41%	0.41	34%	0.343	S	S	.	.	H	α-helix	trans	-59.5	-40.1	175.7	-69.5	166	0	0	0	110.2	F84 L116 L117 K122 T123 L124	F84-I120 HydrophobicContact CE1-CG2 4.1Å; F84-I120 HydrophobicContact CZ-CG2 4.48Å; L116-I120 WeakPolarHBondContact O-CB 3.28Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.4Å; L116-I120 PolarHBondContact O-N 3.06Å; L117-I120 PolarHBondContact O-N 3.08Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 2.61Å; I120-T123 CarbonylContact O-C 3.56Å; I120-T123 WeakPolarHBondContact O-CB 3Å; I120-T123 PolarHBondContact O-N 3.32Å; I120-T123 VanDerWaalsContact O-N 3.12Å; I120-L124 HydrophobicContact CG2-CD1 3.73Å; I120-L124 HydrophobicContact CG2-CG 4.16Å; I120-L124 WeakPolarHBondContact O-CB 3.39Å; I120-L124 WeakPolarHBondContact O-CG 3.38Å; I120-L124 PolarHBondContact O-N 3.37Å
121	G	72.9	Confident	73.9	Confident	1 Å²	1	69 Å²	69	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-39.6	174.7	0	0	0	0	0	112.9	F84 L117 V118 I119 L124 N125	F84-G121 VanDerWaalsContact CG-CA 3.48Å; L117-G121 PolarHBondContact O-N 2.81Å; V118-G121 PolarHBondContact O-N 2.91Å; I119-G121 VanDerWaalsContact C-N 3.26Å; I119-G121 PolarHBondContact O-N 3.37Å; G121-L124 PolarHBondContact O-N 3.31Å; G121-N125 VanDerWaalsContact O-CG 3.25Å; G121-N125 PolarHBondContact O-N 3.14Å; G121-N125 PolarHBondContact O-ND2 2.93Å; G121-N125 VanDerWaalsContact O-ND2 3.12Å
122	K	74.4	Confident	73	Confident	133 Å²	133	67.7 Å²	67.7	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-63.6	-43.7	172.5	-68	178.4	-176.7	-70.5	0	111.7	V118 I119 I120 N125 F126	V118-K122 PolarHBondContact O-N 3.44Å; V118-K122 VanDerWaalsContact O-N 3.1Å; I119-K122 WeakPolarHBondContact O-CB 3.16Å; I119-K122 PolarHBondContact O-N 3.25Å; I119-K122 VanDerWaalsContact O-N 3.08Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 2.61Å; K122-N125 WeakPolarHBondContact O-CB 3.41Å; K122-N125 PolarHBondContact O-N 3.29Å; K122-F126 PolarHBondContact O-N 3.19Å
123	T	74.5	Confident	72.1	Confident	75 Å²	75	62.3 Å²	62.3	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-39.2	176.7	-50.7	0	0	0	0	111.9	I119 I120 F126 I127	I119-T123 PolarHBondContact O-N 3.04Å; I119-T123 PolarHBondContact O-OG1 2.92Å; I120-T123 CarbonylContact O-C 3.56Å; I120-T123 WeakPolarHBondContact O-CB 3Å; I120-T123 PolarHBondContact O-N 3.32Å; I120-T123 VanDerWaalsContact O-N 3.12Å; T123-F126 WeakPolarHBondContact O-CB 3.38Å; T123-F126 PolarHBondContact O-N 3.02Å; T123-I127 HydrophobicContact CG2-CD1 4.1Å; T123-I127 WeakPolarHBondContact O-CG1 3.32Å; T123-I127 PolarHBondContact O-N 3.27Å
124	L	71.7	Confident	70.9	Confident	54 Å²	54	66 Å²	66	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-68.2	-36.4	177.3	-75.5	170.2	0	0	0	111.7	F84 I120 G121 F126 I127 I128	F84-L124 HydrophobicContact CD2-CD1 4.37Å; F84-L124 HydrophobicContact CE1-CD1 4Å; F84-L124 HydrophobicContact CE2-CB 4.44Å; F84-L124 HydrophobicContact CE2-CD1 3.3Å; F84-L124 HydrophobicContact CE2-CG 4.5Å; F84-L124 HydrophobicContact CZ-CD1 3.1Å; I120-L124 HydrophobicContact CG2-CD1 3.73Å; I120-L124 HydrophobicContact CG2-CG 4.16Å; I120-L124 WeakPolarHBondContact O-CB 3.39Å; I120-L124 WeakPolarHBondContact O-CG 3.38Å; I120-L124 PolarHBondContact O-N 3.37Å; G121-L124 PolarHBondContact O-N 3.31Å; L124-F126 VanDerWaalsContact C-N 3.26Å; L124-F126 PolarHBondContact O-N 2.98Å; L124-I127 HydrophobicContact CD2-CD1 4.1Å; L124-I127 CarbonylContact O-C 3.59Å; L124-I127 PolarHBondContact O-N 3.45Å; L124-I127 VanDerWaalsContact O-N 3.13Å; L124-I128 HydrophobicContact CB-CD1 4.48Å; L124-I128 VanDerWaalsContact O-CB 3.25Å; L124-I128 WeakPolarHBondContact O-CB 3.25Å; L124-I128 VanDerWaalsContact O-CD1 3.28Å; L124-I128 WeakPolarHBondContact O-CD1 3.37Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.39Å
125	N	71.4	Confident	69.8	Low	28 Å²	28	70.6 Å²	70.6	15%	0.15	36%	0.358	C	S	.	.	H	α-helix	trans	-58	-40.3	171.5	-75.1	-33.8	0	0	0	112.1	T77 G121 K122 I128 Y129	T77-N125 VanDerWaalsContact CA-OD1 3.31Å; T77-N125 WeakPolarHBondContact CA-OD1 3.32Å; T77-N125 HydrophobicContact CG2-CB 4.06Å; T77-N125 WeakPolarHBondContact CG2-OD1 3.32Å; T77-N125 PolarHBondContact O-OD1 3.04Å; G121-N125 VanDerWaalsContact O-CG 3.25Å; G121-N125 PolarHBondContact O-N 3.14Å; G121-N125 PolarHBondContact O-ND2 2.93Å; G121-N125 VanDerWaalsContact O-ND2 3.12Å; K122-N125 WeakPolarHBondContact O-CB 3.41Å; K122-N125 PolarHBondContact O-N 3.29Å; N125-I128 PolarHBondContact O-N 3.26Å; N125-Y129 WeakPolarHBondContact O-CB 3.48Å; N125-Y129 PolarHBondContact O-N 3.18Å
126	F	69.6	Low	68.4	Low	132 Å²	132	69.3 Å²	69.3	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-64.5	-48.1	171.6	177.5	-100.9	0	0	0	111.6	K122 T123 L124 I128 Y129 C130	K122-F126 PolarHBondContact O-N 3.19Å; T123-F126 WeakPolarHBondContact O-CB 3.38Å; T123-F126 PolarHBondContact O-N 3.02Å; L124-F126 VanDerWaalsContact C-N 3.26Å; L124-F126 PolarHBondContact O-N 2.98Å; F126-I128 PolarHBondContact O-N 2.81Å; F126-Y129 WeakPolarHBondContact O-CB 3.23Å; F126-Y129 PolarHBondContact O-N 3.01Å; F126-C130 VanDerWaalsContact CE1-SG 3.55Å; F126-C130 VanDerWaalsContact CZ-SG 3.59Å; F126-C130 WeakPolarHBondContact O-CB 3.31Å; F126-C130 PolarHBondContact O-N 3.15Å; F126-C130 PolarHBondContact O-SG 3.42Å
127	I	69.2	Low	67.3	Low	87 Å²	87	72.9 Å²	72.9	45%	0.446	36%	0.356	S	S	.	.	H	α-helix	trans	-60.9	-35.2	177.6	-67.1	164.5	0	0	0	111.6	T123 L124 C130 S131	T123-I127 HydrophobicContact CG2-CD1 4.1Å; T123-I127 WeakPolarHBondContact O-CG1 3.32Å; T123-I127 PolarHBondContact O-N 3.27Å; L124-I127 HydrophobicContact CD2-CD1 4.1Å; L124-I127 CarbonylContact O-C 3.59Å; L124-I127 PolarHBondContact O-N 3.45Å; L124-I127 VanDerWaalsContact O-N 3.13Å; I127-C130 CarbonylContact O-C 3.48Å; I127-C130 VanDerWaalsContact O-CB 3.3Å; I127-C130 WeakPolarHBondContact O-CB 3.06Å; I127-C130 PolarHBondContact O-N 3.36Å; I127-S131 VanDerWaalsContact O-CB 3.3Å; I127-S131 WeakPolarHBondContact O-CB 3.4Å; I127-S131 PolarHBondContact O-N 2.9Å
128	I	68.1	Low	66.2	Low	27 Å²	27	73.5 Å²	73.5	14%	0.138	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-50.8	176.3	-76.3	157.9	0	0	0	109.1	M73 I76 S80 L124 N125 F126 C130 S131 S132	M73-I128 HydrophobicContact CE-CG2 3.34Å; M73-I128 VanDerWaalsContact CE-O 3.3Å; M73-I128 WeakPolarHBondContact CE-O 3.33Å; M73-I128 HydrophobicContact SD-CG2 4.45Å; I76-I128 HydrophobicContact CB-CG2 4.19Å; I76-I128 HydrophobicContact CG2-CD1 3.91Å; I76-I128 HydrophobicContact CG2-CG1 4.1Å; I76-I128 HydrophobicContact CG2-CG2 3.66Å; S80-I128 WeakPolarHBondContact OG-CD1 3.44Å; L124-I128 HydrophobicContact CB-CD1 4.48Å; L124-I128 VanDerWaalsContact O-CB 3.25Å; L124-I128 WeakPolarHBondContact O-CB 3.25Å; L124-I128 VanDerWaalsContact O-CD1 3.28Å; L124-I128 WeakPolarHBondContact O-CD1 3.37Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.39Å; N125-I128 PolarHBondContact O-N 3.26Å; F126-I128 PolarHBondContact O-N 2.81Å; I128-C130 VanDerWaalsContact C-N 3.26Å; I128-C130 PolarHBondContact O-N 3.23Å; I128-S131 CarbonylContact O-C 3.43Å; I128-S131 PolarHBondContact O-N 2.85Å; I128-S131 VanDerWaalsContact O-N 3.07Å; I128-S132 PolarHBondContact O-N 3.4Å
129	Y	65.4	Low	65.4	Low	166 Å²	166	77.4 Å²	77.4	65%	0.651	37%	0.373	S	S	*	.	H	α-helix	trans	-54.7	-45.5	174.3	179.7	-99.1	0	0	0	111.6	N125 F126 S132	N125-Y129 WeakPolarHBondContact O-CB 3.48Å; N125-Y129 PolarHBondContact O-N 3.18Å; F126-Y129 WeakPolarHBondContact O-CB 3.23Å; F126-Y129 PolarHBondContact O-N 3.01Å; Y129-S132 WeakPolarHBondContact O-CB 3.49Å; Y129-S132 PolarHBondContact O-N 2.87Å
130	C	57.4	Low	64.5	Low	7 Å²	7	76.4 Å²	76.4	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-57.5	-50.7	170.8	-79.7	0	0	0	0	112.6	F126 I127 I128 S132 F136	F126-C130 VanDerWaalsContact CE1-SG 3.55Å; F126-C130 VanDerWaalsContact CZ-SG 3.59Å; F126-C130 WeakPolarHBondContact O-CB 3.31Å; F126-C130 PolarHBondContact O-N 3.15Å; F126-C130 PolarHBondContact O-SG 3.42Å; I127-C130 CarbonylContact O-C 3.48Å; I127-C130 VanDerWaalsContact O-CB 3.3Å; I127-C130 WeakPolarHBondContact O-CB 3.06Å; I127-C130 PolarHBondContact O-N 3.36Å; I128-C130 VanDerWaalsContact C-N 3.26Å; I128-C130 PolarHBondContact O-N 3.23Å; C130-S132 PolarHBondContact O-N 3.31Å; C130-F136 VanDerWaalsContact C-CD1 3.41Å; C130-F136 VanDerWaalsContact CA-CD1 3.43Å; C130-F136 HydrophobicContact CB-CD1 3.29Å; C130-F136 HydrophobicContact CB-CD2 4.36Å; C130-F136 HydrophobicContact CB-CE1 3.2Å; C130-F136 HydrophobicContact CB-CE2 4.27Å; C130-F136 HydrophobicContact CB-CG 3.92Å; C130-F136 HydrophobicContact CB-CZ 3.73Å; C130-F136 WeakPolarHBondContact O-CB 3.01Å; C130-F136 WeakPolarHBondContact O-CD1 3.36Å; C130-F136 WeakPolarHBondContact O-CG 3.44Å; C130-F136 WeakPolarHBondContact SG-CE1 2.98Å; C130-F136 VanDerWaalsContact SG-CE2 3.5Å; C130-F136 WeakPolarHBondContact SG-CZ 3.26Å
131	S	57.8	Low	63.7	Low	52 Å²	52	76.1 Å²	76.1	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-66.3	-27.5	178.5	-176.1	0	0	0	0	111.9	I127 I128 S133 R137	I127-S131 VanDerWaalsContact O-CB 3.3Å; I127-S131 WeakPolarHBondContact O-CB 3.4Å; I127-S131 PolarHBondContact O-N 2.9Å; I128-S131 CarbonylContact O-C 3.43Å; I128-S131 PolarHBondContact O-N 2.85Å; I128-S131 VanDerWaalsContact O-N 3.07Å; S131-S133 PolarHBondContact O-N 3.21Å; S131-R137 WeakPolarHBondContact O-CD 3.44Å; S131-R137 WeakPolarHBondContact O-CG 3.29Å; S131-R137 PolarHBondContact O-NE 3.29Å; S131-R137 PolarHBondContact O-NH2 3.32Å; S131-R137 PolarHBondContact OG-NE 2.98Å; S131-R137 PolarHBondContact OG-NH2 3.4Å
132	S	60.3	Low	63.1	Low	21 Å²	21	77.8 Å²	77.8	15%	0.147	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-47.9	178.9	-170.1	0	0	0	0	114.5	M73 I128 Y129 C130 K134	M73-S132 WeakPolarHBondContact CG-OG 3.4Å; M73-S132 WeakPolarHBondContact SD-CB 3.41Å; M73-S132 PolarHBondContact SD-OG 3.26Å; I128-S132 PolarHBondContact O-N 3.4Å; Y129-S132 WeakPolarHBondContact O-CB 3.49Å; Y129-S132 PolarHBondContact O-N 2.87Å; C130-S132 PolarHBondContact O-N 3.31Å; S132-K134 PolarHBondContact O-N 3.29Å; S132-K134 VanDerWaalsContact O-N 3.16Å
133	S	62.9	Low	62.7	Low	42 Å²	42	78.2 Å²	78.2	29%	0.294	38%	0.383	S	S	.	.			trans	-76	117.2	-168.5	-176.3	0	0	0	0	106.3	S131 N135 F136 R137	S131-S133 PolarHBondContact O-N 3.21Å; S133-N135 PolarHBondContact O-N 2.76Å; S133-N135 PolarHBondContact OG-N 3.1Å; S133-F136 PolarHBondContact O-N 2.71Å; S133-R137 PolarHBondContact O-N 2.99Å
134	K	56.8	Low	62.1	Low	127 Å²	127	80.8 Å²	80.8	55%	0.552	39%	0.394	S	S	*	.	H	α-helix	trans	-47.7	-28.9	168.2	-68.9	-177.1	-179.5	178.8	0	110.3	S132 K138	S132-K134 PolarHBondContact O-N 3.29Å; S132-K134 VanDerWaalsContact O-N 3.16Å; K134-K138 WeakPolarHBondContact O-CD 3.33Å; K134-K138 VanDerWaalsContact O-CE 3.26Å; K134-K138 WeakPolarHBondContact O-CE 3.38Å; K134-K138 WeakPolarHBondContact O-CG 3.37Å
135	N	54.2	Low	61.7	Low	104 Å²	104	81.2 Å²	81.2	56%	0.556	40%	0.398	S	S	*	.	H	α-helix	trans	-77.5	-36.5	177.7	-63.9	-12.3	0	0	0	113.3	S133 K138 Q139	S133-N135 PolarHBondContact O-N 2.76Å; S133-N135 PolarHBondContact OG-N 3.1Å; N135-K138 WeakPolarHBondContact O-CB 3.36Å; N135-K138 PolarHBondContact O-N 3.06Å; N135-Q139 PolarHBondContact O-N 3.15Å
136	F	53	Low	61	Low	61 Å²	61	89.6 Å²	89.6	27%	0.268	43%	0.428	S	S	.	.	H	α-helix	trans	-79.1	-37.1	179.7	-175.2	-76.2	0	0	0	112.3	C130 S133 K138 Q139 L140	C130-F136 VanDerWaalsContact C-CD1 3.41Å; C130-F136 VanDerWaalsContact CA-CD1 3.43Å; C130-F136 HydrophobicContact CB-CD1 3.29Å; C130-F136 HydrophobicContact CB-CD2 4.36Å; C130-F136 HydrophobicContact CB-CE1 3.2Å; C130-F136 HydrophobicContact CB-CE2 4.27Å; C130-F136 HydrophobicContact CB-CG 3.92Å; C130-F136 HydrophobicContact CB-CZ 3.73Å; C130-F136 WeakPolarHBondContact O-CB 3.01Å; C130-F136 WeakPolarHBondContact O-CD1 3.36Å; C130-F136 WeakPolarHBondContact O-CG 3.44Å; C130-F136 WeakPolarHBondContact SG-CE1 2.98Å; C130-F136 VanDerWaalsContact SG-CE2 3.5Å; C130-F136 WeakPolarHBondContact SG-CZ 3.26Å; S133-F136 PolarHBondContact O-N 2.71Å; F136-K138 PolarHBondContact O-N 2.96Å; F136-Q139 PolarHBondContact O-N 3.44Å; F136-L140 HydrophobicContact CD1-CB 4.16Å; F136-L140 HydrophobicContact CE1-CB 3.8Å; F136-L140 HydrophobicContact CE1-CD1 4.43Å; F136-L140 HydrophobicContact CE1-CD2 4.22Å; F136-L140 HydrophobicContact CE1-CG 4.37Å; F136-L140 WeakPolarHBondContact O-CB 3.31Å; F136-L140 PolarHBondContact O-N 3.46Å
137	R	58.1	Low	60.4	Low	144 Å²	144	88.9 Å²	88.9	54%	0.543	44%	0.439	S	S	.	.	H	α-helix	trans	-53.7	-39.1	168.7	-70.9	-172.8	-175.7	150.8	15.7	111.8	S131 S133 L141	S131-R137 WeakPolarHBondContact O-CD 3.44Å; S131-R137 WeakPolarHBondContact O-CG 3.29Å; S131-R137 PolarHBondContact O-NE 3.29Å; S131-R137 PolarHBondContact O-NH2 3.32Å; S131-R137 PolarHBondContact OG-NE 2.98Å; S131-R137 PolarHBondContact OG-NH2 3.4Å; S133-R137 PolarHBondContact O-N 2.99Å; R137-L141 VanDerWaalsContact O-CB 3.26Å; R137-L141 WeakPolarHBondContact O-CB 3.23Å; R137-L141 PolarHBondContact O-N 3.46Å
138	K	56.8	Low	59.9	Low	71 Å²	71	91.2 Å²	91.2	31%	0.309	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-47	175.6	-68.6	167.7	-166.1	-176.7	0	111.3	K134 N135 F136 L141 L142 Y160	K134-K138 WeakPolarHBondContact O-CD 3.33Å; K134-K138 VanDerWaalsContact O-CE 3.26Å; K134-K138 WeakPolarHBondContact O-CE 3.38Å; K134-K138 WeakPolarHBondContact O-CG 3.37Å; N135-K138 WeakPolarHBondContact O-CB 3.36Å; N135-K138 PolarHBondContact O-N 3.06Å; F136-K138 PolarHBondContact O-N 2.96Å; K138-L141 PolarHBondContact O-N 3.5Å; K138-L142 WeakPolarHBondContact O-CB 3.39Å; K138-L142 WeakPolarHBondContact O-CG 3.33Å; K138-L142 PolarHBondContact O-N 2.83Å; K138-Y160 HydrophobicContact CD-CD1 3.81Å; K138-Y160 HydrophobicContact CD-CE1 4.28Å; K138-Y160 HydrophobicContact CG-CD1 3.85Å; K138-Y160 HydrophobicContact CG-CE1 3.86Å
139	Q	61.1	Low	59.7	Low	115 Å²	115	93.1 Å²	93.1	54%	0.537	46%	0.463	S	S	.	.	H	α-helix	trans	-66.4	-44.8	177.8	-71.9	-172.6	6.2	0	0	112.8	N135 F136 L141 L142 L143	N135-Q139 PolarHBondContact O-N 3.15Å; F136-Q139 PolarHBondContact O-N 3.44Å; Q139-L141 VanDerWaalsContact C-N 3.31Å; Q139-L141 PolarHBondContact O-N 2.98Å; Q139-L142 CarbonylContact O-C 3.54Å; Q139-L142 WeakPolarHBondContact O-CB 3.49Å; Q139-L142 PolarHBondContact O-N 2.94Å; Q139-L142 VanDerWaalsContact O-N 3.13Å; Q139-L143 WeakPolarHBondContact O-CG 3.39Å; Q139-L143 PolarHBondContact O-N 3.43Å
140	L	60.5	Low	59.6	Low	77 Å²	77	88.3 Å²	88.3	40%	0.403	46%	0.458	S	S	.	.	H	α-helix	trans	-60.7	-42	176.8	-176.9	65.5	0	0	0	111.1	F136 L142 L143 L144	F136-L140 HydrophobicContact CD1-CB 4.16Å; F136-L140 HydrophobicContact CE1-CB 3.8Å; F136-L140 HydrophobicContact CE1-CD1 4.43Å; F136-L140 HydrophobicContact CE1-CD2 4.22Å; F136-L140 HydrophobicContact CE1-CG 4.37Å; F136-L140 WeakPolarHBondContact O-CB 3.31Å; F136-L140 PolarHBondContact O-N 3.46Å; L140-L142 VanDerWaalsContact C-N 3.35Å; L140-L143 PolarHBondContact O-N 3.44Å; L140-L144 HydrophobicContact CD1-CD1 4.1Å; L140-L144 HydrophobicContact CD1-CG 4.21Å; L140-L144 HydrophobicContact CD2-CD1 4.33Å; L140-L144 HydrophobicContact CG-CD1 3.85Å; L140-L144 HydrophobicContact CG-CG 4.32Å; L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 WeakPolarHBondContact O-CG 3.38Å; L140-L144 PolarHBondContact O-N 3.23Å
141	L	61.4	Low	59.9	Low	74 Å²	74	92 Å²	92	39%	0.387	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-35	175.9	-161.2	141	0	0	0	111.8	R137 K138 Q139 L143 L144 V145 F156	R137-L141 VanDerWaalsContact O-CB 3.26Å; R137-L141 WeakPolarHBondContact O-CB 3.23Å; R137-L141 PolarHBondContact O-N 3.46Å; K138-L141 PolarHBondContact O-N 3.5Å; Q139-L141 VanDerWaalsContact C-N 3.31Å; Q139-L141 PolarHBondContact O-N 2.98Å; L141-L143 VanDerWaalsContact C-N 3.28Å; L141-L143 PolarHBondContact O-N 2.98Å; L141-L144 PolarHBondContact O-N 3.4Å; L141-V145 HydrophobicContact CD2-CG2 3.45Å; L141-V145 VanDerWaalsContact CD2-CG2 3.45Å; L141-V145 HydrophobicContact CG-CG2 3.99Å; L141-V145 VanDerWaalsContact O-CB 3.23Å; L141-V145 WeakPolarHBondContact O-CB 3.04Å; L141-V145 WeakPolarHBondContact O-CG2 3.29Å; L141-V145 PolarHBondContact O-N 3.38Å; L141-F156 HydrophobicContact CD2-CE1 4.05Å; L141-F156 HydrophobicContact CD2-CE2 3.66Å; L141-F156 HydrophobicContact CD2-CZ 3.37Å; L141-F156 HydrophobicContact CG-CZ 4.47Å
142	L	60.6	Low	60.2	Low	37 Å²	37	95.7 Å²	95.7	19%	0.194	49%	0.49	C	S	.	.	H	α-helix	trans	-64.6	-31.1	171.3	-74.1	167.7	0	0	0	113.1	K138 Q139 L140 F156 Y157	K138-L142 WeakPolarHBondContact O-CB 3.39Å; K138-L142 WeakPolarHBondContact O-CG 3.33Å; K138-L142 PolarHBondContact O-N 2.83Å; Q139-L142 CarbonylContact O-C 3.54Å; Q139-L142 WeakPolarHBondContact O-CB 3.49Å; Q139-L142 PolarHBondContact O-N 2.94Å; Q139-L142 VanDerWaalsContact O-N 3.13Å; L140-L142 VanDerWaalsContact C-N 3.35Å; L142-F156 HydrophobicContact CD2-CD1 4.14Å; L142-F156 HydrophobicContact CD2-CE1 4.36Å; L142-Y157 HydrophobicContact CD1-CE1 3.59Å; L142-Y157 WeakPolarHBondContact CD1-OH 3.33Å; L142-Y157 HydrophobicContact CD2-CD2 4.47Å; L142-Y157 HydrophobicContact CD2-CE1 3.97Å; L142-Y157 HydrophobicContact CD2-CE2 3.72Å; L142-Y157 VanDerWaalsContact CD2-CZ 3.43Å; L142-Y157 WeakPolarHBondContact CD2-OH 3.08Å; L142-Y157 HydrophobicContact CG-CE1 4.44Å
143	L	65	Low	60.3	Low	142 Å²	142	99.5 Å²	99.5	74%	0.743	50%	0.501	S	S	*	.	H	α-helix	trans	-80	-39.1	175.4	-67.7	172.6	0	0	0	112.1	Q139 L140 L141	Q139-L143 WeakPolarHBondContact O-CG 3.39Å; Q139-L143 PolarHBondContact O-N 3.43Å; L140-L143 PolarHBondContact O-N 3.44Å; L141-L143 VanDerWaalsContact C-N 3.28Å; L141-L143 PolarHBondContact O-N 2.98Å
144	L	62	Low	60.5	Low	129 Å²	129	103 Å²	103	68%	0.675	51%	0.513	S	S	*	.	H	α-helix	trans	-79.5	-30.6	-179.2	-76.1	176	0	0	0	113.4	L140 L141 R146	L140-L144 HydrophobicContact CD1-CD1 4.1Å; L140-L144 HydrophobicContact CD1-CG 4.21Å; L140-L144 HydrophobicContact CD2-CD1 4.33Å; L140-L144 HydrophobicContact CG-CD1 3.85Å; L140-L144 HydrophobicContact CG-CG 4.32Å; L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 WeakPolarHBondContact O-CG 3.38Å; L140-L144 PolarHBondContact O-N 3.23Å; L141-L144 PolarHBondContact O-N 3.4Å; L144-R146 PolarHBondContact O-N 2.87Å
145	V	64	Low	60.8	Low	63 Å²	63	103.3 Å²	103.3	38%	0.382	51%	0.511	S	S	.	.	S	Bend	trans	-70.5	90.1	169.8	175.7	0	0	0	0	107.2	L141	L141-V145 HydrophobicContact CD2-CG2 3.45Å; L141-V145 VanDerWaalsContact CD2-CG2 3.45Å; L141-V145 HydrophobicContact CG-CG2 3.99Å; L141-V145 VanDerWaalsContact O-CB 3.23Å; L141-V145 WeakPolarHBondContact O-CB 3.04Å; L141-V145 WeakPolarHBondContact O-CG2 3.29Å; L141-V145 PolarHBondContact O-N 3.38Å
146	R	56.2	Low	61.5	Low	203 Å²	203	100.9 Å²	100.9	77%	0.766	50%	0.496	S	S	*	.			trans	-28.9	134.4	173.3	-166.7	170.1	162.3	122.3	-4.5	112.5	L144 D148	L144-R146 PolarHBondContact O-N 2.87Å; R146-D148 PolarHBondContact O-N 2.9Å
147	S	57.1	Low	62.1	Low	118 Å²	118	102.1 Å²	102.1	83%	0.825	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	2.4	-173.3	-0.6	0	0	0	0	117.9
148	D	59.9	Low	62.4	Low	136 Å²	136	95.9 Å²	95.9	73%	0.727	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-28	-169.1	-132	-18.3	0	0	0	113.9	R146	R146-D148 PolarHBondContact O-N 2.9Å
149	D	62.9	Low	62.8	Low	67 Å²	67	100.9 Å²	100.9	36%	0.358	50%	0.5	S	S	.	.			trans	-108.4	74	-176.7	-77.6	-51.5	0	0	0	112.3	T151 K152 R153	D149-T151 PolarHBondContact O-N 3.37Å; D149-T151 VanDerWaalsContact O-N 3.17Å; D149-K152 HydrophobicContact CB-CB 3.74Å; D149-K152 HydrophobicContact CB-CD 3.75Å; D149-K152 HydrophobicContact CB-CG 3.73Å; D149-K152 PolarHBondContact O-N 2.88Å; D149-K152 VanDerWaalsContact O-N 3.1Å; D149-K152 VanDerWaalsContact OD2-CD 3.28Å; D149-K152 WeakPolarHBondContact OD2-CD 3.06Å; D149-K152 WeakPolarHBondContact OD2-CE 3.17Å; D149-K152 IonicContact OD2-NZ 2.88Å; D149-K152 PolarHBondContact OD2-NZ 2.92Å; D149-R153 PolarHBondContact O-N 3.01Å
150	A	63.3	Low	62.6	Low	65 Å²	65	100.3 Å²	100.3	54%	0.537	49%	0.494	S	S	.	.	H	α-helix	trans	-51.6	-35.1	169.4	0	0	0	0	0	112	R153 Q154	A150-R153 WeakPolarHBondContact O-CB 3.4Å; A150-R153 PolarHBondContact O-N 3.41Å; A150-Q154 PolarHBondContact O-N 2.8Å; A150-Q154 VanDerWaalsContact O-N 3.13Å
151	T	64.7	Low	62.9	Low	85 Å²	85	102.1 Å²	102.1	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-46.9	176.5	-49.5	0	0	0	0	112	D149 R153 Q154 Y155	D149-T151 PolarHBondContact O-N 3.37Å; D149-T151 VanDerWaalsContact O-N 3.17Å; T151-R153 VanDerWaalsContact C-N 3.29Å; T151-R153 PolarHBondContact O-N 3.38Å; T151-Q154 PolarHBondContact O-N 3.16Å; T151-Y155 HydrophobicContact CG2-CD2 4.12Å; T151-Y155 HydrophobicContact CG2-CE2 3.9Å; T151-Y155 WeakPolarHBondContact O-CD2 3.41Å; T151-Y155 PolarHBondContact O-N 3.36Å
152	K	63.6	Low	62.7	Low	129 Å²	129	101.6 Å²	101.6	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-64.5	-36.1	177.4	-67.6	-179.3	-172.1	155.1	0	111.2	D149 Q154 F156	D149-K152 HydrophobicContact CB-CB 3.74Å; D149-K152 HydrophobicContact CB-CD 3.75Å; D149-K152 HydrophobicContact CB-CG 3.73Å; D149-K152 PolarHBondContact O-N 2.88Å; D149-K152 VanDerWaalsContact O-N 3.1Å; D149-K152 VanDerWaalsContact OD2-CD 3.28Å; D149-K152 WeakPolarHBondContact OD2-CD 3.06Å; D149-K152 WeakPolarHBondContact OD2-CE 3.17Å; D149-K152 IonicContact OD2-NZ 2.88Å; D149-K152 PolarHBondContact OD2-NZ 2.92Å; K152-Q154 PolarHBondContact O-N 2.88Å; K152-F156 WeakPolarHBondContact O-CB 3.17Å; K152-F156 PolarHBondContact O-N 3.47Å
153	R	62.4	Low	62.2	Low	101 Å²	101	103.8 Å²	103.8	38%	0.381	53%	0.527	S	S	.	.	H	α-helix	trans	-57.4	-48	172.8	-73.8	179.5	67.9	-155.9	-0.3	111.3	D149 A150 T151 F156 Y157	D149-R153 PolarHBondContact O-N 3.01Å; A150-R153 WeakPolarHBondContact O-CB 3.4Å; A150-R153 PolarHBondContact O-N 3.41Å; T151-R153 VanDerWaalsContact C-N 3.29Å; T151-R153 PolarHBondContact O-N 3.38Å; R153-F156 CarbonylContact O-C 3.56Å; R153-F156 WeakPolarHBondContact O-CB 3.41Å; R153-F156 PolarHBondContact O-N 3.46Å; R153-Y157 HydrophobicContact CB-CD2 4.17Å; R153-Y157 HydrophobicContact CB-CE2 4.03Å; R153-Y157 PolarHBondContact NH2-OH 2.73Å; R153-Y157 WeakPolarHBondContact O-CB 3.11Å; R153-Y157 WeakPolarHBondContact O-CD2 3.24Å; R153-Y157 PolarHBondContact O-N 3.16Å
154	Q	66.2	Low	61.7	Low	115 Å²	115	105.7 Å²	105.7	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-62.2	-47.1	-179.8	-73.6	-176.4	-28.4	0	0	113.2	A150 T151 K152 F156 Y157 A158 F170	A150-Q154 PolarHBondContact O-N 2.8Å; A150-Q154 VanDerWaalsContact O-N 3.13Å; T151-Q154 PolarHBondContact O-N 3.16Å; K152-Q154 PolarHBondContact O-N 2.88Å; Q154-F156 VanDerWaalsContact C-N 3.29Å; Q154-F156 PolarHBondContact O-N 2.74Å; Q154-Y157 PolarHBondContact O-N 2.85Å; Q154-A158 VanDerWaalsContact O-CB 3.23Å; Q154-A158 WeakPolarHBondContact O-CB 3.49Å; Q154-A158 PolarHBondContact O-N 2.91Å; Q154-F170 HydrophobicContact CB-CE2 4.39Å; Q154-F170 HydrophobicContact CB-CZ 3.99Å
155	Y	63.5	Low	61.3	Low	134 Å²	134	104.2 Å²	104.2	53%	0.525	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-40.6	175.1	-81.5	-80.4	0	0	0	112	T151 K159 F170	T151-Y155 HydrophobicContact CG2-CD2 4.12Å; T151-Y155 HydrophobicContact CG2-CE2 3.9Å; T151-Y155 WeakPolarHBondContact O-CD2 3.41Å; T151-Y155 PolarHBondContact O-N 3.36Å; Y155-K159 WeakPolarHBondContact O-CB 3.22Å; Y155-K159 PolarHBondContact O-N 2.76Å; Y155-F170 HydrophobicContact CD2-CZ 4.3Å; Y155-F170 HydrophobicContact CE1-CD1 4.26Å; Y155-F170 HydrophobicContact CE1-CE1 4.32Å; Y155-F170 HydrophobicContact CE1-CG 4.36Å; Y155-F170 HydrophobicContact CE1-CZ 4.48Å; Y155-F170 HydrophobicContact CE2-CD1 4.47Å; Y155-F170 AromaticContact CE2-CE1 3.86Å; Y155-F170 HydrophobicContact CE2-CE1 3.86Å; Y155-F170 HydrophobicContact CE2-CZ 4.08Å; Y155-F170 AromaticContact CZ-CD1 3.89Å; Y155-F170 AromaticContact CZ-CE1 3.74Å
156	F	69.1	Low	60.5	Low	52 Å²	52	104.2 Å²	104.2	23%	0.228	52%	0.522	C	S	.	.	H	α-helix	trans	-59.1	-62.7	173.1	-166.9	-93.5	0	0	0	108.9	L141 L142 K152 R153 Q154 A158 K159 Y160	L141-F156 HydrophobicContact CD2-CE1 4.05Å; L141-F156 HydrophobicContact CD2-CE2 3.66Å; L141-F156 HydrophobicContact CD2-CZ 3.37Å; L141-F156 HydrophobicContact CG-CZ 4.47Å; L142-F156 HydrophobicContact CD2-CD1 4.14Å; L142-F156 HydrophobicContact CD2-CE1 4.36Å; K152-F156 WeakPolarHBondContact O-CB 3.17Å; K152-F156 PolarHBondContact O-N 3.47Å; R153-F156 CarbonylContact O-C 3.56Å; R153-F156 WeakPolarHBondContact O-CB 3.41Å; R153-F156 PolarHBondContact O-N 3.46Å; Q154-F156 VanDerWaalsContact C-N 3.29Å; Q154-F156 PolarHBondContact O-N 2.74Å; F156-A158 VanDerWaalsContact C-N 3.26Å; F156-A158 PolarHBondContact O-N 3.44Å; F156-A158 VanDerWaalsContact O-N 3.14Å; F156-K159 CarbonylContact O-C 3.54Å; F156-K159 WeakPolarHBondContact O-CA 3.14Å; F156-K159 WeakPolarHBondContact O-CB 3.12Å; F156-K159 PolarHBondContact O-N 3.11Å; F156-Y160 HydrophobicContact CB-CD2 4.45Å; F156-Y160 HydrophobicContact CB-CE2 4.44Å; F156-Y160 AromaticContact CD1-CD2 3.24Å; F156-Y160 HydrophobicContact CD1-CD2 3.24Å; F156-Y160 AromaticContact CD1-CE2 3.24Å; F156-Y160 HydrophobicContact CD1-CE2 3.24Å; F156-Y160 HydrophobicContact CD1-CG 4.37Å; F156-Y160 HydrophobicContact CD2-CD2 4.13Å; F156-Y160 AromaticContact CD2-CE2 3.36Å; F156-Y160 HydrophobicContact CD2-CE2 3.36Å; F156-Y160 AromaticContact CE1-CD2 3.29Å; F156-Y160 HydrophobicContact CE1-CD2 3.29Å; F156-Y160 HydrophobicContact CE1-CE1 4.29Å; F156-Y160 AromaticContact CE1-CE2 3.01Å; F156-Y160 HydrophobicContact CE1-CE2 3.01Å; F156-Y160 HydrophobicContact CE1-CG 4.21Å; F156-Y160 AromaticContact CE1-CZ 3.49Å; F156-Y160 VanDerWaalsContact CE1-CZ 3.49Å; F156-Y160 HydrophobicContact CE2-CD2 4.17Å; F156-Y160 AromaticContact CE2-CE2 3.13Å; F156-Y160 HydrophobicContact CE2-CE2 3.13Å; F156-Y160 AromaticContact CE2-CZ 3.49Å; F156-Y160 VanDerWaalsContact CE2-CZ 3.49Å; F156-Y160 WeakPolarHBondContact CE2-OH 3.27Å; F156-Y160 AromaticContact CG-CD2 3.66Å; F156-Y160 HydrophobicContact CG-CD2 3.66Å; F156-Y160 AromaticContact CG-CE2 3.39Å; F156-Y160 HydrophobicContact CG-CE2 3.39Å; F156-Y160 AromaticContact CZ-CD2 3.75Å; F156-Y160 HydrophobicContact CZ-CD2 3.75Å; F156-Y160 HydrophobicContact CZ-CE1 4.11Å; F156-Y160 AromaticContact CZ-CE2 2.92Å; F156-Y160 HydrophobicContact CZ-CE2 2.92Å; F156-Y160 AromaticContact CZ-CZ 3.06Å; F156-Y160 WeakPolarHBondContact CZ-OH 3.38Å; F156-Y160 WeakPolarHBondContact O-CD2 3.14Å; F156-Y160 PolarHBondContact O-N 2.72Å
157	Y	66.6	Low	60.3	Low	88 Å²	88	100.4 Å²	100.4	35%	0.345	52%	0.521	S	S	.	.	H	α-helix	trans	-48.7	-44.4	178.1	-79.1	-69.6	0	0	0	113.4	L142 R153 Q154 K159 Y160 L161	L142-Y157 HydrophobicContact CD1-CE1 3.59Å; L142-Y157 WeakPolarHBondContact CD1-OH 3.33Å; L142-Y157 HydrophobicContact CD2-CD2 4.47Å; L142-Y157 HydrophobicContact CD2-CE1 3.97Å; L142-Y157 HydrophobicContact CD2-CE2 3.72Å; L142-Y157 VanDerWaalsContact CD2-CZ 3.43Å; L142-Y157 WeakPolarHBondContact CD2-OH 3.08Å; L142-Y157 HydrophobicContact CG-CE1 4.44Å; R153-Y157 HydrophobicContact CB-CD2 4.17Å; R153-Y157 HydrophobicContact CB-CE2 4.03Å; R153-Y157 PolarHBondContact NH2-OH 2.73Å; R153-Y157 WeakPolarHBondContact O-CB 3.11Å; R153-Y157 WeakPolarHBondContact O-CD2 3.24Å; R153-Y157 PolarHBondContact O-N 3.16Å; Q154-Y157 PolarHBondContact O-N 2.85Å; Y157-K159 PolarHBondContact O-N 3.02Å; Y157-Y160 PolarHBondContact O-N 3.23Å; Y157-Y160 VanDerWaalsContact O-N 3.14Å; Y157-L161 WeakPolarHBondContact O-CB 3.45Å; Y157-L161 PolarHBondContact O-N 3.25Å
158	A	63	Low	60.1	Low	12 Å²	12	102 Å²	102	10%	0.099	51%	0.513	C	S	.	.	H	α-helix	trans	-63.6	-40.6	179.4	0	0	0	0	0	112	Q154 F156 T166	Q154-A158 VanDerWaalsContact O-CB 3.23Å; Q154-A158 WeakPolarHBondContact O-CB 3.49Å; Q154-A158 PolarHBondContact O-N 2.91Å; F156-A158 VanDerWaalsContact C-N 3.26Å; F156-A158 PolarHBondContact O-N 3.44Å; F156-A158 VanDerWaalsContact O-N 3.14Å; A158-T166 HydrophobicContact CB-CG2 3.9Å; A158-T166 WeakPolarHBondContact O-CG2 3.46Å
159	K	65.7	Low	59.8	Low	176 Å²	176	102 Å²	102	77%	0.765	51%	0.512	S	S	*	.	H	α-helix	trans	-67.8	-33.7	171.7	-172.2	174.3	-177.9	175.2	0	112.6	Y155 F156 Y157	Y155-K159 WeakPolarHBondContact O-CB 3.22Å; Y155-K159 PolarHBondContact O-N 2.76Å; F156-K159 CarbonylContact O-C 3.54Å; F156-K159 WeakPolarHBondContact O-CA 3.14Å; F156-K159 WeakPolarHBondContact O-CB 3.12Å; F156-K159 PolarHBondContact O-N 3.11Å; Y157-K159 PolarHBondContact O-N 3.02Å
160	Y	57.6	Low	59.4	Low	104 Å²	104	101.7 Å²	101.7	41%	0.408	51%	0.508	S	S	.	.	H	α-helix	trans	-78.9	-32.9	-179.1	-82.8	-79.2	0	0	0	114.9	K138 F156 Y157 G162	K138-Y160 HydrophobicContact CD-CD1 3.81Å; K138-Y160 HydrophobicContact CD-CE1 4.28Å; K138-Y160 HydrophobicContact CG-CD1 3.85Å; K138-Y160 HydrophobicContact CG-CE1 3.86Å; F156-Y160 HydrophobicContact CB-CD2 4.45Å; F156-Y160 HydrophobicContact CB-CE2 4.44Å; F156-Y160 AromaticContact CD1-CD2 3.24Å; F156-Y160 HydrophobicContact CD1-CD2 3.24Å; F156-Y160 AromaticContact CD1-CE2 3.24Å; F156-Y160 HydrophobicContact CD1-CE2 3.24Å; F156-Y160 HydrophobicContact CD1-CG 4.37Å; F156-Y160 HydrophobicContact CD2-CD2 4.13Å; F156-Y160 AromaticContact CD2-CE2 3.36Å; F156-Y160 HydrophobicContact CD2-CE2 3.36Å; F156-Y160 AromaticContact CE1-CD2 3.29Å; F156-Y160 HydrophobicContact CE1-CD2 3.29Å; F156-Y160 HydrophobicContact CE1-CE1 4.29Å; F156-Y160 AromaticContact CE1-CE2 3.01Å; F156-Y160 HydrophobicContact CE1-CE2 3.01Å; F156-Y160 HydrophobicContact CE1-CG 4.21Å; F156-Y160 AromaticContact CE1-CZ 3.49Å; F156-Y160 VanDerWaalsContact CE1-CZ 3.49Å; F156-Y160 HydrophobicContact CE2-CD2 4.17Å; F156-Y160 AromaticContact CE2-CE2 3.13Å; F156-Y160 HydrophobicContact CE2-CE2 3.13Å; F156-Y160 AromaticContact CE2-CZ 3.49Å; F156-Y160 VanDerWaalsContact CE2-CZ 3.49Å; F156-Y160 WeakPolarHBondContact CE2-OH 3.27Å; F156-Y160 AromaticContact CG-CD2 3.66Å; F156-Y160 HydrophobicContact CG-CD2 3.66Å; F156-Y160 AromaticContact CG-CE2 3.39Å; F156-Y160 HydrophobicContact CG-CE2 3.39Å; F156-Y160 AromaticContact CZ-CD2 3.75Å; F156-Y160 HydrophobicContact CZ-CD2 3.75Å; F156-Y160 HydrophobicContact CZ-CE1 4.11Å; F156-Y160 AromaticContact CZ-CE2 2.92Å; F156-Y160 HydrophobicContact CZ-CE2 2.92Å; F156-Y160 AromaticContact CZ-CZ 3.06Å; F156-Y160 WeakPolarHBondContact CZ-OH 3.38Å; F156-Y160 WeakPolarHBondContact O-CD2 3.14Å; F156-Y160 PolarHBondContact O-N 2.72Å; Y157-Y160 PolarHBondContact O-N 3.23Å; Y157-Y160 VanDerWaalsContact O-N 3.14Å; Y160-G162 PolarHBondContact O-N 3.35Å
161	L	65.7	Low	58.7	Low	115 Å²	115	102 Å²	102	60%	0.602	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.9	177.7	-91.5	154.8	0	0	0	111.9	Y157 I163	Y157-L161 WeakPolarHBondContact O-CB 3.45Å; Y157-L161 PolarHBondContact O-N 3.25Å; L161-I163 HydrophobicContact CB-CB 4.33Å; L161-I163 HydrophobicContact CB-CD1 3.75Å; L161-I163 HydrophobicContact CB-CG1 3.86Å; L161-I163 HydrophobicContact CD1-CD1 4.13Å; L161-I163 HydrophobicContact CD2-CD1 3.95Å; L161-I163 HydrophobicContact CG-CD1 4.15Å; L161-I163 PolarHBondContact O-N 2.91Å
162	G	57.9	Low	58.2	Low	63 Å²	63	109.4 Å²	109.4	65%	0.649	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	15.3	-178.1	0	0	0	0	0	112.4	Y160 E164	Y160-G162 PolarHBondContact O-N 3.35Å; G162-E164 PolarHBondContact O-N 2.75Å
163	I	50.4	Low	57.6	Low	83 Å²	83	108.5 Å²	108.5	43%	0.426	52%	0.524	S	S	.	.			trans	-69.3	107.8	177.5	-74.3	169.2	0	0	0	104.5	L161 Q165 T166	L161-I163 HydrophobicContact CB-CB 4.33Å; L161-I163 HydrophobicContact CB-CD1 3.75Å; L161-I163 HydrophobicContact CB-CG1 3.86Å; L161-I163 HydrophobicContact CD1-CD1 4.13Å; L161-I163 HydrophobicContact CD2-CD1 3.95Å; L161-I163 HydrophobicContact CG-CD1 4.15Å; L161-I163 PolarHBondContact O-N 2.91Å; I163-Q165 HydrophobicContact CG2-CB 3.38Å; I163-Q165 HydrophobicContact CG2-CG 3.78Å; I163-Q165 VanDerWaalsContact CG2-N 3.3Å; I163-Q165 PolarHBondContact O-N 3.33Å; I163-T166 PolarHBondContact O-N 3.17Å; I163-T166 VanDerWaalsContact O-N 3.12Å
164	E	53.6	Low	57.1	Low	182 Å²	182	106.2 Å²	106.2	85%	0.85	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-7.8	167.1	-88.2	-154.8	108.4	0	0	113.5	G162 T166	G162-E164 PolarHBondContact O-N 2.75Å; E164-T166 VanDerWaalsContact C-N 3.31Å; E164-T166 PolarHBondContact O-N 3.43Å
165	Q	53.2	Low	56.6	Low	97 Å²	97	105.1 Å²	105.1	45%	0.453	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	15.7	175	-47.4	-141.6	-5.5	0	0	114.8	I163 T167 K168 L169	I163-Q165 HydrophobicContact CG2-CB 3.38Å; I163-Q165 HydrophobicContact CG2-CG 3.78Å; I163-Q165 VanDerWaalsContact CG2-N 3.3Å; I163-Q165 PolarHBondContact O-N 3.33Å; Q165-T167 PolarHBondContact O-N 3.48Å; Q165-K168 HydrophobicContact CB-CB 4.18Å; Q165-K168 HydrophobicContact CB-CG 4.4Å; Q165-K168 CarbonylContact O-C 3.58Å; Q165-K168 WeakPolarHBondContact O-CA 3.5Å; Q165-K168 PolarHBondContact O-N 2.78Å; Q165-L169 PolarHBondContact O-N 2.75Å
166	T	49	Very low	56.2	Low	63 Å²	63	105 Å²	105	39%	0.387	54%	0.535	S	S	.	.	H	α-helix	trans	-56.2	-27.4	166.4	55.4	0	0	0	0	112.3	A158 I163 E164 K168 F170	A158-T166 HydrophobicContact CB-CG2 3.9Å; A158-T166 WeakPolarHBondContact O-CG2 3.46Å; I163-T166 PolarHBondContact O-N 3.17Å; I163-T166 VanDerWaalsContact O-N 3.12Å; E164-T166 VanDerWaalsContact C-N 3.31Å; E164-T166 PolarHBondContact O-N 3.43Å; T166-K168 VanDerWaalsContact C-N 3.3Å; T166-K168 PolarHBondContact O-N 3.4Å; T166-F170 PolarHBondContact O-N 3.49Å
167	T	51.9	Low	55.6	Low	123 Å²	123	111.6 Å²	111.6	76%	0.755	56%	0.559	S	S	*	*	H	α-helix	trans	-70.3	-22.7	170.9	-23.9	0	0	0	0	113.3	Q165	Q165-T167 PolarHBondContact O-N 3.48Å
168	K	52.8	Low	55.1	Low	153 Å²	153	117.1 Å²	117.1	67%	0.665	58%	0.579	S	S	*	*	H	α-helix	trans	-98.2	-34	178.4	-56.5	-163.6	-168.1	168.2	0	113.8	Q165 T166	Q165-K168 HydrophobicContact CB-CB 4.18Å; Q165-K168 HydrophobicContact CB-CG 4.4Å; Q165-K168 CarbonylContact O-C 3.58Å; Q165-K168 WeakPolarHBondContact O-CA 3.5Å; Q165-K168 PolarHBondContact O-N 2.78Å; T166-K168 VanDerWaalsContact C-N 3.3Å; T166-K168 PolarHBondContact O-N 3.4Å
169	L	53.4	Low	54.7	Low	135 Å²	135	122 Å²	122	71%	0.707	60%	0.599	S	S	*	*	H	α-helix	trans	-80	-29.6	-175.6	-160.2	69.9	0	0	0	112.7	Q165 P171	Q165-L169 PolarHBondContact O-N 2.75Å; L169-P171 VanDerWaalsContact C-CD 3.47Å; L169-P171 WeakPolarHBondContact O-CD 3.33Å
170	F	54.3	Low	54.2	Low	60 Å²	60	121.1 Å²	121.1	26%	0.263	60%	0.595	S	S	.	*	S	Bend	trans	-107.8	87.3	169.5	-84.8	-85.5	0	0	0	109.5	Q154 Y155 T166 R172	Q154-F170 HydrophobicContact CB-CE2 4.39Å; Q154-F170 HydrophobicContact CB-CZ 3.99Å; Y155-F170 HydrophobicContact CD2-CZ 4.3Å; Y155-F170 HydrophobicContact CE1-CD1 4.26Å; Y155-F170 HydrophobicContact CE1-CE1 4.32Å; Y155-F170 HydrophobicContact CE1-CG 4.36Å; Y155-F170 HydrophobicContact CE1-CZ 4.48Å; Y155-F170 HydrophobicContact CE2-CD1 4.47Å; Y155-F170 AromaticContact CE2-CE1 3.86Å; Y155-F170 HydrophobicContact CE2-CE1 3.86Å; Y155-F170 HydrophobicContact CE2-CZ 4.08Å; Y155-F170 AromaticContact CZ-CD1 3.89Å; Y155-F170 AromaticContact CZ-CE1 3.74Å; T166-F170 PolarHBondContact O-N 3.49Å; F170-R172 PolarHBondContact O-N 3.41Å
171	P	49.3	Very low	54.1	Low	72 Å²	72	124.1 Å²	124.1	47%	0.468	61%	0.611	S	S	.	*			trans	-61.3	106.6	163.7	26.1	-31.9	0	0	0	107.4	L169 N173 A174	L169-P171 VanDerWaalsContact C-CD 3.47Å; L169-P171 WeakPolarHBondContact O-CD 3.33Å; P171-N173 PolarHBondContact O-N 2.89Å; P171-A174 HydrophobicContact CB-CB 4.43Å; P171-A174 HydrophobicContact CG-CB 3.87Å; P171-A174 PolarHBondContact O-N 3.44Å
172	R	53.1	Low	54.2	Low	240 Å²	240	124.8 Å²	124.8	91%	0.906	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	-20.7	160.2	-86	-164.2	-179.5	-147.4	3.8	111.6	F170	F170-R172 PolarHBondContact O-N 3.41Å
173	N	50.6	Low	54.5	Low	110 Å²	110	132.1 Å²	132.1	59%	0.588	62%	0.622	S	S	*	*	H	α-helix	trans	-87.6	-2.3	-178.7	-57.2	-6.6	0	0	0	114.4	P171 R177	P171-N173 PolarHBondContact O-N 2.89Å; N173-R177 WeakPolarHBondContact O-CB 2.92Å; N173-R177 PolarHBondContact O-N 2.95Å
174	A	53.3	Low	55.1	Low	53 Å²	53	135 Å²	135	44%	0.438	64%	0.638	S	S	.	*	H	α-helix	trans	-73.5	-28.1	175.9	0	0	0	0	0	113.1	P171	P171-A174 HydrophobicContact CB-CB 4.43Å; P171-A174 HydrophobicContact CG-CB 3.87Å; P171-A174 PolarHBondContact O-N 3.44Å
175	C	55.3	Low	55.6	Low	93 Å²	93	134.2 Å²	134.2	63%	0.628	65%	0.653	S	S	*	*	H	α-helix	trans	-72.1	-48.1	173.3	-152.5	0	0	0	0	110.5	R177 R178 E179	C175-R177 VanDerWaalsContact C-N 3.33Å; C175-R177 PolarHBondContact O-N 3.22Å; C175-R178 PolarHBondContact O-N 3.02Å; C175-E179 PolarHBondContact O-N 3.49Å
176	H	53.9	Low	55.7	Low	130 Å²	130	136.1 Å²	136.1	60%	0.602	66%	0.663	S	S	*	*	H	α-helix	trans	-68.5	-25	177.1	-90.7	12.8	0	0	0	114.9	R178 E179 K180	H176-R178 VanDerWaalsContact C-N 3.32Å; H176-E179 IonicContact CE1-OE2 3.92Å; H176-E179 IonicContact ND1-OE2 3.43Å; H176-E179 PolarHBondContact ND1-OE2 3.31Å; H176-E179 PolarHBondContact O-N 2.82Å; H176-K180 PolarHBondContact O-N 3.19Å
177	R	57.1	Low	56.1	Low	192 Å²	192	139.9 Å²	139.9	73%	0.725	68%	0.677	S	S	*	*	H	α-helix	trans	-73.1	-24.2	175.6	-166.3	177.5	-68.9	-142.2	-0.1	112.5	N173 C175	N173-R177 WeakPolarHBondContact O-CB 2.92Å; N173-R177 PolarHBondContact O-N 2.95Å; C175-R177 VanDerWaalsContact C-N 3.33Å; C175-R177 PolarHBondContact O-N 3.22Å
178	R	55.6	Low	56.3	Low	203 Å²	203	140.9 Å²	140.9	77%	0.766	67%	0.673	S	S	*	*	H	α-helix	trans	-76.8	-32.8	172.4	-93.7	-161.6	-77.3	-154.3	-1	112.9	C175 H176	C175-R178 PolarHBondContact O-N 3.02Å; H176-R178 VanDerWaalsContact C-N 3.32Å
179	E	54.4	Low	56.5	Low	115 Å²	115	140.2 Å²	140.2	54%	0.537	67%	0.674	S	S	.	*	H	α-helix	trans	-70.1	-40	176.2	-84	176.7	118.2	0	0	113.1	C175 H176 K181 I182	C175-E179 PolarHBondContact O-N 3.49Å; H176-E179 IonicContact CE1-OE2 3.92Å; H176-E179 IonicContact ND1-OE2 3.43Å; H176-E179 PolarHBondContact ND1-OE2 3.31Å; H176-E179 PolarHBondContact O-N 2.82Å; E179-K181 PolarHBondContact O-N 3.41Å; E179-I182 PolarHBondContact O-N 3.3Å
180	K	55.7	Low	56.7	Low	157 Å²	157	140.5 Å²	140.5	68%	0.683	67%	0.671	S	S	*	*	H	α-helix	trans	-69.9	-29.6	-177.6	-72.4	-159.1	175	-167.9	0	114.6	H176 I182 W183	H176-K180 PolarHBondContact O-N 3.19Å; K180-I182 VanDerWaalsContact C-N 3.26Å; K180-I182 PolarHBondContact O-N 3.23Å; K180-W183 PolarHBondContact O-N 3.48Å
181	K	56.1	Low	56.9	Low	167 Å²	167	145.9 Å²	145.9	73%	0.726	70%	0.699	S	S	*	*	H	α-helix	trans	-71.6	-18.7	178	-93.2	-160.2	178	-164.2	0	114.1	E179	E179-K181 PolarHBondContact O-N 3.41Å
182	I	68.3	Low	57.4	Low	130 Å²	130	151.1 Å²	151.1	67%	0.667	72%	0.715	S	S	*	*	H	α-helix	trans	-80.2	-21.6	-179.4	-70.5	171	0	0	0	111.6	E179 K180	E179-I182 PolarHBondContact O-N 3.3Å; K180-I182 VanDerWaalsContact C-N 3.26Å; K180-I182 PolarHBondContact O-N 3.23Å
183	W	63.5	Low	57.7	Low	217 Å²	217	144.3 Å²	144.3	82%	0.822	70%	0.701	S	S	*	*	H	α-helix	trans	-99	-12.8	-177.8	-70.2	102.5	0	0	0	114.9	K180	K180-W183 PolarHBondContact O-N 3.48Å
184	D	62.6	Low	58.3	Low	143 Å²	143	147.2 Å²	147.2	77%	0.765	71%	0.71	S	S	*	*			trans	-106.5	20.9	-179	-68.5	-20.7	0	0	0	113.2
185	S	64.5	Low	58.8	Low	166 Å²	166	155.7 Å²	155.7	100%	1.161	74%	0.735	S	S	*	*			trans	-120.2	0	167.2	-72.7	0	0	0	0	109.9

Retrieved 185 of 185 residues in 51.1 ms (Link to these results)

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