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Translocon-associated protein subunit gamma

TRAP proteins are part of a complex whose function is to bind calcium to the ER membrane and thereby regulate the retention of ER resident proteins.

AlphaFold DB , UniProt , Accession Q9UNL2, Species HUMAN (Homo sapiens, Human), Gene SSR3, 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	43.6	Very low	60.6	Low	231 Å²	231	102.5 Å²	102.5	100%	1.138	58%	0.578	S	S	*	*				0	99.7	0	-162.4	163.3	175	0	0	106.4
2	A	48.4	Very low	61	Low	80 Å²	80	103.8 Å²	103.8	66%	0.661	58%	0.576	S	S	*	*			trans	-59.7	132.8	179.4	0	0	0	0	0	108.6	K4	A2-K4 PolarHBondContact O-N 2.79Å
3	P	50.9	Low	61.7	Low	92 Å²	92	104.4 Å²	104.4	60%	0.597	57%	0.572	S	S	*	*			trans	-63.5	132.6	-172.3	24.8	-30.9	0	0	0	108.8	G5 S6	P3-G5 PolarHBondContact O-N 3.26Å; P3-S6 PolarHBondContact O-N 2.86Å; P3-S6 PolarHBondContact O-OG 3.17Å; P3-S6 VanDerWaalsContact O-OG 3.07Å
4	K	57.4	Low	62.4	Low	179 Å²	179	103.5 Å²	103.5	78%	0.778	57%	0.566	S	S	*	*	H	α-helix	trans	-52.2	-16.6	-178.9	-73	179.8	175.5	178.1	0	114.4	A2 S7	A2-K4 PolarHBondContact O-N 2.79Å; K4-S7 PolarHBondContact O-OG 3.16Å
5	G	57.3	Low	62.6	Low	40 Å²	40	99.6 Å²	99.6	41%	0.412	54%	0.544	S	S	.	.	H	α-helix	trans	-71.5	-36.2	171.3	0	0	0	0	0	113.9	P3 K8 Q9	P3-G5 PolarHBondContact O-N 3.26Å; G5-K8 PolarHBondContact O-N 3.25Å; G5-Q9 WeakPolarHBondContact O-CB 3.49Å; G5-Q9 PolarHBondContact O-N 3.44Å
6	S	69.2	Low	63.1	Low	44 Å²	44	99.5 Å²	99.5	31%	0.308	54%	0.542	S	S	.	.	H	α-helix	trans	-67.2	-43.7	-177.1	73	0	0	0	0	111.6	P3 K8 Q10	P3-S6 PolarHBondContact O-N 2.86Å; P3-S6 PolarHBondContact O-OG 3.17Å; P3-S6 VanDerWaalsContact O-OG 3.07Å; S6-K8 VanDerWaalsContact C-N 3.26Å; S6-K8 PolarHBondContact O-N 2.74Å; S6-Q10 WeakPolarHBondContact O-CB 3.43Å; S6-Q10 PolarHBondContact O-N 3.3Å
7	S	67.5	Low	63.5	Low	73 Å²	73	100 Å²	100	51%	0.51	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-32.1	177.5	58.6	0	0	0	0	112.5	K4 S11	K4-S7 PolarHBondContact O-OG 3.16Å; S7-S11 WeakPolarHBondContact O-CB 3.28Å; S7-S11 PolarHBondContact O-N 3.39Å
8	K	62.6	Low	63.6	Low	88 Å²	88	100.5 Å²	100.5	38%	0.383	54%	0.542	S	S	.	.	H	α-helix	trans	-78.4	-45.3	-179.9	-166.5	166.9	-175.6	159.9	0	111.7	G5 S6 Q10 S11 E12 E119	G5-K8 PolarHBondContact O-N 3.25Å; S6-K8 VanDerWaalsContact C-N 3.26Å; S6-K8 PolarHBondContact O-N 2.74Å; K8-Q10 VanDerWaalsContact C-N 3.28Å; K8-Q10 PolarHBondContact O-N 2.94Å; K8-S11 PolarHBondContact O-N 3.46Å; K8-E12 PolarHBondContact O-N 2.94Å; K8-E119 WeakPolarHBondContact CE-OE1 3.36Å; K8-E119 IonicContact NZ-OE1 2.66Å; K8-E119 PolarHBondContact NZ-OE1 2.85Å
9	Q	69	Low	63.7	Low	118 Å²	118	98.5 Å²	98.5	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-58.4	-43.9	171.3	-78	179.6	-79.8	0	0	110.9	G5 S11 E12 E13	G5-Q9 WeakPolarHBondContact O-CB 3.49Å; G5-Q9 PolarHBondContact O-N 3.44Å; Q9-S11 VanDerWaalsContact C-N 3.31Å; Q9-S11 PolarHBondContact O-N 3.49Å; Q9-E12 PolarHBondContact O-N 3.48Å; Q9-E12 VanDerWaalsContact O-N 3.16Å; Q9-E13 WeakPolarHBondContact O-CB 3.22Å; Q9-E13 WeakPolarHBondContact O-CG 3.05Å; Q9-E13 PolarHBondContact O-N 3.46Å
10	Q	70.9	Confident	63.8	Low	109 Å²	109	101.3 Å²	101.3	51%	0.509	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-39.3	177.4	-168.2	173.4	-10.6	0	0	111.7	S6 K8 E13 D14	S6-Q10 WeakPolarHBondContact O-CB 3.43Å; S6-Q10 PolarHBondContact O-N 3.3Å; K8-Q10 VanDerWaalsContact C-N 3.28Å; K8-Q10 PolarHBondContact O-N 2.94Å; Q10-E13 PolarHBondContact O-N 2.89Å; Q10-D14 VanDerWaalsContact O-CB 3.25Å; Q10-D14 WeakPolarHBondContact O-CB 3.4Å; Q10-D14 PolarHBondContact O-N 3.06Å
11	S	69.5	Low	64	Low	73 Å²	73	98.6 Å²	98.6	51%	0.51	53%	0.528	S	S	.	.	H	α-helix	trans	-67.5	-35.3	174.4	-175.2	0	0	0	0	113.6	S7 K8 Q9 L15	S7-S11 WeakPolarHBondContact O-CB 3.28Å; S7-S11 PolarHBondContact O-N 3.39Å; K8-S11 PolarHBondContact O-N 3.46Å; Q9-S11 VanDerWaalsContact C-N 3.31Å; Q9-S11 PolarHBondContact O-N 3.49Å; S11-L15 VanDerWaalsContact O-CB 3.31Å; S11-L15 WeakPolarHBondContact O-CB 3.42Å; S11-L15 PolarHBondContact O-N 3.48Å; S11-L15 VanDerWaalsContact O-N 3.16Å
12	E	66.5	Low	64.9	Low	118 Å²	118	94.2 Å²	94.2	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-70.8	-43.9	174.9	-74.9	-178.7	119.3	0	0	110.8	K8 Q9 L15 L16	K8-E12 PolarHBondContact O-N 2.94Å; Q9-E12 PolarHBondContact O-N 3.48Å; Q9-E12 VanDerWaalsContact O-N 3.16Å; E12-L15 PolarHBondContact O-N 3.31Å; E12-L16 WeakPolarHBondContact O-CB 3.21Å; E12-L16 VanDerWaalsContact O-CG 3.25Å; E12-L16 WeakPolarHBondContact O-CG 3.34Å; E12-L16 PolarHBondContact O-N 2.97Å
13	E	70	Confident	65.6	Low	112 Å²	112	96.1 Å²	96.1	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-47.3	174.6	-73.7	177.3	-177.7	0	0	111.2	Q9 Q10 L15 L16 L17	Q9-E13 WeakPolarHBondContact O-CB 3.22Å; Q9-E13 WeakPolarHBondContact O-CG 3.05Å; Q9-E13 PolarHBondContact O-N 3.46Å; Q10-E13 PolarHBondContact O-N 2.89Å; E13-L15 VanDerWaalsContact C-N 3.27Å; E13-L15 PolarHBondContact O-N 3.48Å; E13-L16 PolarHBondContact O-N 3.03Å; E13-L17 VanDerWaalsContact O-CB 3.23Å; E13-L17 WeakPolarHBondContact O-CB 3.2Å; E13-L17 WeakPolarHBondContact O-CG 3.49Å; E13-L17 PolarHBondContact O-N 2.98Å
14	D	70.6	Confident	66	Low	92 Å²	92	93.4 Å²	93.4	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-37.7	177.3	-75.3	-25.5	0	0	0	111.9	Q10 Q18	Q10-D14 VanDerWaalsContact O-CB 3.25Å; Q10-D14 WeakPolarHBondContact O-CB 3.4Å; Q10-D14 PolarHBondContact O-N 3.06Å; D14-Q18 VanDerWaalsContact O-CB 3.3Å; D14-Q18 WeakPolarHBondContact O-CB 3.32Å; D14-Q18 PolarHBondContact O-N 3Å
15	L	66.1	Low	66.7	Low	45 Å²	45	87.7 Å²	87.7	24%	0.236	46%	0.46	C	S	.	.	H	α-helix	trans	-72.5	-40.5	178.4	-169.6	135.6	0	0	0	111.9	S11 E12 E13 Q18 D19 L122	S11-L15 VanDerWaalsContact O-CB 3.31Å; S11-L15 WeakPolarHBondContact O-CB 3.42Å; S11-L15 PolarHBondContact O-N 3.48Å; S11-L15 VanDerWaalsContact O-N 3.16Å; E12-L15 PolarHBondContact O-N 3.31Å; E13-L15 VanDerWaalsContact C-N 3.27Å; E13-L15 PolarHBondContact O-N 3.48Å; L15-Q18 PolarHBondContact O-N 2.84Å; L15-D19 PolarHBondContact O-N 3.42Å; L15-L122 HydrophobicContact CD2-CD2 3.85Å; L15-L122 HydrophobicContact CD2-CG 4.41Å
16	L	70.2	Confident	67.6	Low	98 Å²	98	89.7 Å²	89.7	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-63.8	-44.6	172.1	-69.4	171.8	0	0	0	110.9	E12 E13 Q18 D19 F20	E12-L16 WeakPolarHBondContact O-CB 3.21Å; E12-L16 VanDerWaalsContact O-CG 3.25Å; E12-L16 WeakPolarHBondContact O-CG 3.34Å; E12-L16 PolarHBondContact O-N 2.97Å; E13-L16 PolarHBondContact O-N 3.03Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.07Å; L16-D19 PolarHBondContact O-N 3.34Å; L16-D19 VanDerWaalsContact O-N 3.16Å; L16-F20 WeakPolarHBondContact O-CD2 3.28Å; L16-F20 PolarHBondContact O-N 3.34Å
17	L	70.3	Confident	68.1	Low	108 Å²	108	95.7 Å²	95.7	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-61.7	-38.4	176	-73.3	171.1	0	0	0	111.2	E13 D19 F20 S21	E13-L17 VanDerWaalsContact O-CB 3.23Å; E13-L17 WeakPolarHBondContact O-CB 3.2Å; E13-L17 WeakPolarHBondContact O-CG 3.49Å; E13-L17 PolarHBondContact O-N 2.98Å; L17-D19 VanDerWaalsContact C-N 3.35Å; L17-F20 CarbonylContact O-C 3.59Å; L17-F20 PolarHBondContact O-N 3.24Å; L17-S21 WeakPolarHBondContact O-CA 3.36Å; L17-S21 WeakPolarHBondContact O-CB 3.3Å; L17-S21 PolarHBondContact O-N 2.91Å
18	Q	65.6	Low	68.7	Low	109 Å²	109	92.4 Å²	92.4	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-65.2	-38.4	174.9	-172.4	-179.6	17.3	0	0	111.9	D14 L15 L16 S21	D14-Q18 VanDerWaalsContact O-CB 3.3Å; D14-Q18 WeakPolarHBondContact O-CB 3.32Å; D14-Q18 PolarHBondContact O-N 3Å; L15-Q18 PolarHBondContact O-N 2.84Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.07Å; Q18-S21 PolarHBondContact O-N 2.94Å
19	D	64.9	Low	69.6	Low	62 Å²	62	90.2 Å²	90.2	33%	0.332	47%	0.466	S	S	.	.	H	α-helix	trans	-68.6	-33.3	175.8	-95.3	0.9	0	0	0	112.7	L15 L16 L17 K85	L15-D19 PolarHBondContact O-N 3.42Å; L16-D19 PolarHBondContact O-N 3.34Å; L16-D19 VanDerWaalsContact O-N 3.16Å; L17-D19 VanDerWaalsContact C-N 3.35Å; D19-K85 IonicContact OD1-NZ 3.08Å; D19-K85 PolarHBondContact OD1-NZ 2.83Å
20	F	65.8	Low	70.5	Confident	154 Å²	154	87.9 Å²	87.9	68%	0.675	47%	0.467	S	S	*	.	H	α-helix	trans	-81.9	-23	172.9	-73.7	-65.4	0	0	0	113.8	L16 L17 R22 F82	L16-F20 WeakPolarHBondContact O-CD2 3.28Å; L16-F20 PolarHBondContact O-N 3.34Å; L17-F20 CarbonylContact O-C 3.59Å; L17-F20 PolarHBondContact O-N 3.24Å; F20-R22 PolarHBondContact O-N 3.47Å; F20-F82 WeakPolarHBondContact O-CE2 3.36Å
21	S	67.2	Low	71.4	Confident	46 Å²	46	87.1 Å²	87.1	32%	0.322	47%	0.466	S	S	.	.			trans	-72.1	130.2	179.8	-172	0	0	0	0	110.3	L17 Q18 N23	L17-S21 WeakPolarHBondContact O-CA 3.36Å; L17-S21 WeakPolarHBondContact O-CB 3.3Å; L17-S21 PolarHBondContact O-N 2.91Å; Q18-S21 PolarHBondContact O-N 2.94Å; S21-N23 PolarHBondContact O-N 3.18Å; S21-N23 VanDerWaalsContact O-N 3.12Å; S21-N23 WeakPolarHBondContact OG-CB 3.32Å; S21-N23 PolarHBondContact OG-N 3.22Å
22	R	62.6	Low	72.5	Confident	138 Å²	138	83.7 Å²	83.7	52%	0.521	44%	0.442	S	S	.	.			trans	-67.2	-4.2	168.7	-76.8	177.8	154.1	-178.6	-7.1	112.6	F20 L24 K78 F82	F20-R22 PolarHBondContact O-N 3.47Å; R22-L24 PolarHBondContact O-N 3.29Å; R22-L24 VanDerWaalsContact O-N 3.12Å; R22-K78 WeakPolarHBondContact O-CE 3.22Å; R22-F82 HydrophobicContact CB-CD2 4.44Å; R22-F82 HydrophobicContact CG-CD1 4.31Å; R22-F82 HydrophobicContact CG-CD2 3.72Å; R22-F82 HydrophobicContact CG-CE1 4.36Å; R22-F82 HydrophobicContact CG-CE2 3.78Å; R22-F82 HydrophobicContact CG-CG 3.99Å; R22-F82 HydrophobicContact CG-CZ 4.1Å
23	N	63.3	Low	73.7	Confident	121 Å²	121	82.8 Å²	82.8	65%	0.647	44%	0.436	S	S	*	.			trans	-69.9	111.1	180	-72.7	-17.6	0	0	0	110.1	S21	S21-N23 PolarHBondContact O-N 3.18Å; S21-N23 VanDerWaalsContact O-N 3.12Å; S21-N23 WeakPolarHBondContact OG-CB 3.32Å; S21-N23 PolarHBondContact OG-N 3.22Å
24	L	60.6	Low	74.8	Confident	35 Å²	35	79.2 Å²	79.2	18%	0.183	43%	0.429	C	S	.	.			trans	-68.1	144.5	172	-64.4	172.6	0	0	0	109.4	R22 A26 F32 K78 K81	R22-L24 PolarHBondContact O-N 3.29Å; R22-L24 VanDerWaalsContact O-N 3.12Å; L24-A26 PolarHBondContact O-N 3.11Å; L24-F32 HydrophobicContact CD1-CD2 3.32Å; L24-F32 HydrophobicContact CD1-CE2 3.4Å; L24-F32 VanDerWaalsContact CD1-CE2 3.4Å; L24-F32 HydrophobicContact CD2-CE2 3.89Å; L24-F32 HydrophobicContact CG-CE2 4.3Å; L24-K78 HydrophobicContact CD1-CB 3.79Å; L24-K78 HydrophobicContact CD1-CD 3.96Å; L24-K78 HydrophobicContact CD1-CG 3.63Å; L24-K78 HydrophobicContact CD2-CG 4.42Å; L24-K78 HydrophobicContact CG-CD 4.28Å; L24-K78 HydrophobicContact CG-CG 3.9Å; L24-K81 HydrophobicContact CD2-CD 3.6Å; L24-K81 HydrophobicContact CD2-CG 4.23Å
25	S	72.2	Confident	75.9	Confident	58 Å²	58	77.6 Å²	77.6	41%	0.406	42%	0.42	S	S	.	.			trans	-53.4	141.2	163.2	177.3	0	0	0	0	109.8	K27 S28 S29	S25-K27 PolarHBondContact O-N 3Å; S25-S28 PolarHBondContact O-N 3.07Å; S25-S29 PolarHBondContact O-N 2.62Å
26	A	74.7	Confident	77.3	Confident	82 Å²	82	75.4 Å²	75.4	68%	0.678	41%	0.409	S	S	*	.	H	α-helix	trans	-51.6	-35.3	178.9	0	0	0	0	0	112.1	L24 S29 A30	L24-A26 PolarHBondContact O-N 3.11Å; A26-S29 PolarHBondContact O-N 3.29Å; A26-A30 WeakPolarHBondContact O-CB 3.44Å; A26-A30 PolarHBondContact O-N 2.85Å
27	K	79.3	Confident	78.4	Confident	170 Å²	170	76 Å²	76	74%	0.739	41%	0.408	S	S	*	.	H	α-helix	trans	-61	-48.4	174.2	-66	-176.3	-179.9	-179.4	0	112.2	S25 A30 L31	S25-K27 PolarHBondContact O-N 3Å; K27-A30 PolarHBondContact O-N 3.47Å; K27-L31 WeakPolarHBondContact O-CG 3.28Å; K27-L31 PolarHBondContact O-N 2.71Å
28	S	80.4	Confident	79.5	Confident	5 Å²	5	76 Å²	76	4%	0.035	41%	0.407	C	S	.	.	H	α-helix	trans	-67.5	-38.6	178.7	-49.5	0	0	0	0	111.7	S25 L31 F32 K81	S25-S28 PolarHBondContact O-N 3.07Å; S28-L31 PolarHBondContact O-N 2.88Å; S28-F32 WeakPolarHBondContact O-CB 3.29Å; S28-F32 WeakPolarHBondContact O-CD1 3.17Å; S28-F32 WeakPolarHBondContact O-CG 3.32Å; S28-F32 PolarHBondContact O-N 3.44Å; S28-K81 PolarHBondContact OG-NZ 2.83Å
29	S	81.9	Confident	80.9	Confident	42 Å²	42	71.1 Å²	71.1	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-63.1	-44.6	176.9	-165.3	0	0	0	0	111.4	S25 A26 F32 F33	S25-S29 PolarHBondContact O-N 2.62Å; A26-S29 PolarHBondContact O-N 3.29Å; S29-F32 PolarHBondContact O-N 3.42Å; S29-F33 WeakPolarHBondContact O-CD2 3.47Å; S29-F33 PolarHBondContact O-N 3.42Å
30	A	88.4	Confident	82.2	Confident	68 Å²	68	68.1 Å²	68.1	56%	0.562	37%	0.369	S	S	*	.	H	α-helix	trans	-61.9	-44	176	0	0	0	0	0	111.9	A26 K27 F32 F33 G34	A26-A30 WeakPolarHBondContact O-CB 3.44Å; A26-A30 PolarHBondContact O-N 2.85Å; K27-A30 PolarHBondContact O-N 3.47Å; A30-F32 VanDerWaalsContact C-N 3.28Å; A30-F32 PolarHBondContact O-N 3Å; A30-F33 PolarHBondContact O-N 3.37Å; A30-G34 PolarHBondContact O-N 3.13Å
31	L	90.4	Very high	83.5	Confident	94 Å²	94	62.5 Å²	62.5	49%	0.492	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-39.4	174.5	-74.8	173.4	0	0	0	112	K27 S28 N35	K27-L31 WeakPolarHBondContact O-CG 3.28Å; K27-L31 PolarHBondContact O-N 2.71Å; S28-L31 PolarHBondContact O-N 2.88Å; L31-N35 WeakPolarHBondContact O-CB 3.46Å; L31-N35 PolarHBondContact O-N 3.5Å; L31-N35 PolarHBondContact O-ND2 2.97Å
32	F	92.2	Very high	84.7	Confident	1 Å²	1	64 Å²	64	0%	0.004	35%	0.354	C	S	.	.	H	α-helix	trans	-67.1	-51.2	178.5	-73.9	-5.3	0	0	0	112.6	L24 S28 S29 A30 G34 N35 A36 Y77 K81 T134 I138	L24-F32 HydrophobicContact CD1-CD2 3.32Å; L24-F32 HydrophobicContact CD1-CE2 3.4Å; L24-F32 VanDerWaalsContact CD1-CE2 3.4Å; L24-F32 HydrophobicContact CD2-CE2 3.89Å; L24-F32 HydrophobicContact CG-CE2 4.3Å; S28-F32 WeakPolarHBondContact O-CB 3.29Å; S28-F32 WeakPolarHBondContact O-CD1 3.17Å; S28-F32 WeakPolarHBondContact O-CG 3.32Å; S28-F32 PolarHBondContact O-N 3.44Å; S29-F32 PolarHBondContact O-N 3.42Å; A30-F32 VanDerWaalsContact C-N 3.28Å; A30-F32 PolarHBondContact O-N 3Å; F32-G34 PolarHBondContact O-N 2.87Å; F32-N35 PolarHBondContact O-N 2.84Å; F32-A36 WeakPolarHBondContact O-CB 3.44Å; F32-A36 PolarHBondContact O-N 3.02Å; F32-Y77 HydrophobicContact CB-CD2 3.76Å; F32-Y77 AromaticContact CD1-CD2 3.85Å; F32-Y77 HydrophobicContact CD1-CD2 3.85Å; F32-Y77 HydrophobicContact CD1-CG 4.35Å; F32-Y77 AromaticContact CG-CD2 3.82Å; F32-Y77 HydrophobicContact CG-CD2 3.82Å; F32-Y77 HydrophobicContact CG-CG 4.36Å; F32-Y77 WeakPolarHBondContact O-CE2 3.4Å; F32-K81 HydrophobicContact CE2-CB 4.19Å; F32-K81 HydrophobicContact CE2-CD 3.85Å; F32-K81 HydrophobicContact CZ-CB 3.91Å; F32-K81 HydrophobicContact CZ-CD 3.45Å; F32-K81 VanDerWaalsContact CZ-CD 3.45Å; F32-K81 HydrophobicContact CZ-CG 4.27Å; F32-T134 HydrophobicContact CD1-CG2 4.42Å; F32-T134 HydrophobicContact CE1-CG2 3.56Å; F32-T134 HydrophobicContact CZ-CG2 4.15Å; F32-I138 HydrophobicContact CD1-CD1 3.98Å; F32-I138 HydrophobicContact CD1-CG1 3.87Å; F32-I138 HydrophobicContact CE1-CD1 3.97Å; F32-I138 HydrophobicContact CE1-CG1 3.79Å
33	F	91.7	Very high	86.1	Confident	99 Å²	99	57.5 Å²	57.5	43%	0.434	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-40.1	178.1	-84.5	-81.1	0	0	0	112.4	S29 A30 A36 F37 T70 A74	S29-F33 WeakPolarHBondContact O-CD2 3.47Å; S29-F33 PolarHBondContact O-N 3.42Å; A30-F33 PolarHBondContact O-N 3.37Å; F33-A36 PolarHBondContact O-N 3.43Å; F33-F37 WeakPolarHBondContact O-CB 3.22Å; F33-F37 PolarHBondContact O-N 2.91Å; F33-T70 HydrophobicContact CD1-CG2 4.22Å; F33-A74 HydrophobicContact CD1-CB 4.07Å; F33-A74 HydrophobicContact CD2-CB 4.43Å; F33-A74 HydrophobicContact CE1-CB 4Å; F33-A74 HydrophobicContact CE2-CB 4.37Å; F33-A74 HydrophobicContact CG-CB 4.29Å; F33-A74 HydrophobicContact CZ-CB 4.15Å
34	G	93.3	Very high	87.5	Confident	36 Å²	36	53.4 Å²	53.4	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-48.1	177.2	0	0	0	0	0	112.7	A30 F32 F37 I38	A30-G34 PolarHBondContact O-N 3.13Å; F32-G34 PolarHBondContact O-N 2.87Å; G34-F37 PolarHBondContact O-N 2.79Å; G34-I38 WeakPolarHBondContact O-CG1 3.39Å; G34-I38 PolarHBondContact O-N 3.13Å
35	N	93.3	Very high	89	Confident	58 Å²	58	59.7 Å²	59.7	31%	0.31	33%	0.329	S	S	.	.	H	α-helix	trans	-68.1	-39.9	177.3	-81.3	-89.2	0	0	0	112.2	L31 F32 F37 I38 V39 Y77 I138	L31-N35 WeakPolarHBondContact O-CB 3.46Å; L31-N35 PolarHBondContact O-N 3.5Å; L31-N35 PolarHBondContact O-ND2 2.97Å; F32-N35 PolarHBondContact O-N 2.84Å; N35-F37 VanDerWaalsContact C-N 3.29Å; N35-F37 PolarHBondContact O-N 2.73Å; N35-I38 PolarHBondContact O-N 2.97Å; N35-V39 PolarHBondContact O-N 3.38Å; N35-Y77 HydrophobicContact CB-CE2 4.29Å; N35-I138 HydrophobicContact CB-CG2 4.17Å
36	A	94.5	Very high	89.8	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-40.1	177.5	0	0	0	0	0	111.2	F32 F33 V39 S40 T70 V73 A74 Y77	F32-A36 WeakPolarHBondContact O-CB 3.44Å; F32-A36 PolarHBondContact O-N 3.02Å; F33-A36 PolarHBondContact O-N 3.43Å; A36-V39 VanDerWaalsContact O-CG1 3.25Å; A36-V39 WeakPolarHBondContact O-CG1 3.22Å; A36-S40 WeakPolarHBondContact O-CB 3.23Å; A36-S40 PolarHBondContact O-N 3.38Å; A36-S40 PolarHBondContact O-OG 2.96Å; A36-T70 HydrophobicContact CB-CG2 3.91Å; A36-V73 HydrophobicContact CB-CB 4.07Å; A36-V73 HydrophobicContact CB-CG1 3.83Å; A36-A74 HydrophobicContact CB-CB 3.99Å; A36-Y77 HydrophobicContact CB-CE2 3.84Å
37	F	94.1	Very high	90.6	Very high	109 Å²	109	54 Å²	54	48%	0.478	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-45.8	177.9	-176.9	-102.8	0	0	0	112.2	F33 G34 N35 V39 S40 A41 T66 T70	F33-F37 WeakPolarHBondContact O-CB 3.22Å; F33-F37 PolarHBondContact O-N 2.91Å; G34-F37 PolarHBondContact O-N 2.79Å; N35-F37 VanDerWaalsContact C-N 3.29Å; N35-F37 PolarHBondContact O-N 2.73Å; F37-V39 PolarHBondContact O-N 2.96Å; F37-S40 PolarHBondContact O-N 2.94Å; F37-A41 PolarHBondContact O-N 3.29Å; F37-T66 HydrophobicContact CD2-CG2 4Å; F37-T66 HydrophobicContact CE2-CG2 3.76Å; F37-T70 WeakPolarHBondContact CA-OG1 3.04Å; F37-T70 HydrophobicContact CB-CG2 4.05Å
38	I	94	Very high	91.1	Very high	110 Å²	110	51.9 Å²	51.9	56%	0.564	27%	0.27	S	S	*	.	H	α-helix	trans	-60.6	-48.8	178.4	-66.3	165.2	0	0	0	110.2	G34 N35 S40 A41 I42	G34-I38 WeakPolarHBondContact O-CG1 3.39Å; G34-I38 PolarHBondContact O-N 3.13Å; N35-I38 PolarHBondContact O-N 2.97Å; I38-S40 VanDerWaalsContact C-N 3.32Å; I38-S40 PolarHBondContact O-N 3.06Å; I38-A41 PolarHBondContact O-N 3.34Å; I38-I42 PolarHBondContact O-N 3.33Å
39	V	94.1	Very high	91.6	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-35.4	-179.3	75.3	0	0	0	0	111.9	N35 A36 F37 A41 I42 P43 V73 N142 F145 L146	N35-V39 PolarHBondContact O-N 3.38Å; A36-V39 VanDerWaalsContact O-CG1 3.25Å; A36-V39 WeakPolarHBondContact O-CG1 3.22Å; F37-V39 PolarHBondContact O-N 2.96Å; V39-A41 VanDerWaalsContact C-N 3.26Å; V39-A41 PolarHBondContact O-N 3.5Å; V39-I42 HydrophobicContact CG2-CD1 4.31Å; V39-I42 PolarHBondContact O-N 3.04Å; V39-P43 WeakPolarHBondContact O-CD 3.38Å; V39-V73 HydrophobicContact CG1-CG1 4.05Å; V39-N142 WeakPolarHBondContact CG1-OD1 3.43Å; V39-N142 HydrophobicContact CG2-CB 4.29Å; V39-F145 HydrophobicContact CG2-CD1 3.91Å; V39-F145 HydrophobicContact CG2-CE1 4.36Å; V39-L146 HydrophobicContact CG2-CD1 4.21Å; V39-L146 HydrophobicContact CG2-CD2 4.02Å; V39-L146 HydrophobicContact CG2-CG 3.98Å
40	S	93	Very high	92	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-70.3	-19.8	175.9	-79.9	0	0	0	0	113.9	A36 F37 I38 T66 S69 T70	A36-S40 WeakPolarHBondContact O-CB 3.23Å; A36-S40 PolarHBondContact O-N 3.38Å; A36-S40 PolarHBondContact O-OG 2.96Å; F37-S40 PolarHBondContact O-N 2.94Å; I38-S40 VanDerWaalsContact C-N 3.32Å; I38-S40 PolarHBondContact O-N 3.06Å; S40-T66 PolarHBondContact O-OG1 3.49Å; S40-S69 VanDerWaalsContact CB-OG 3.26Å; S40-S69 WeakPolarHBondContact CB-OG 3.28Å; S40-S69 WeakPolarHBondContact OG-CB 3.43Å; S40-S69 PolarHBondContact OG-OG 3.47Å; S40-T70 WeakPolarHBondContact CB-OG1 3.5Å; S40-T70 PolarHBondContact OG-N 3.24Å
41	A	93	Very high	92	Very high	35 Å²	35	60.2 Å²	60.2	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-84.1	-25.6	174.3	0	0	0	0	0	112.9	F37 I38 V39 I44	F37-A41 PolarHBondContact O-N 3.29Å; I38-A41 PolarHBondContact O-N 3.34Å; V39-A41 VanDerWaalsContact C-N 3.26Å; V39-A41 PolarHBondContact O-N 3.5Å; A41-I44 HydrophobicContact CB-CD1 4.48Å; A41-I44 VanDerWaalsContact O-CB 3.28Å; A41-I44 WeakPolarHBondContact O-CB 3.33Å; A41-I44 PolarHBondContact O-N 3.33Å
42	I	92.9	Very high	91.8	Very high	78 Å²	78	63 Å²	63	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-54.1	-45.3	-179.3	-65.8	170.3	0	0	0	112.4	I38 V39 I44 W45 L46 L146	I38-I42 PolarHBondContact O-N 3.33Å; V39-I42 HydrophobicContact CG2-CD1 4.31Å; V39-I42 PolarHBondContact O-N 3.04Å; I42-I44 PolarHBondContact O-N 3.4Å; I42-W45 WeakPolarHBondContact O-CB 3.31Å; I42-W45 PolarHBondContact O-N 3Å; I42-W45 VanDerWaalsContact O-N 3.13Å; I42-L46 PolarHBondContact O-N 2.92Å; I42-L146 HydrophobicContact CB-CD2 4.38Å; I42-L146 HydrophobicContact CD1-CD2 4.41Å; I42-L146 HydrophobicContact CG2-CD2 4.13Å
43	P	92.1	Very high	91.5	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-28	178	-25.7	36.1	0	0	0	113.8	V39 W45 L46 Y47 F145 V149 Y166 I170	V39-P43 WeakPolarHBondContact O-CD 3.38Å; P43-W45 PolarHBondContact O-N 2.99Å; P43-L46 VanDerWaalsContact O-CB 3.31Å; P43-L46 WeakPolarHBondContact O-CB 3.19Å; P43-L46 PolarHBondContact O-N 3.42Å; P43-Y47 VanDerWaalsContact O-CD2 3.26Å; P43-Y47 WeakPolarHBondContact O-CD2 3.46Å; P43-Y47 PolarHBondContact O-N 3.33Å; P43-F145 HydrophobicContact CG-CE1 3.98Å; P43-F145 HydrophobicContact CG-CZ 4.25Å; P43-V149 HydrophobicContact CB-CG1 4.2Å; P43-V149 HydrophobicContact CG-CG1 4.12Å; P43-Y166 HydrophobicContact CB-CE2 4.3Å; P43-I170 HydrophobicContact CB-CD1 3.45Å; P43-I170 VanDerWaalsContact CB-CD1 3.45Å; P43-I170 HydrophobicContact CG-CD1 3.56Å
44	I	92.3	Very high	91.3	Very high	36 Å²	36	62.2 Å²	62.2	19%	0.185	30%	0.295	C	S	.	.	H	α-helix	trans	-56	-45.3	175.7	-58.3	173.6	0	0	0	109.6	A41 I42 L46 Y47 W48 L55 Y62 T66	A41-I44 HydrophobicContact CB-CD1 4.48Å; A41-I44 VanDerWaalsContact O-CB 3.28Å; A41-I44 WeakPolarHBondContact O-CB 3.33Å; A41-I44 PolarHBondContact O-N 3.33Å; I42-I44 PolarHBondContact O-N 3.4Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.18Å; I44-Y47 PolarHBondContact O-N 3.45Å; I44-W48 WeakPolarHBondContact O-CB 3.19Å; I44-W48 PolarHBondContact O-N 3.24Å; I44-L55 HydrophobicContact CG2-CD1 4.32Å; I44-Y62 HydrophobicContact CB-CD1 4.41Å; I44-Y62 HydrophobicContact CG1-CD1 3.96Å; I44-Y62 HydrophobicContact CG1-CG 4.29Å; I44-Y62 HydrophobicContact CG2-CD1 4.06Å; I44-Y62 HydrophobicContact CG2-CD2 4.21Å; I44-Y62 HydrophobicContact CG2-CE1 4.21Å; I44-Y62 HydrophobicContact CG2-CE2 4.36Å; I44-Y62 HydrophobicContact CG2-CG 4.06Å; I44-T66 WeakPolarHBondContact CD1-OG1 3.14Å
45	W	91.2	Very high	91	Very high	166 Å²	166	64.2 Å²	64.2	63%	0.629	30%	0.297	S	S	*	.	H	α-helix	trans	-62	-40.7	177.6	-178.3	81.1	0	0	0	112.2	I42 P43 Y47 W48 R49	I42-W45 WeakPolarHBondContact O-CB 3.31Å; I42-W45 PolarHBondContact O-N 3Å; I42-W45 VanDerWaalsContact O-N 3.13Å; P43-W45 PolarHBondContact O-N 2.99Å; W45-Y47 PolarHBondContact O-N 3.44Å; W45-W48 PolarHBondContact O-N 3.5Å; W45-R49 WeakPolarHBondContact O-CB 3.26Å; W45-R49 PolarHBondContact O-N 3.1Å
46	L	90.2	Very high	90.7	Very high	22 Å²	22	68.4 Å²	68.4	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-59.1	-47.8	177.5	-165.9	154	0	0	0	111.3	I42 P43 I44 I50 I150 F154	I42-L46 PolarHBondContact O-N 2.92Å; P43-L46 VanDerWaalsContact O-CB 3.31Å; P43-L46 WeakPolarHBondContact O-CB 3.19Å; P43-L46 PolarHBondContact O-N 3.42Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.18Å; L46-I50 HydrophobicContact CD2-CD1 4.27Å; L46-I50 HydrophobicContact CG-CD1 4.05Å; L46-I50 VanDerWaalsContact O-CB 3.26Å; L46-I50 WeakPolarHBondContact O-CB 3.34Å; L46-I50 PolarHBondContact O-N 3.16Å; L46-I150 HydrophobicContact CD1-CG1 4.3Å; L46-F154 HydrophobicContact CD1-CE2 3.85Å; L46-F154 HydrophobicContact CD1-CZ 4.29Å; L46-F154 HydrophobicContact CD2-CE2 3.78Å; L46-F154 HydrophobicContact CD2-CZ 3.81Å; L46-F154 HydrophobicContact CG-CE2 4.19Å; L46-F154 HydrophobicContact CG-CZ 4.19Å
47	Y	91	Very high	90.4	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-76.5	-31.3	-178	-79.3	-98.9	0	0	0	113.6	P43 I44 W45 W51 H52 M53 S153 N165 Y166 S169	P43-Y47 VanDerWaalsContact O-CD2 3.26Å; P43-Y47 WeakPolarHBondContact O-CD2 3.46Å; P43-Y47 PolarHBondContact O-N 3.33Å; I44-Y47 PolarHBondContact O-N 3.45Å; W45-Y47 PolarHBondContact O-N 3.44Å; Y47-W51 HydrophobicContact CD1-CB 4.03Å; Y47-W51 AromaticContact CD1-CD1 3.44Å; Y47-W51 VanDerWaalsContact CD1-CD1 3.44Å; Y47-W51 AromaticContact CD1-CG 3.85Å; Y47-W51 HydrophobicContact CD1-CG 3.85Å; Y47-W51 AromaticContact CE1-CD1 3.65Å; Y47-W51 HydrophobicContact CE1-CG 4.23Å; Y47-W51 AromaticContact CG-CD1 3.94Å; Y47-W51 CarbonylContact O-C 3.44Å; Y47-W51 WeakPolarHBondContact O-CB 3.32Å; Y47-W51 PolarHBondContact O-N 2.95Å; Y47-H52 PolarHBondContact O-N 2.83Å; Y47-M53 PolarHBondContact O-N 3.23Å; Y47-S153 PolarHBondContact OH-OG 3.45Å; Y47-N165 HydrophobicContact CE1-CB 4.14Å; Y47-N165 VanDerWaalsContact CE1-OD1 3.29Å; Y47-N165 WeakPolarHBondContact CE1-OD1 3.42Å; Y47-N165 VanDerWaalsContact CZ-OD1 3.27Å; Y47-N165 PolarHBondContact OH-O 3.33Å; Y47-N165 VanDerWaalsContact OH-O 3.13Å; Y47-N165 PolarHBondContact OH-OD1 2.82Å; Y47-Y166 HydrophobicContact CD1-CD2 4.09Å; Y47-Y166 HydrophobicContact CD1-CG 4.39Å; Y47-Y166 AromaticContact CD2-CD2 3.49Å; Y47-Y166 HydrophobicContact CD2-CD2 3.49Å; Y47-Y166 VanDerWaalsContact CD2-CD2 3.49Å; Y47-Y166 HydrophobicContact CD2-CE2 4.18Å; Y47-Y166 VanDerWaalsContact CE1-CA 3.46Å; Y47-Y166 HydrophobicContact CE1-CD2 4.24Å; Y47-Y166 HydrophobicContact CE1-CG 4.44Å; Y47-Y166 AromaticContact CE2-CD2 3.63Å; Y47-Y166 HydrophobicContact CE2-CD2 3.63Å; Y47-Y166 HydrophobicContact CE2-CE2 4.45Å; Y47-Y166 AromaticContact CG-CD2 3.67Å; Y47-Y166 HydrophobicContact CG-CD2 3.67Å; Y47-Y166 HydrophobicContact CG-CG 4.38Å; Y47-Y166 VanDerWaalsContact CZ-CA 3.47Å; Y47-Y166 AromaticContact CZ-CD2 3.99Å; Y47-Y166 WeakPolarHBondContact OH-CA 3.15Å; Y47-S169 WeakPolarHBondContact OH-CB 3.49Å; Y47-S169 PolarHBondContact OH-OG 2.6Å; Y47-S169 VanDerWaalsContact OH-OG 3.1Å
48	W	90	Very high	90.2	Very high	125 Å²	125	71.9 Å²	71.9	47%	0.473	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-46.4	171.6	-180	57.4	0	0	0	111.6	I44 W45 H52 L55	I44-W48 WeakPolarHBondContact O-CB 3.19Å; I44-W48 PolarHBondContact O-N 3.24Å; W45-W48 PolarHBondContact O-N 3.5Å; W48-H52 WeakPolarHBondContact O-CA 3.33Å; W48-L55 HydrophobicContact CB-CD1 3.72Å; W48-L55 VanDerWaalsContact CD1-CD1 3.43Å; W48-L55 HydrophobicContact CD2-CD1 3.87Å; W48-L55 HydrophobicContact CG-CD1 3.37Å
49	R	91.3	Very high	90	Very high	157 Å²	157	68.6 Å²	68.6	59%	0.592	33%	0.327	S	S	*	.	H	α-helix	trans	-81.6	-37	-172.4	-170.4	57	177.8	157.2	1.7	114	W45	W45-R49 WeakPolarHBondContact O-CB 3.26Å; W45-R49 PolarHBondContact O-N 3.1Å
50	I	89	Confident	89.9	Confident	79 Å²	79	73.7 Å²	73.7	41%	0.405	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-47.1	-170.6	-59.4	175.6	0	0	0	111.3	L46 H52 F154	L46-I50 HydrophobicContact CD2-CD1 4.27Å; L46-I50 HydrophobicContact CG-CD1 4.05Å; L46-I50 VanDerWaalsContact O-CB 3.26Å; L46-I50 WeakPolarHBondContact O-CB 3.34Å; L46-I50 PolarHBondContact O-N 3.16Å; I50-H52 VanDerWaalsContact C-N 3.28Å; I50-F154 HydrophobicContact CD1-CE1 3.9Å; I50-F154 HydrophobicContact CD1-CZ 3.45Å; I50-F154 VanDerWaalsContact CD1-CZ 3.45Å; I50-F154 HydrophobicContact CG2-CE1 3.8Å; I50-F154 HydrophobicContact CG2-CZ 4.29Å
51	W	88	Confident	89.9	Confident	54 Å²	54	75.6 Å²	75.6	21%	0.205	37%	0.368	C	S	.	.	S	Bend	trans	-87.3	1.1	179.7	-68.2	103.3	0	0	0	113.3	Y47 M53 S153 K158 P162	Y47-W51 HydrophobicContact CD1-CB 4.03Å; Y47-W51 AromaticContact CD1-CD1 3.44Å; Y47-W51 VanDerWaalsContact CD1-CD1 3.44Å; Y47-W51 AromaticContact CD1-CG 3.85Å; Y47-W51 HydrophobicContact CD1-CG 3.85Å; Y47-W51 AromaticContact CE1-CD1 3.65Å; Y47-W51 HydrophobicContact CE1-CG 4.23Å; Y47-W51 AromaticContact CG-CD1 3.94Å; Y47-W51 CarbonylContact O-C 3.44Å; Y47-W51 WeakPolarHBondContact O-CB 3.32Å; Y47-W51 PolarHBondContact O-N 2.95Å; W51-M53 HydrophobicContact CB-CG 4.45Å; W51-M53 PolarHBondContact O-N 2.55Å; W51-M53 VanDerWaalsContact O-N 3.11Å; W51-S153 WeakPolarHBondContact CZ2-O 3.2Å; W51-K158 VanDerWaalsContact CH2-CA 3.49Å; W51-K158 HydrophobicContact CH2-CB 4.01Å; W51-K158 WeakPolarHBondContact CH2-O 3.25Å; W51-K158 HydrophobicContact CZ2-CB 4.43Å; W51-K158 VanDerWaalsContact CZ3-O 3.32Å; W51-K158 WeakPolarHBondContact CZ3-O 3.26Å; W51-P162 HydrophobicContact CB-CB 4.07Å; W51-P162 HydrophobicContact CB-CG 4.4Å; W51-P162 HydrophobicContact CE3-CG 4.18Å
52	H	86.8	Confident	89.8	Confident	153 Å²	153	74.3 Å²	74.3	71%	0.708	36%	0.355	S	S	*	.			trans	50.3	34.7	179.4	-65.1	-65	0	0	0	113.8	Y47 W48 I50	Y47-H52 PolarHBondContact O-N 2.83Å; W48-H52 WeakPolarHBondContact O-CA 3.33Å; I50-H52 VanDerWaalsContact C-N 3.28Å
53	M	86	Confident	89.8	Confident	12 Å²	12	73.9 Å²	73.9	6%	0.059	36%	0.359	C	S	.	.			trans	-72	132.7	175.2	-79.4	-110.9	-73.6	0	0	110.9	Y47 W51 L55 L61 Y62 P162 T163 Y166	Y47-M53 PolarHBondContact O-N 3.23Å; W51-M53 HydrophobicContact CB-CG 4.45Å; W51-M53 PolarHBondContact O-N 2.55Å; W51-M53 VanDerWaalsContact O-N 3.11Å; M53-L55 PolarHBondContact O-N 3.44Å; M53-L61 HydrophobicContact CE-CD2 4.37Å; M53-Y62 WeakPolarHBondContact CB-OH 3.31Å; M53-Y62 HydrophobicContact CE-CE1 4.09Å; M53-P162 HydrophobicContact CG-CB 3.39Å; M53-P162 HydrophobicContact SD-CB 3.6Å; M53-T163 PolarHBondContact SD-N 3.22Å; M53-T163 PolarHBondContact SD-OG1 3.44Å; M53-Y166 HydrophobicContact CE-CG 4.47Å
54	D	88.2	Confident	90	Very high	70 Å²	70	77.6 Å²	77.6	37%	0.374	38%	0.382	S	S	.	.			trans	-66.4	127.3	178.2	-171.4	-75.1	0	0	0	111.5	I56 Q57 S58	D54-I56 WeakPolarHBondContact OD1-CA 3.47Å; D54-I56 PolarHBondContact OD1-N 3.07Å; D54-Q57 HydrophobicContact CB-CB 4.1Å; D54-Q57 HydrophobicContact CB-CG 4.25Å; D54-Q57 WeakPolarHBondContact OD1-CG 3.49Å; D54-Q57 PolarHBondContact OD1-N 3.05Å; D54-S58 WeakPolarHBondContact O-CB 3.34Å; D54-S58 PolarHBondContact O-N 2.94Å; D54-S58 PolarHBondContact O-OG 2.78Å
55	L	85.5	Confident	90	Very high	79 Å²	79	76.8 Å²	76.8	41%	0.414	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-36.1	-174.1	-144.7	110.2	0	0	0	112.7	I44 W48 M53 A59	I44-L55 HydrophobicContact CG2-CD1 4.32Å; W48-L55 HydrophobicContact CB-CD1 3.72Å; W48-L55 VanDerWaalsContact CD1-CD1 3.43Å; W48-L55 HydrophobicContact CD2-CD1 3.87Å; W48-L55 HydrophobicContact CG-CD1 3.37Å; M53-L55 PolarHBondContact O-N 3.44Å; L55-A59 WeakPolarHBondContact O-CA 3.05Å; L55-A59 WeakPolarHBondContact O-CB 3.37Å; L55-A59 PolarHBondContact O-N 2.86Å
56	I	88.1	Confident	90.2	Very high	145 Å²	145	69.2 Å²	69.2	74%	0.744	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-46.8	-172.3	-62.5	167.6	0	0	0	109.4	D54 S58 A59	D54-I56 WeakPolarHBondContact OD1-CA 3.47Å; D54-I56 PolarHBondContact OD1-N 3.07Å; I56-S58 VanDerWaalsContact C-N 3.3Å; I56-S58 PolarHBondContact O-N 2.89Å; I56-A59 VanDerWaalsContact O-CB 3.28Å; I56-A59 WeakPolarHBondContact O-CB 3.19Å; I56-A59 PolarHBondContact O-N 3.23Å
57	Q	87.5	Confident	90.4	Very high	164 Å²	164	73.6 Å²	73.6	77%	0.766	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-37.3	178.2	-64.6	-178.7	-1	0	0	111.5	D54	D54-Q57 HydrophobicContact CB-CB 4.1Å; D54-Q57 HydrophobicContact CB-CG 4.25Å; D54-Q57 WeakPolarHBondContact OD1-CG 3.49Å; D54-Q57 PolarHBondContact OD1-N 3.05Å
58	S	89.6	Confident	90.6	Very high	18 Å²	18	76.9 Å²	76.9	13%	0.126	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	9.8	-179.8	-50.7	0	0	0	0	113.4	D54 I56 V60 L61 Y62	D54-S58 WeakPolarHBondContact O-CB 3.34Å; D54-S58 PolarHBondContact O-N 2.94Å; D54-S58 PolarHBondContact O-OG 2.78Å; I56-S58 VanDerWaalsContact C-N 3.3Å; I56-S58 PolarHBondContact O-N 2.89Å; S58-V60 VanDerWaalsContact C-N 3.29Å; S58-V60 PolarHBondContact O-N 2.91Å; S58-L61 WeakPolarHBondContact O-CB 3.25Å; S58-L61 PolarHBondContact O-N 3.45Å; S58-Y62 VanDerWaalsContact O-CD2 3.22Å; S58-Y62 WeakPolarHBondContact O-CD2 3.45Å; S58-Y62 PolarHBondContact O-N 3.38Å
59	A	90.3	Very high	90.8	Very high	41 Å²	41	71 Å²	71	34%	0.339	37%	0.37	S	S	.	.	H	α-helix	trans	-57.4	-40.1	-174.9	0	0	0	0	0	113.2	L55 I56 S63	L55-A59 WeakPolarHBondContact O-CA 3.05Å; L55-A59 WeakPolarHBondContact O-CB 3.37Å; L55-A59 PolarHBondContact O-N 2.86Å; I56-A59 VanDerWaalsContact O-CB 3.28Å; I56-A59 WeakPolarHBondContact O-CB 3.19Å; I56-A59 PolarHBondContact O-N 3.23Å; A59-S63 WeakPolarHBondContact O-CB 3.26Å; A59-S63 PolarHBondContact O-N 3.32Å; A59-S63 PolarHBondContact O-OG 2.89Å
60	V	92.6	Very high	91	Very high	112 Å²	112	64 Å²	64	68%	0.679	35%	0.345	S	S	*	.	H	α-helix	trans	-63.7	-45.3	177.2	179.9	0	0	0	0	110.5	S58 S63 V64	S58-V60 VanDerWaalsContact C-N 3.29Å; S58-V60 PolarHBondContact O-N 2.91Å; V60-S63 PolarHBondContact O-N 3.38Å; V60-V64 HydrophobicContact CG1-CG2 4.46Å; V60-V64 VanDerWaalsContact O-CG2 3.32Å; V60-V64 WeakPolarHBondContact O-CG2 3.34Å; V60-V64 PolarHBondContact O-N 3.45Å
61	L	91.7	Very high	91.3	Very high	41 Å²	41	67.2 Å²	67.2	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-44.1	179.9	174.3	144.1	0	0	0	111.7	M53 S58 S63 V64 M65 T163 Y166 I167	M53-L61 HydrophobicContact CE-CD2 4.37Å; S58-L61 WeakPolarHBondContact O-CB 3.25Å; S58-L61 PolarHBondContact O-N 3.45Å; L61-S63 VanDerWaalsContact C-N 3.34Å; L61-S63 PolarHBondContact O-N 2.67Å; L61-V64 PolarHBondContact O-N 2.8Å; L61-M65 HydrophobicContact CG-CG 4.5Å; L61-M65 WeakPolarHBondContact O-CB 3.43Å; L61-M65 WeakPolarHBondContact O-CG 3.22Å; L61-M65 PolarHBondContact O-N 2.8Å; L61-T163 HydrophobicContact CD1-CG2 3.56Å; L61-Y166 HydrophobicContact CD2-CD1 3.45Å; L61-Y166 VanDerWaalsContact CD2-CD1 3.45Å; L61-Y166 HydrophobicContact CD2-CE1 3.68Å; L61-Y166 HydrophobicContact CD2-CG 4.5Å; L61-I167 HydrophobicContact CD1-CD1 3.78Å; L61-I167 HydrophobicContact CD1-CG1 4Å; L61-I167 HydrophobicContact CG-CG1 4.49Å
62	Y	92.6	Very high	91.6	Very high	7 Å²	7	66.7 Å²	66.7	3%	0.027	35%	0.354	C	S	.	.	H	α-helix	trans	-58.8	-46.5	173.1	-70.2	-48.1	0	0	0	111.5	I44 M53 S58 V64 M65 T66 Y166	I44-Y62 HydrophobicContact CB-CD1 4.41Å; I44-Y62 HydrophobicContact CG1-CD1 3.96Å; I44-Y62 HydrophobicContact CG1-CG 4.29Å; I44-Y62 HydrophobicContact CG2-CD1 4.06Å; I44-Y62 HydrophobicContact CG2-CD2 4.21Å; I44-Y62 HydrophobicContact CG2-CE1 4.21Å; I44-Y62 HydrophobicContact CG2-CE2 4.36Å; I44-Y62 HydrophobicContact CG2-CG 4.06Å; M53-Y62 WeakPolarHBondContact CB-OH 3.31Å; M53-Y62 HydrophobicContact CE-CE1 4.09Å; S58-Y62 VanDerWaalsContact O-CD2 3.22Å; S58-Y62 WeakPolarHBondContact O-CD2 3.45Å; S58-Y62 PolarHBondContact O-N 3.38Å; Y62-V64 PolarHBondContact O-N 3.46Å; Y62-M65 PolarHBondContact O-N 2.63Å; Y62-T66 WeakPolarHBondContact O-CB 3.31Å; Y62-T66 PolarHBondContact O-N 2.99Å; Y62-T66 PolarHBondContact O-OG1 2.95Å; Y62-Y166 HydrophobicContact CD1-CD1 4.35Å; Y62-Y166 AromaticContact CD1-CE1 3.67Å; Y62-Y166 HydrophobicContact CD1-CE1 3.67Å; Y62-Y166 HydrophobicContact CD1-CE2 4.01Å; Y62-Y166 AromaticContact CD1-CZ 3.49Å; Y62-Y166 VanDerWaalsContact CD1-CZ 3.49Å; Y62-Y166 HydrophobicContact CE1-CD1 4.33Å; Y62-Y166 HydrophobicContact CE1-CD2 4.18Å; Y62-Y166 HydrophobicContact CE1-CE1 4.06Å; Y62-Y166 AromaticContact CE1-CE2 3.95Å; Y62-Y166 HydrophobicContact CE1-CE2 3.95Å; Y62-Y166 HydrophobicContact CE1-CG 4.36Å; Y62-Y166 AromaticContact CE1-CZ 3.89Å
63	S	93	Very high	92	Very high	69 Å²	69	59.4 Å²	59.4	48%	0.483	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-48.3	-179.9	-58.8	0	0	0	0	111.9	A59 V60 L61 T66 L67	A59-S63 WeakPolarHBondContact O-CB 3.26Å; A59-S63 PolarHBondContact O-N 3.32Å; A59-S63 PolarHBondContact O-OG 2.89Å; V60-S63 PolarHBondContact O-N 3.38Å; L61-S63 VanDerWaalsContact C-N 3.34Å; L61-S63 PolarHBondContact O-N 2.67Å; S63-T66 PolarHBondContact O-N 2.82Å; S63-L67 VanDerWaalsContact O-CG 3.28Å; S63-L67 WeakPolarHBondContact O-CG 3.4Å; S63-L67 PolarHBondContact O-N 3.49Å
64	V	94.6	Very high	92.3	Very high	79 Å²	79	59 Å²	59	48%	0.479	32%	0.319	S	S	.	.	H	α-helix	trans	-62.4	-48.5	179.4	171.6	0	0	0	0	111	V60 L61 Y62 T66 L67 V68	V60-V64 HydrophobicContact CG1-CG2 4.46Å; V60-V64 VanDerWaalsContact O-CG2 3.32Å; V60-V64 WeakPolarHBondContact O-CG2 3.34Å; V60-V64 PolarHBondContact O-N 3.45Å; L61-V64 PolarHBondContact O-N 2.8Å; Y62-V64 PolarHBondContact O-N 3.46Å; V64-T66 PolarHBondContact O-N 3.43Å; V64-L67 PolarHBondContact O-N 3.46Å; V64-V68 HydrophobicContact CG1-CG2 4.45Å; V64-V68 WeakPolarHBondContact O-CG2 3.29Å; V64-V68 PolarHBondContact O-N 3.47Å
65	M	93.8	Very high	92.5	Very high	20 Å²	20	59.2 Å²	59.2	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-68.8	-35	-177.8	-65.8	-60.7	-69	0	0	112.3	L61 Y62 S69 Y166 I167 I170 S171	L61-M65 HydrophobicContact CG-CG 4.5Å; L61-M65 WeakPolarHBondContact O-CB 3.43Å; L61-M65 WeakPolarHBondContact O-CG 3.22Å; L61-M65 PolarHBondContact O-N 2.8Å; Y62-M65 PolarHBondContact O-N 2.63Å; M65-S69 WeakPolarHBondContact O-CB 3.36Å; M65-S69 PolarHBondContact O-N 2.97Å; M65-S69 PolarHBondContact O-OG 3.45Å; M65-Y166 HydrophobicContact CB-CE1 3.57Å; M65-Y166 HydrophobicContact CG-CD1 4.3Å; M65-Y166 HydrophobicContact CG-CE1 3.75Å; M65-I167 HydrophobicContact CE-CB 4.23Å; M65-I167 HydrophobicContact CE-CG2 3.98Å; M65-I167 VanDerWaalsContact CE-O 3.31Å; M65-I167 WeakPolarHBondContact CE-O 3.22Å; M65-I167 HydrophobicContact SD-CG2 4.38Å; M65-I170 HydrophobicContact CB-CG2 4.44Å; M65-I170 HydrophobicContact CE-CB 3.92Å; M65-I170 HydrophobicContact CE-CG2 3.99Å; M65-S171 WeakPolarHBondContact CE-OG 3.47Å
66	T	94.2	Very high	92.9	Very high	7 Å²	7	55.4 Å²	55.4	4%	0.043	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-43.1	173.3	-68.3	0	0	0	0	111.1	F37 S40 I44 Y62 S63 V64 S69 T70	F37-T66 HydrophobicContact CD2-CG2 4Å; F37-T66 HydrophobicContact CE2-CG2 3.76Å; S40-T66 PolarHBondContact O-OG1 3.49Å; I44-T66 WeakPolarHBondContact CD1-OG1 3.14Å; Y62-T66 WeakPolarHBondContact O-CB 3.31Å; Y62-T66 PolarHBondContact O-N 2.99Å; Y62-T66 PolarHBondContact O-OG1 2.95Å; S63-T66 PolarHBondContact O-N 2.82Å; V64-T66 PolarHBondContact O-N 3.43Å; T66-S69 WeakPolarHBondContact CA-OG 3.36Å; T66-S69 PolarHBondContact O-OG 3.07Å; T66-S69 VanDerWaalsContact O-OG 3.07Å; T66-T70 WeakPolarHBondContact O-CB 3.19Å; T66-T70 PolarHBondContact O-N 3.05Å; T66-T70 PolarHBondContact O-OG1 3.37Å
67	L	95.1	Very high	93.1	Very high	113 Å²	113	48.5 Å²	48.5	59%	0.592	26%	0.262	S	S	*	.	H	α-helix	trans	-64.8	-46.4	177	-70.6	174.3	0	0	0	112.2	S63 V64 T70 Y71	S63-L67 VanDerWaalsContact O-CG 3.28Å; S63-L67 WeakPolarHBondContact O-CG 3.4Å; S63-L67 PolarHBondContact O-N 3.49Å; V64-L67 PolarHBondContact O-N 3.46Å; L67-T70 PolarHBondContact O-N 3.42Å; L67-Y71 PolarHBondContact O-N 3.03Å
68	V	94.9	Very high	93.2	Very high	70 Å²	70	43.9 Å²	43.9	42%	0.424	24%	0.239	S	C	.	.	H	α-helix	trans	-62.2	-47.9	178.1	172.1	0	0	0	0	110.9	V64 Y71 L72	V64-V68 HydrophobicContact CG1-CG2 4.45Å; V64-V68 WeakPolarHBondContact O-CG2 3.29Å; V64-V68 PolarHBondContact O-N 3.47Å; V68-Y71 PolarHBondContact O-N 2.95Å; V68-L72 HydrophobicContact CG1-CD1 4.17Å; V68-L72 WeakPolarHBondContact O-CG 3.1Å; V68-L72 PolarHBondContact O-N 2.45Å
69	S	94.5	Very high	93.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-39.2	178.3	59.8	0	0	0	0	112.1	S40 M65 T66 Y71 L72 V73	S40-S69 VanDerWaalsContact CB-OG 3.26Å; S40-S69 WeakPolarHBondContact CB-OG 3.28Å; S40-S69 WeakPolarHBondContact OG-CB 3.43Å; S40-S69 PolarHBondContact OG-OG 3.47Å; M65-S69 WeakPolarHBondContact O-CB 3.36Å; M65-S69 PolarHBondContact O-N 2.97Å; M65-S69 PolarHBondContact O-OG 3.45Å; T66-S69 WeakPolarHBondContact CA-OG 3.36Å; T66-S69 PolarHBondContact O-OG 3.07Å; T66-S69 VanDerWaalsContact O-OG 3.07Å; S69-Y71 VanDerWaalsContact C-N 3.29Å; S69-Y71 PolarHBondContact O-N 3.39Å; S69-L72 PolarHBondContact O-N 3.35Å; S69-V73 VanDerWaalsContact O-CB 3.29Å; S69-V73 WeakPolarHBondContact O-CB 3.47Å; S69-V73 WeakPolarHBondContact O-CG2 3.47Å; S69-V73 PolarHBondContact O-N 2.94Å
70	T	95.6	Very high	93.2	Very high	10 Å²	10	42.1 Å²	42.1	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-45.6	175.6	-63.4	0	0	0	0	110.3	F33 A36 F37 S40 T66 L67 A74	F33-T70 HydrophobicContact CD1-CG2 4.22Å; A36-T70 HydrophobicContact CB-CG2 3.91Å; F37-T70 WeakPolarHBondContact CA-OG1 3.04Å; F37-T70 HydrophobicContact CB-CG2 4.05Å; S40-T70 WeakPolarHBondContact CB-OG1 3.5Å; S40-T70 PolarHBondContact OG-N 3.24Å; T66-T70 WeakPolarHBondContact O-CB 3.19Å; T66-T70 PolarHBondContact O-N 3.05Å; T66-T70 PolarHBondContact O-OG1 3.37Å; L67-T70 PolarHBondContact O-N 3.42Å; T70-A74 WeakPolarHBondContact O-CB 3.42Å; T70-A74 PolarHBondContact O-N 3.49Å
71	Y	94.2	Very high	93.1	Very high	146 Å²	146	37 Å²	37	57%	0.573	19%	0.192	S	C	*	.	H	α-helix	trans	-61.9	-47.7	177.3	176.6	-98.2	0	0	0	112.1	L67 V68 S69 A74 F75	L67-Y71 PolarHBondContact O-N 3.03Å; V68-Y71 PolarHBondContact O-N 2.95Å; S69-Y71 VanDerWaalsContact C-N 3.29Å; S69-Y71 PolarHBondContact O-N 3.39Å; Y71-A74 PolarHBondContact O-N 3.21Å; Y71-F75 VanDerWaalsContact O-CB 3.31Å; Y71-F75 WeakPolarHBondContact O-CB 3.2Å; Y71-F75 PolarHBondContact O-N 2.9Å
72	L	94.4	Very high	92.9	Very high	43 Å²	43	38.3 Å²	38.3	23%	0.225	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-40.4	-179.7	-71.2	176.6	0	0	0	112.9	V68 S69 F75 A76 S174 A178	V68-L72 HydrophobicContact CG1-CD1 4.17Å; V68-L72 WeakPolarHBondContact O-CG 3.1Å; V68-L72 PolarHBondContact O-N 2.45Å; S69-L72 PolarHBondContact O-N 3.35Å; L72-F75 WeakPolarHBondContact O-CB 3.39Å; L72-F75 PolarHBondContact O-N 2.92Å; L72-A76 WeakPolarHBondContact O-CB 3.43Å; L72-A76 PolarHBondContact O-N 2.85Å; L72-S174 WeakPolarHBondContact CD1-OG 3.32Å; L72-A178 HydrophobicContact CB-CB 4.47Å; L72-A178 HydrophobicContact CD2-CB 4.22Å
73	V	94.8	Very high	92.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-45.7	175.6	173.3	0	0	0	0	110.3	A36 V39 S69 F75 A76 Y77 F145 I177	A36-V73 HydrophobicContact CB-CB 4.07Å; A36-V73 HydrophobicContact CB-CG1 3.83Å; V39-V73 HydrophobicContact CG1-CG1 4.05Å; S69-V73 VanDerWaalsContact O-CB 3.29Å; S69-V73 WeakPolarHBondContact O-CB 3.47Å; S69-V73 WeakPolarHBondContact O-CG2 3.47Å; S69-V73 PolarHBondContact O-N 2.94Å; V73-F75 VanDerWaalsContact C-N 3.31Å; V73-F75 PolarHBondContact O-N 3.35Å; V73-A76 WeakPolarHBondContact O-CB 3.23Å; V73-A76 PolarHBondContact O-N 3.32Å; V73-A76 VanDerWaalsContact O-N 3.1Å; V73-Y77 HydrophobicContact CG1-CD1 4.24Å; V73-Y77 HydrophobicContact CG1-CE1 3.49Å; V73-Y77 VanDerWaalsContact CG1-CE1 3.49Å; V73-Y77 HydrophobicContact CG1-CE2 3.95Å; V73-Y77 VanDerWaalsContact CG1-OH 3.31Å; V73-Y77 WeakPolarHBondContact CG1-OH 3.09Å; V73-Y77 WeakPolarHBondContact O-CD1 3.44Å; V73-Y77 PolarHBondContact O-N 3.45Å; V73-F145 HydrophobicContact CG2-CD2 4.12Å; V73-F145 HydrophobicContact CG2-CE2 4.3Å; V73-F145 HydrophobicContact CG2-CG 4.45Å; V73-I177 HydrophobicContact CB-CD1 4.13Å; V73-I177 HydrophobicContact CG1-CD1 4.44Å; V73-I177 HydrophobicContact CG2-CD1 3.5Å; V73-I177 VanDerWaalsContact CG2-CD1 3.5Å
74	A	93.7	Very high	92.3	Very high	5 Å²	5	38.2 Å²	38.2	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-38.6	176.8	0	0	0	0	0	111.9	F33 A36 T70 Y71 A76 Y77 K78	F33-A74 HydrophobicContact CD1-CB 4.07Å; F33-A74 HydrophobicContact CD2-CB 4.43Å; F33-A74 HydrophobicContact CE1-CB 4Å; F33-A74 HydrophobicContact CE2-CB 4.37Å; F33-A74 HydrophobicContact CG-CB 4.29Å; F33-A74 HydrophobicContact CZ-CB 4.15Å; A36-A74 HydrophobicContact CB-CB 3.99Å; T70-A74 WeakPolarHBondContact O-CB 3.42Å; T70-A74 PolarHBondContact O-N 3.49Å; Y71-A74 PolarHBondContact O-N 3.21Å; A74-A76 VanDerWaalsContact C-N 3.33Å; A74-Y77 PolarHBondContact O-N 2.87Å; A74-K78 PolarHBondContact O-N 3.49Å
75	F	92	Very high	91.9	Very high	73 Å²	73	36 Å²	36	32%	0.32	18%	0.175	S	C	.	.	H	α-helix	trans	-61.1	-42.8	171.4	177.6	-101.7	0	0	0	111.6	Y71 L72 V73 K78 N79 A178 T182	Y71-F75 VanDerWaalsContact O-CB 3.31Å; Y71-F75 WeakPolarHBondContact O-CB 3.2Å; Y71-F75 PolarHBondContact O-N 2.9Å; L72-F75 WeakPolarHBondContact O-CB 3.39Å; L72-F75 PolarHBondContact O-N 2.92Å; V73-F75 VanDerWaalsContact C-N 3.31Å; V73-F75 PolarHBondContact O-N 3.35Å; F75-K78 WeakPolarHBondContact O-CB 3.44Å; F75-K78 PolarHBondContact O-N 2.83Å; F75-N79 WeakPolarHBondContact CD1-ND2 3.19Å; F75-N79 WeakPolarHBondContact CE1-ND2 3.37Å; F75-N79 WeakPolarHBondContact CZ-ND2 3.17Å; F75-N79 PolarHBondContact O-N 2.84Å; F75-N79 VanDerWaalsContact O-N 3.09Å; F75-N79 PolarHBondContact O-ND2 2.9Å; F75-A178 HydrophobicContact CD1-CB 4.23Å; F75-T182 HydrophobicContact CE1-CG2 3.85Å; F75-T182 HydrophobicContact CZ-CG2 4.17Å
76	A	93.3	Very high	91.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-42.6	176.7	0	0	0	0	0	112.4	L72 V73 A74 K78 N79 V80 N141 I177 S181	L72-A76 WeakPolarHBondContact O-CB 3.43Å; L72-A76 PolarHBondContact O-N 2.85Å; V73-A76 WeakPolarHBondContact O-CB 3.23Å; V73-A76 PolarHBondContact O-N 3.32Å; V73-A76 VanDerWaalsContact O-N 3.1Å; A74-A76 VanDerWaalsContact C-N 3.33Å; A76-K78 VanDerWaalsContact C-N 3.31Å; A76-K78 PolarHBondContact O-N 3.41Å; A76-N79 PolarHBondContact O-N 3.3Å; A76-V80 WeakPolarHBondContact O-CG2 3.4Å; A76-V80 PolarHBondContact O-N 2.96Å; A76-N141 WeakPolarHBondContact CB-OD1 3.36Å; A76-I177 HydrophobicContact CB-CB 4.41Å; A76-I177 HydrophobicContact CB-CD1 4.37Å; A76-I177 HydrophobicContact CB-CG1 4.09Å; A76-S181 WeakPolarHBondContact CA-OG 3.27Å
77	Y	92.8	Very high	91	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-43.8	173.5	-60.5	-19.3	0	0	0	112.1	F32 N35 A36 V73 A74 N79 K81 S137 I138 N141 N142	F32-Y77 HydrophobicContact CB-CD2 3.76Å; F32-Y77 AromaticContact CD1-CD2 3.85Å; F32-Y77 HydrophobicContact CD1-CD2 3.85Å; F32-Y77 HydrophobicContact CD1-CG 4.35Å; F32-Y77 AromaticContact CG-CD2 3.82Å; F32-Y77 HydrophobicContact CG-CD2 3.82Å; F32-Y77 HydrophobicContact CG-CG 4.36Å; F32-Y77 WeakPolarHBondContact O-CE2 3.4Å; N35-Y77 HydrophobicContact CB-CE2 4.29Å; A36-Y77 HydrophobicContact CB-CE2 3.84Å; V73-Y77 HydrophobicContact CG1-CD1 4.24Å; V73-Y77 HydrophobicContact CG1-CE1 3.49Å; V73-Y77 VanDerWaalsContact CG1-CE1 3.49Å; V73-Y77 HydrophobicContact CG1-CE2 3.95Å; V73-Y77 VanDerWaalsContact CG1-OH 3.31Å; V73-Y77 WeakPolarHBondContact CG1-OH 3.09Å; V73-Y77 WeakPolarHBondContact O-CD1 3.44Å; V73-Y77 PolarHBondContact O-N 3.45Å; A74-Y77 PolarHBondContact O-N 2.87Å; Y77-N79 PolarHBondContact O-N 3.46Å; Y77-K81 WeakPolarHBondContact O-CB 3.31Å; Y77-K81 PolarHBondContact O-N 3.4Å; Y77-S137 WeakPolarHBondContact CD1-O 3.04Å; Y77-I138 HydrophobicContact CD2-CG1 4.33Å; Y77-I138 HydrophobicContact CE2-CG1 4.34Å; Y77-N141 HydrophobicContact CD1-CB 3.45Å; Y77-N141 VanDerWaalsContact CD1-CB 3.45Å; Y77-N141 HydrophobicContact CE1-CB 3.44Å; Y77-N141 VanDerWaalsContact CE1-CB 3.44Å; Y77-N142 VanDerWaalsContact OH-CG 3.24Å; Y77-N142 PolarHBondContact OH-ND2 3.49Å; Y77-N142 PolarHBondContact OH-OD1 3.08Å
78	K	90.7	Very high	90.5	Very high	66 Å²	66	40.5 Å²	40.5	29%	0.287	19%	0.192	S	C	.	.	H	α-helix	trans	-59.7	-46.7	179.8	-179.8	173	-174.6	-176.4	0	111.5	R22 L24 A74 F75 A76 F82	R22-K78 WeakPolarHBondContact O-CE 3.22Å; L24-K78 HydrophobicContact CD1-CB 3.79Å; L24-K78 HydrophobicContact CD1-CD 3.96Å; L24-K78 HydrophobicContact CD1-CG 3.63Å; L24-K78 HydrophobicContact CD2-CG 4.42Å; L24-K78 HydrophobicContact CG-CD 4.28Å; L24-K78 HydrophobicContact CG-CG 3.9Å; A74-K78 PolarHBondContact O-N 3.49Å; F75-K78 WeakPolarHBondContact O-CB 3.44Å; F75-K78 PolarHBondContact O-N 2.83Å; A76-K78 VanDerWaalsContact C-N 3.31Å; A76-K78 PolarHBondContact O-N 3.41Å; K78-F82 WeakPolarHBondContact O-CB 3.29Å; K78-F82 PolarHBondContact O-N 2.97Å
79	N	89.8	Confident	90	Very high	5 Å²	5	38 Å²	38	3%	0.027	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-45.4	-178.8	-66.1	-27.1	0	0	0	112.1	F75 A76 Y77 K81 F82 V83 S181	F75-N79 WeakPolarHBondContact CD1-ND2 3.19Å; F75-N79 WeakPolarHBondContact CE1-ND2 3.37Å; F75-N79 WeakPolarHBondContact CZ-ND2 3.17Å; F75-N79 PolarHBondContact O-N 2.84Å; F75-N79 VanDerWaalsContact O-N 3.09Å; F75-N79 PolarHBondContact O-ND2 2.9Å; A76-N79 PolarHBondContact O-N 3.3Å; Y77-N79 PolarHBondContact O-N 3.46Å; N79-K81 VanDerWaalsContact C-N 3.31Å; N79-K81 PolarHBondContact O-N 3.43Å; N79-F82 PolarHBondContact O-N 3.32Å; N79-V83 PolarHBondContact O-N 3.06Å; N79-V83 VanDerWaalsContact O-N 3.12Å; N79-S181 WeakPolarHBondContact CB-O 3.48Å; N79-S181 PolarHBondContact ND2-OG 3.5Å
80	V	89.7	Confident	89.5	Confident	18 Å²	18	43.2 Å²	43.2	11%	0.109	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177	176.5	0	0	0	0	110.2	A76 F82 V83 L84 N141	A76-V80 WeakPolarHBondContact O-CG2 3.4Å; A76-V80 PolarHBondContact O-N 2.96Å; V80-F82 VanDerWaalsContact C-N 3.32Å; V80-F82 PolarHBondContact O-N 2.91Å; V80-V83 PolarHBondContact O-N 3.1Å; V80-L84 VanDerWaalsContact O-CB 3.25Å; V80-L84 WeakPolarHBondContact O-CB 3.36Å; V80-L84 PolarHBondContact O-N 2.9Å; V80-N141 VanDerWaalsContact CG2-ND2 3.34Å; V80-N141 WeakPolarHBondContact CG2-ND2 3.44Å
81	K	89.5	Confident	89	Confident	5 Å²	5	51.4 Å²	51.4	2%	0.022	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-44.2	177.2	171.6	168.6	167.9	165.4	0	111.3	L24 S28 F32 Y77 N79 V83 L84 K85 D130 A133 T134 S137	L24-K81 HydrophobicContact CD2-CD 3.6Å; L24-K81 HydrophobicContact CD2-CG 4.23Å; S28-K81 PolarHBondContact OG-NZ 2.83Å; F32-K81 HydrophobicContact CE2-CB 4.19Å; F32-K81 HydrophobicContact CE2-CD 3.85Å; F32-K81 HydrophobicContact CZ-CB 3.91Å; F32-K81 HydrophobicContact CZ-CD 3.45Å; F32-K81 VanDerWaalsContact CZ-CD 3.45Å; F32-K81 HydrophobicContact CZ-CG 4.27Å; Y77-K81 WeakPolarHBondContact O-CB 3.31Å; Y77-K81 PolarHBondContact O-N 3.4Å; N79-K81 VanDerWaalsContact C-N 3.31Å; N79-K81 PolarHBondContact O-N 3.43Å; K81-V83 PolarHBondContact O-N 3.43Å; K81-L84 PolarHBondContact O-N 3.42Å; K81-K85 WeakPolarHBondContact O-CB 3.4Å; K81-K85 PolarHBondContact O-N 3.07Å; K81-D130 WeakPolarHBondContact CE-OD1 3.49Å; K81-D130 IonicContact NZ-OD1 3.22Å; K81-D130 PolarHBondContact NZ-OD1 3.29Å; K81-D130 IonicContact NZ-OD2 3.41Å; K81-D130 PolarHBondContact NZ-OD2 3.06Å; K81-D130 VanDerWaalsContact NZ-OD2 3.08Å; K81-A133 HydrophobicContact CG-CB 4.14Å; K81-T134 WeakPolarHBondContact CD-OG1 3.4Å; K81-T134 WeakPolarHBondContact CE-OG1 3.42Å; K81-T134 PolarHBondContact NZ-OG1 3.39Å; K81-S137 WeakPolarHBondContact CA-OG 3.48Å; K81-S137 WeakPolarHBondContact CB-OG 3.37Å; K81-S137 PolarHBondContact N-OG 3.07Å
82	F	87.5	Confident	88.4	Confident	67 Å²	67	49.5 Å²	49.5	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-59	-48.9	179.4	-178.2	-99.8	0	0	0	111.7	F20 R22 K78 N79 V80	F20-F82 WeakPolarHBondContact O-CE2 3.36Å; R22-F82 HydrophobicContact CB-CD2 4.44Å; R22-F82 HydrophobicContact CG-CD1 4.31Å; R22-F82 HydrophobicContact CG-CD2 3.72Å; R22-F82 HydrophobicContact CG-CE1 4.36Å; R22-F82 HydrophobicContact CG-CE2 3.78Å; R22-F82 HydrophobicContact CG-CG 3.99Å; R22-F82 HydrophobicContact CG-CZ 4.1Å; K78-F82 WeakPolarHBondContact O-CB 3.29Å; K78-F82 PolarHBondContact O-N 2.97Å; N79-F82 PolarHBondContact O-N 3.32Å; V80-F82 VanDerWaalsContact C-N 3.32Å; V80-F82 PolarHBondContact O-N 2.91Å
83	V	86.7	Confident	87.7	Confident	37 Å²	37	51.7 Å²	51.7	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-40.7	179	178.2	0	0	0	0	111.4	N79 V80 K81 K87	N79-V83 PolarHBondContact O-N 3.06Å; N79-V83 VanDerWaalsContact O-N 3.12Å; V80-V83 PolarHBondContact O-N 3.1Å; K81-V83 PolarHBondContact O-N 3.43Å; V83-K87 HydrophobicContact CG1-CD 4.39Å
84	L	86.5	Confident	87.1	Confident	37 Å²	37	58.2 Å²	58.2	19%	0.194	27%	0.274	C	S	.	.	H	α-helix	trans	-77.1	-32.8	-174.5	-141.6	76.7	0	0	0	113	V80 K81 H86 K87 V88 A133 F136	V80-L84 VanDerWaalsContact O-CB 3.25Å; V80-L84 WeakPolarHBondContact O-CB 3.36Å; V80-L84 PolarHBondContact O-N 2.9Å; K81-L84 PolarHBondContact O-N 3.42Å; L84-H86 VanDerWaalsContact C-N 3.3Å; L84-H86 PolarHBondContact O-N 3.03Å; L84-K87 PolarHBondContact O-N 3.33Å; L84-V88 HydrophobicContact CD2-CG2 4.49Å; L84-V88 HydrophobicContact CG-CG2 4.18Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 VanDerWaalsContact O-CG2 3.26Å; L84-V88 WeakPolarHBondContact O-CG2 3.39Å; L84-V88 PolarHBondContact O-N 3.06Å; L84-A133 HydrophobicContact CB-CB 4.26Å; L84-F136 HydrophobicContact CD1-CD1 4.45Å; L84-F136 HydrophobicContact CD1-CE1 4.43Å; L84-F136 HydrophobicContact CD2-CB 3.61Å; L84-F136 HydrophobicContact CD2-CD1 3.15Å; L84-F136 HydrophobicContact CD2-CD2 4.49Å; L84-F136 HydrophobicContact CD2-CE1 3.89Å; L84-F136 HydrophobicContact CD2-CG 3.5Å; L84-F136 VanDerWaalsContact CD2-CG 3.5Å; L84-F136 HydrophobicContact CG-CD1 4.42Å
85	K	85.9	Confident	86.6	Confident	32 Å²	32	60.6 Å²	60.6	14%	0.139	29%	0.293	C	S	.	.	H	α-helix	trans	-56.2	-46.2	179.7	-170.6	-170.8	-174.5	-156	0	110.9	D19 K81 A89 N126 A129 A133	D19-K85 IonicContact OD1-NZ 3.08Å; D19-K85 PolarHBondContact OD1-NZ 2.83Å; K81-K85 WeakPolarHBondContact O-CB 3.4Å; K81-K85 PolarHBondContact O-N 3.07Å; K85-A89 VanDerWaalsContact O-CB 3.25Å; K85-A89 WeakPolarHBondContact O-CB 3.18Å; K85-A89 PolarHBondContact O-N 3.44Å; K85-N126 WeakPolarHBondContact CE-OD1 3.41Å; K85-N126 PolarHBondContact NZ-OD1 3.44Å; K85-A129 HydrophobicContact CG-CB 4.3Å; K85-A133 HydrophobicContact CB-CB 4.04Å
86	H	83.9	Confident	86.1	Confident	115 Å²	115	57.3 Å²	57.3	53%	0.532	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-47.2	177.8	-173.1	72	0	0	0	112.2	L84 V88 A89 Q90	L84-H86 VanDerWaalsContact C-N 3.3Å; L84-H86 PolarHBondContact O-N 3.03Å; H86-V88 PolarHBondContact O-N 2.9Å; H86-A89 PolarHBondContact O-N 3.34Å; H86-Q90 PolarHBondContact NE2-NE2 3.09Å; H86-Q90 VanDerWaalsContact NE2-NE2 3.12Å; H86-Q90 WeakPolarHBondContact O-CG 3.45Å; H86-Q90 PolarHBondContact O-N 3.41Å; H86-Q90 VanDerWaalsContact O-N 3.1Å
87	K	85.5	Confident	85.5	Confident	99 Å²	99	59.5 Å²	59.5	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-41.3	179.2	-67.6	-177.9	-179.8	-178.5	0	112	V83 L84 K91 K185	V83-K87 HydrophobicContact CG1-CD 4.39Å; L84-K87 PolarHBondContact O-N 3.33Å; K87-K91 WeakPolarHBondContact O-CB 3.39Å; K87-K91 PolarHBondContact O-N 3.13Å; K87-K91 VanDerWaalsContact O-N 3.16Å; K87-K185 PolarHBondContact NZ-O 2.86Å
88	V	85.3	Confident	85	Confident	21 Å²	21	67.3 Å²	67.3	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-69.4	-43.9	177.7	172.1	0	0	0	0	111	L84 H86 Q90 K91 R92 A129 E132	L84-V88 HydrophobicContact CD2-CG2 4.49Å; L84-V88 HydrophobicContact CG-CG2 4.18Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 VanDerWaalsContact O-CG2 3.26Å; L84-V88 WeakPolarHBondContact O-CG2 3.39Å; L84-V88 PolarHBondContact O-N 3.06Å; H86-V88 PolarHBondContact O-N 2.9Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 3.27Å; V88-K91 PolarHBondContact O-N 2.86Å; V88-K91 VanDerWaalsContact O-N 3.16Å; V88-R92 HydrophobicContact CG1-CG 3.91Å; V88-R92 WeakPolarHBondContact O-CB 3.29Å; V88-R92 WeakPolarHBondContact O-CG 3.04Å; V88-R92 PolarHBondContact O-N 2.63Å; V88-A129 HydrophobicContact CG1-CB 4.15Å; V88-E132 HydrophobicContact CG1-CB 4Å; V88-E132 WeakPolarHBondContact CG1-OE2 3.26Å
89	A	83.1	Confident	84.6	Confident	18 Å²	18	67.3 Å²	67.3	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-56.5	-45.8	177.8	0	0	0	0	0	111.1	K85 H86 E93 K125 A129	K85-A89 VanDerWaalsContact O-CB 3.25Å; K85-A89 WeakPolarHBondContact O-CB 3.18Å; K85-A89 PolarHBondContact O-N 3.44Å; H86-A89 PolarHBondContact O-N 3.34Å; A89-E93 PolarHBondContact O-N 3.25Å; A89-K125 HydrophobicContact CB-CG 4.47Å; A89-K125 WeakPolarHBondContact O-CE 3.14Å; A89-A129 HydrophobicContact CB-CB 3.94Å
90	Q	84.3	Confident	84.1	Confident	111 Å²	111	67.9 Å²	67.9	52%	0.519	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-44.3	176.1	-71.1	176.7	-34.8	0	0	112.4	H86 V88 R92	H86-Q90 PolarHBondContact NE2-NE2 3.09Å; H86-Q90 VanDerWaalsContact NE2-NE2 3.12Å; H86-Q90 WeakPolarHBondContact O-CG 3.45Å; H86-Q90 PolarHBondContact O-N 3.41Å; H86-Q90 VanDerWaalsContact O-N 3.1Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 3.27Å; Q90-R92 PolarHBondContact O-N 2.84Å
91	K	84.9	Confident	83.6	Confident	182 Å²	182	69.4 Å²	69.4	79%	0.791	34%	0.343	S	S	*	.	H	α-helix	trans	-73.7	-24.1	-176.3	-165.9	169.8	-176.8	177.2	0	114	K87 V88	K87-K91 WeakPolarHBondContact O-CB 3.39Å; K87-K91 PolarHBondContact O-N 3.13Å; K87-K91 VanDerWaalsContact O-N 3.16Å; V88-K91 PolarHBondContact O-N 2.86Å; V88-K91 VanDerWaalsContact O-N 3.16Å
92	R	82.1	Confident	83	Confident	106 Å²	106	78.4 Å²	78.4	40%	0.4	38%	0.377	S	S	.	.	H	α-helix	trans	-97.7	-5.1	-177.5	-66.2	-58	-164.5	-179.1	7.8	114.2	V88 Q90 D94 A95 V96 E132	V88-R92 HydrophobicContact CG1-CG 3.91Å; V88-R92 WeakPolarHBondContact O-CB 3.29Å; V88-R92 WeakPolarHBondContact O-CG 3.04Å; V88-R92 PolarHBondContact O-N 2.63Å; Q90-R92 PolarHBondContact O-N 2.84Å; R92-D94 PolarHBondContact O-N 2.94Å; R92-A95 PolarHBondContact O-N 3.47Å; R92-V96 HydrophobicContact CB-CG2 4.31Å; R92-V96 WeakPolarHBondContact O-CB 3.38Å; R92-V96 VanDerWaalsContact O-CG2 3.29Å; R92-V96 WeakPolarHBondContact O-CG2 2.82Å; R92-V96 PolarHBondContact O-N 2.96Å; R92-E132 IonicContact CZ-OE1 3.92Å; R92-E132 IonicContact CZ-OE2 2.82Å; R92-E132 IonicContact NE-OE1 2.74Å; R92-E132 PolarHBondContact NE-OE1 3.16Å; R92-E132 IonicContact NE-OE2 2.78Å; R92-E132 PolarHBondContact NE-OE2 3.33Å; R92-E132 VanDerWaalsContact NE-OE2 3.16Å; R92-E132 IonicContact NH2-OE1 3.16Å; R92-E132 PolarHBondContact NH2-OE1 3.29Å; R92-E132 IonicContact NH2-OE2 2.68Å
93	E	79.5	Confident	82.4	Confident	88 Å²	88	81.5 Å²	81.5	41%	0.411	39%	0.39	S	S	.	.	H	α-helix	trans	-51.9	-54.8	-177.4	179.8	148.3	-137.8	0	0	113.5	A89 A95 V96 S97 K125	A89-E93 PolarHBondContact O-N 3.25Å; E93-A95 PolarHBondContact O-N 3.39Å; E93-V96 PolarHBondContact O-N 3.45Å; E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.47Å; E93-S97 PolarHBondContact O-N 3.42Å; E93-K125 IonicContact OE1-NZ 2.68Å; E93-K125 PolarHBondContact OE1-NZ 2.68Å; E93-K125 IonicContact OE2-NZ 2.7Å; E93-K125 PolarHBondContact OE2-NZ 2.6Å
94	D	82.6	Confident	81.6	Confident	137 Å²	137	80.9 Å²	80.9	73%	0.733	39%	0.385	S	S	*	.	H	α-helix	trans	-64.1	-41.4	-177.1	-63.4	-31.5	0	0	0	112.4	R92 K98	R92-D94 PolarHBondContact O-N 2.94Å; D94-K98 WeakPolarHBondContact O-CB 3.43Å; D94-K98 PolarHBondContact O-N 2.93Å
95	A	83.8	Confident	80.6	Confident	55 Å²	55	82.4 Å²	82.4	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-66.6	-44.2	-179.3	0	0	0	0	0	111.5	R92 E93 K98 E99	R92-A95 PolarHBondContact O-N 3.47Å; E93-A95 PolarHBondContact O-N 3.39Å; A95-K98 PolarHBondContact O-N 3.47Å; A95-E99 WeakPolarHBondContact O-CB 2.98Å; A95-E99 PolarHBondContact O-N 3.37Å
96	V	80.6	Confident	79.6	Confident	5 Å²	5	88.4 Å²	88.4	3%	0.03	43%	0.428	C	S	.	.	H	α-helix	trans	-67.8	-42	178.3	173.7	0	0	0	0	110.7	R92 E93 K98 E99 V100 K124 K125 V128	R92-V96 HydrophobicContact CB-CG2 4.31Å; R92-V96 WeakPolarHBondContact O-CB 3.38Å; R92-V96 VanDerWaalsContact O-CG2 3.29Å; R92-V96 WeakPolarHBondContact O-CG2 2.82Å; R92-V96 PolarHBondContact O-N 2.96Å; E93-V96 PolarHBondContact O-N 3.45Å; V96-K98 VanDerWaalsContact C-N 3.31Å; V96-K98 PolarHBondContact O-N 3.49Å; V96-E99 PolarHBondContact O-N 3.49Å; V96-V100 HydrophobicContact CG1-CG2 4.24Å; V96-V100 WeakPolarHBondContact O-CG2 3.17Å; V96-V100 PolarHBondContact O-N 2.84Å; V96-K124 HydrophobicContact CG1-CB 3.82Å; V96-K124 HydrophobicContact CG1-CG 3.79Å; V96-K125 HydrophobicContact CG1-CB 4.34Å; V96-V128 HydrophobicContact CG2-CG2 4.48Å
97	S	79.9	Confident	78.5	Confident	45 Å²	45	85.6 Å²	85.6	32%	0.315	42%	0.424	S	S	.	.	H	α-helix	trans	-58.6	-43.1	175.6	-177.9	0	0	0	0	111.9	E93 T101	E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.47Å; E93-S97 PolarHBondContact O-N 3.42Å; S97-T101 VanDerWaalsContact O-CB 3.31Å; S97-T101 WeakPolarHBondContact O-CB 3.43Å; S97-T101 PolarHBondContact O-N 2.99Å; S97-T101 PolarHBondContact O-OG1 2.94Å
98	K	83.7	Confident	77.5	Confident	164 Å²	164	85 Å²	85	71%	0.713	43%	0.426	S	S	*	.	H	α-helix	trans	-66.5	-41.7	174.8	-170.5	175.5	-177.9	177.3	0	112.3	D94 A95 V96 R102	D94-K98 WeakPolarHBondContact O-CB 3.43Å; D94-K98 PolarHBondContact O-N 2.93Å; A95-K98 PolarHBondContact O-N 3.47Å; V96-K98 VanDerWaalsContact C-N 3.31Å; V96-K98 PolarHBondContact O-N 3.49Å; K98-R102 WeakPolarHBondContact O-CB 3.47Å; K98-R102 PolarHBondContact O-N 2.96Å
99	E	81.9	Confident	76.4	Confident	67 Å²	67	86.9 Å²	86.9	31%	0.313	44%	0.435	S	S	.	.	H	α-helix	trans	-64.4	-47.2	179.2	-172.3	-174.7	170.1	0	0	112	A95 V96 R102 K103	A95-E99 WeakPolarHBondContact O-CB 2.98Å; A95-E99 PolarHBondContact O-N 3.37Å; V96-E99 PolarHBondContact O-N 3.49Å; E99-R102 PolarHBondContact O-N 3.48Å; E99-K103 HydrophobicContact CG-CD 4.48Å; E99-K103 PolarHBondContact O-N 2.83Å; E99-K103 WeakPolarHBondContact OE1-CE 3.28Å; E99-K103 IonicContact OE1-NZ 2.84Å; E99-K103 PolarHBondContact OE1-NZ 2.82Å
100	V	78.8	Confident	75.5	Confident	16 Å²	16	96.7 Å²	96.7	10%	0.097	47%	0.468	C	S	.	.	H	α-helix	trans	-62.9	-47.2	178.3	174	0	0	0	0	109.8	V96 R102 K103 L104 R120 I121 K124	V96-V100 HydrophobicContact CG1-CG2 4.24Å; V96-V100 WeakPolarHBondContact O-CG2 3.17Å; V96-V100 PolarHBondContact O-N 2.84Å; V100-R102 PolarHBondContact O-N 3.5Å; V100-K103 PolarHBondContact O-N 2.89Å; V100-K103 VanDerWaalsContact O-N 3.11Å; V100-L104 HydrophobicContact CG1-CD1 3.65Å; V100-L104 WeakPolarHBondContact O-CD1 3.45Å; V100-L104 PolarHBondContact O-N 3.28Å; V100-L104 VanDerWaalsContact O-N 3.07Å; V100-R120 HydrophobicContact CG1-CB 4.48Å; V100-I121 HydrophobicContact CB-CG1 3.82Å; V100-I121 HydrophobicContact CG1-CG1 3.73Å; V100-I121 HydrophobicContact CG2-CG1 4.15Å; V100-K124 HydrophobicContact CG2-CB 4.16Å; V100-K124 HydrophobicContact CG2-CG 4.28Å
101	T	78.8	Confident	74.8	Confident	51 Å²	51	99.8 Å²	99.8	31%	0.313	48%	0.48	S	S	.	.	H	α-helix	trans	-59.3	-34.3	177	-62.4	0	0	0	0	112.6	S97 K117	S97-T101 VanDerWaalsContact O-CB 3.31Å; S97-T101 WeakPolarHBondContact O-CB 3.43Å; S97-T101 PolarHBondContact O-N 2.99Å; S97-T101 PolarHBondContact O-OG1 2.94Å; T101-K117 WeakPolarHBondContact OG1-CE 3.38Å; T101-K117 PolarHBondContact OG1-NZ 3.13Å; T101-K117 VanDerWaalsContact OG1-NZ 3.12Å
102	R	78.3	Confident	74	Confident	193 Å²	193	92.8 Å²	92.8	73%	0.728	45%	0.45	S	S	*	.	H	α-helix	trans	-74.2	-33.5	176.3	-170.9	-177.2	70.3	104.6	-1.5	113.3	K98 E99 V100	K98-R102 WeakPolarHBondContact O-CB 3.47Å; K98-R102 PolarHBondContact O-N 2.96Å; E99-R102 PolarHBondContact O-N 3.48Å; V100-R102 PolarHBondContact O-N 3.5Å
103	K	74	Confident	73.8	Confident	133 Å²	133	90.8 Å²	90.8	58%	0.578	45%	0.452	S	S	*	.	H	α-helix	trans	-76.8	-27.7	179.8	-78.6	-175.1	-177.7	167.5	0	113.1	E99 V100 S105	E99-K103 HydrophobicContact CG-CD 4.48Å; E99-K103 PolarHBondContact O-N 2.83Å; E99-K103 WeakPolarHBondContact OE1-CE 3.28Å; E99-K103 IonicContact OE1-NZ 2.84Å; E99-K103 PolarHBondContact OE1-NZ 2.82Å; V100-K103 PolarHBondContact O-N 2.89Å; V100-K103 VanDerWaalsContact O-N 3.11Å; K103-S105 PolarHBondContact O-N 3.4Å
104	L	70	Confident	73.7	Confident	23 Å²	23	96.8 Å²	96.8	12%	0.12	47%	0.471	C	S	.	.	S	Bend	trans	-69.4	119.9	169	-83.9	80.1	0	0	0	108.4	V100 N109 M112	V100-L104 HydrophobicContact CG1-CD1 3.65Å; V100-L104 WeakPolarHBondContact O-CD1 3.45Å; V100-L104 PolarHBondContact O-N 3.28Å; V100-L104 VanDerWaalsContact O-N 3.07Å; L104-N109 HydrophobicContact CB-CB 4.26Å; L104-N109 HydrophobicContact CD2-CB 4.44Å; L104-M112 HydrophobicContact CD2-CB 4.45Å; L104-M112 HydrophobicContact CD2-CE 3.62Å; L104-M112 HydrophobicContact CD2-SD 3.57Å; L104-M112 VanDerWaalsContact CD2-SD 3.57Å; L104-M112 HydrophobicContact CG-CE 4.33Å
105	S	64.9	Low	73.5	Confident	69 Å²	69	97 Å²	97	48%	0.483	47%	0.466	S	S	.	.			trans	-53	144.3	164.8	174.4	0	0	0	0	109.1	K103 A107 D108 N109	K103-S105 PolarHBondContact O-N 3.4Å; S105-A107 PolarHBondContact O-N 3.12Å; S105-A107 PolarHBondContact OG-N 3.2Å; S105-D108 PolarHBondContact O-N 3.04Å; S105-N109 WeakPolarHBondContact O-CB 3.26Å; S105-N109 PolarHBondContact O-N 3.22Å
106	E	65.5	Low	73.4	Confident	159 Å²	159	99.1 Å²	99.1	74%	0.743	47%	0.466	S	S	*	.	H	α-helix	trans	-52	-32.9	176.2	-64.2	-172.8	165.3	0	0	112	N109 R110	E106-N109 PolarHBondContact O-N 2.86Å; E106-R110 WeakPolarHBondContact O-CG 3.4Å; E106-R110 PolarHBondContact O-N 3.48Å; E106-R110 VanDerWaalsContact O-N 3.14Å
107	A	61.6	Low	73.3	Confident	55 Å²	55	100.6 Å²	100.6	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-66.7	-40.7	176	0	0	0	0	0	113.1	S105 K111	S105-A107 PolarHBondContact O-N 3.12Å; S105-A107 PolarHBondContact OG-N 3.2Å; A107-K111 WeakPolarHBondContact O-CG 3.3Å; A107-K111 PolarHBondContact O-N 3.12Å
108	D	64.1	Low	73.4	Confident	87 Å²	87	103.2 Å²	103.2	47%	0.465	48%	0.483	S	S	.	.	H	α-helix	trans	-74.8	-35.3	175.9	-70.8	-27	0	0	0	111.2	S105 R110 K111 M112	S105-D108 PolarHBondContact O-N 3.04Å; D108-R110 PolarHBondContact O-N 2.98Å; D108-K111 PolarHBondContact O-N 3.43Å; D108-K111 VanDerWaalsContact O-N 3.09Å; D108-M112 VanDerWaalsContact O-CB 3.25Å; D108-M112 WeakPolarHBondContact O-CB 3.5Å; D108-M112 PolarHBondContact O-N 3.24Å
109	N	60.9	Low	73.4	Confident	60 Å²	60	100 Å²	100	32%	0.321	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-26.9	176.4	-155.5	28.2	0	0	0	111.7	L104 S105 E106 K117	L104-N109 HydrophobicContact CB-CB 4.26Å; L104-N109 HydrophobicContact CD2-CB 4.44Å; S105-N109 WeakPolarHBondContact O-CB 3.26Å; S105-N109 PolarHBondContact O-N 3.22Å; E106-N109 PolarHBondContact O-N 2.86Å; N109-K117 PolarHBondContact OD1-NZ 3.12Å
110	R	64.1	Low	73.4	Confident	225 Å²	225	104 Å²	104	85%	0.849	48%	0.482	S	S	*	.	H	α-helix	trans	-80.8	-30.9	171.3	-74.8	-176.5	-179.4	-173.4	2	113.8	E106 D108	E106-R110 WeakPolarHBondContact O-CG 3.4Å; E106-R110 PolarHBondContact O-N 3.48Å; E106-R110 VanDerWaalsContact O-N 3.14Å; D108-R110 PolarHBondContact O-N 2.98Å
111	K	70.2	Confident	73.5	Confident	176 Å²	176	104.2 Å²	104.2	77%	0.765	48%	0.483	S	S	*	.	H	α-helix	trans	-84.5	-27.3	-179.7	-72.3	-178.6	179.9	-179	0	113.1	A107 D108	A107-K111 WeakPolarHBondContact O-CG 3.3Å; A107-K111 PolarHBondContact O-N 3.12Å; D108-K111 PolarHBondContact O-N 3.43Å; D108-K111 VanDerWaalsContact O-N 3.09Å
112	M	68.9	Low	73.7	Confident	35 Å²	35	105.5 Å²	105.5	17%	0.172	49%	0.487	C	S	.	.	S	Bend	trans	-76.5	133.5	-178.9	-174.1	172.2	-63.7	0	0	111	L104 D108 E116 K117	L104-M112 HydrophobicContact CD2-CB 4.45Å; L104-M112 HydrophobicContact CD2-CE 3.62Å; L104-M112 HydrophobicContact CD2-SD 3.57Å; L104-M112 VanDerWaalsContact CD2-SD 3.57Å; L104-M112 HydrophobicContact CG-CE 4.33Å; D108-M112 VanDerWaalsContact O-CB 3.25Å; D108-M112 WeakPolarHBondContact O-CB 3.5Å; D108-M112 PolarHBondContact O-N 3.24Å; M112-E116 HydrophobicContact CG-CB 3.62Å; M112-E116 HydrophobicContact SD-CB 4.09Å; M112-K117 HydrophobicContact CG-CB 4.32Å; M112-K117 VanDerWaalsContact SD-CA 3.53Å; M112-K117 HydrophobicContact SD-CB 3.73Å; M112-K117 HydrophobicContact SD-CG 4.37Å; M112-K117 PolarHBondContact SD-N 3.34Å
113	S	77.5	Confident	74	Confident	63 Å²	63	104.4 Å²	104.4	44%	0.441	48%	0.483	S	S	.	.			trans	-66.9	141.6	171.2	-178.2	0	0	0	0	109.9	K115 E116 K117	S113-K115 PolarHBondContact O-N 3.3Å; S113-E116 PolarHBondContact N-OE2 3.44Å; S113-E116 WeakPolarHBondContact O-CB 3.35Å; S113-E116 PolarHBondContact O-N 3.36Å; S113-K117 PolarHBondContact O-N 3.46Å
114	R	77.6	Confident	74.5	Confident	215 Å²	215	101 Å²	101	81%	0.811	47%	0.469	S	S	*	.	H	α-helix	trans	-48.3	-39	177.2	-68.8	-175.7	-180	-176.5	-0.1	112	K117 D118	R114-K117 WeakPolarHBondContact O-CB 3.49Å; R114-K117 PolarHBondContact O-N 3.38Å; R114-D118 VanDerWaalsContact O-CG 3.28Å; R114-D118 PolarHBondContact O-N 2.85Å
115	K	78.6	Confident	75.2	Confident	142 Å²	142	101.3 Å²	101.3	62%	0.617	47%	0.469	S	S	*	.	H	α-helix	trans	-61.8	-43.9	177.3	-65.6	-170.9	176.6	-172.5	0	113.4	S113 K117 D118 E119	S113-K115 PolarHBondContact O-N 3.3Å; K115-K117 VanDerWaalsContact C-N 3.27Å; K115-K117 PolarHBondContact O-N 2.75Å; K115-D118 PolarHBondContact O-N 3.17Å; K115-E119 WeakPolarHBondContact O-CG 3.4Å; K115-E119 PolarHBondContact O-N 2.66Å
116	E	81.6	Confident	76.2	Confident	98 Å²	98	99.6 Å²	99.6	46%	0.458	45%	0.454	S	S	.	.	H	α-helix	trans	-66.9	-33	179.2	-66	172.5	138.5	0	0	111.5	M112 S113 R120	M112-E116 HydrophobicContact CG-CB 3.62Å; M112-E116 HydrophobicContact SD-CB 4.09Å; S113-E116 PolarHBondContact N-OE2 3.44Å; S113-E116 WeakPolarHBondContact O-CB 3.35Å; S113-E116 PolarHBondContact O-N 3.36Å; E116-R120 WeakPolarHBondContact O-CG 3.47Å; E116-R120 PolarHBondContact O-N 2.98Å; E116-R120 VanDerWaalsContact O-N 3.08Å
117	K	78.3	Confident	77.2	Confident	37 Å²	37	96.2 Å²	96.2	16%	0.161	44%	0.439	C	S	.	.	H	α-helix	trans	-67.2	-46.4	175.7	-172.7	176.6	177.2	173.7	0	111.2	T101 N109 M112 S113 R114 K115 E119 R120 I121	T101-K117 WeakPolarHBondContact OG1-CE 3.38Å; T101-K117 PolarHBondContact OG1-NZ 3.13Å; T101-K117 VanDerWaalsContact OG1-NZ 3.12Å; N109-K117 PolarHBondContact OD1-NZ 3.12Å; M112-K117 HydrophobicContact CG-CB 4.32Å; M112-K117 VanDerWaalsContact SD-CA 3.53Å; M112-K117 HydrophobicContact SD-CB 3.73Å; M112-K117 HydrophobicContact SD-CG 4.37Å; M112-K117 PolarHBondContact SD-N 3.34Å; S113-K117 PolarHBondContact O-N 3.46Å; R114-K117 WeakPolarHBondContact O-CB 3.49Å; R114-K117 PolarHBondContact O-N 3.38Å; K115-K117 VanDerWaalsContact C-N 3.27Å; K115-K117 PolarHBondContact O-N 2.75Å; K117-E119 VanDerWaalsContact C-N 3.34Å; K117-E119 PolarHBondContact O-N 2.93Å; K117-R120 PolarHBondContact O-N 3.45Å; K117-I121 HydrophobicContact CG-CD1 4.12Å; K117-I121 WeakPolarHBondContact O-CG1 3.35Å; K117-I121 PolarHBondContact O-N 3.32Å
118	D	82.9	Confident	78.4	Confident	100 Å²	100	95.1 Å²	95.1	54%	0.535	43%	0.426	S	S	.	.	H	α-helix	trans	-62.9	-41.3	178.1	-64	-23.6	0	0	0	111.1	R114 K115 R120 I121 L122	R114-D118 VanDerWaalsContact O-CG 3.28Å; R114-D118 PolarHBondContact O-N 2.85Å; K115-D118 PolarHBondContact O-N 3.17Å; D118-R120 PolarHBondContact O-N 3.36Å; D118-I121 PolarHBondContact O-N 3.39Å; D118-L122 WeakPolarHBondContact O-CB 3.29Å; D118-L122 PolarHBondContact O-N 2.91Å
119	E	82.8	Confident	79.5	Confident	95 Å²	95	91 Å²	91	44%	0.444	40%	0.404	S	S	.	.	H	α-helix	trans	-59.8	-43.1	174.1	-75.3	172.2	-163.6	0	0	111.8	K8 K115 K117 L122 W123	K8-E119 WeakPolarHBondContact CE-OE1 3.36Å; K8-E119 IonicContact NZ-OE1 2.66Å; K8-E119 PolarHBondContact NZ-OE1 2.85Å; K115-E119 WeakPolarHBondContact O-CG 3.4Å; K115-E119 PolarHBondContact O-N 2.66Å; K117-E119 VanDerWaalsContact C-N 3.34Å; K117-E119 PolarHBondContact O-N 2.93Å; E119-L122 PolarHBondContact O-N 3.01Å; E119-W123 WeakPolarHBondContact O-CB 3.46Å; E119-W123 PolarHBondContact O-N 3.46Å
120	R	81.9	Confident	80.8	Confident	152 Å²	152	90.3 Å²	90.3	57%	0.574	40%	0.4	S	S	*	.	H	α-helix	trans	-66.3	-40	176.1	-74.6	179.8	-173.1	-119.5	4	112.9	V100 E116 K117 D118 W123 K124	V100-R120 HydrophobicContact CG1-CB 4.48Å; E116-R120 WeakPolarHBondContact O-CG 3.47Å; E116-R120 PolarHBondContact O-N 2.98Å; E116-R120 VanDerWaalsContact O-N 3.08Å; K117-R120 PolarHBondContact O-N 3.45Å; D118-R120 PolarHBondContact O-N 3.36Å; R120-W123 PolarHBondContact O-N 3.12Å; R120-K124 WeakPolarHBondContact O-CB 3.18Å; R120-K124 PolarHBondContact O-N 3.03Å
121	I	81.7	Confident	81.9	Confident	20 Å²	20	87.6 Å²	87.6	10%	0.103	39%	0.391	C	S	.	.	H	α-helix	trans	-62.9	-47.1	176.2	-68.6	167	0	0	0	109.6	V100 K117 D118 W123 K124 K125	V100-I121 HydrophobicContact CB-CG1 3.82Å; V100-I121 HydrophobicContact CG1-CG1 3.73Å; V100-I121 HydrophobicContact CG2-CG1 4.15Å; K117-I121 HydrophobicContact CG-CD1 4.12Å; K117-I121 WeakPolarHBondContact O-CG1 3.35Å; K117-I121 PolarHBondContact O-N 3.32Å; D118-I121 PolarHBondContact O-N 3.39Å; I121-W123 PolarHBondContact O-N 3.43Å; I121-K124 PolarHBondContact O-N 2.84Å; I121-K125 VanDerWaalsContact O-CB 3.23Å; I121-K125 WeakPolarHBondContact O-CB 3.2Å; I121-K125 PolarHBondContact O-N 2.78Å
122	L	83.3	Confident	82.9	Confident	78 Å²	78	81.9 Å²	81.9	41%	0.408	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-44.9	177.8	-177	62.6	0	0	0	111.6	L15 D118 E119 K125 N126	L15-L122 HydrophobicContact CD2-CD2 3.85Å; L15-L122 HydrophobicContact CD2-CG 4.41Å; D118-L122 WeakPolarHBondContact O-CB 3.29Å; D118-L122 PolarHBondContact O-N 2.91Å; E119-L122 PolarHBondContact O-N 3.01Å; L122-K125 WeakPolarHBondContact O-CB 3.43Å; L122-K125 PolarHBondContact O-N 3.08Å; L122-N126 WeakPolarHBondContact O-CB 3.49Å; L122-N126 PolarHBondContact O-N 2.91Å
123	W	83.6	Confident	83.9	Confident	170 Å²	170	80.2 Å²	80.2	64%	0.644	36%	0.359	S	S	*	.	H	α-helix	trans	-63.9	-43.9	178.8	-148.5	92.8	0	0	0	111.7	E119 R120 I121 N126 E127	E119-W123 WeakPolarHBondContact O-CB 3.46Å; E119-W123 PolarHBondContact O-N 3.46Å; R120-W123 PolarHBondContact O-N 3.12Å; I121-W123 PolarHBondContact O-N 3.43Å; W123-N126 PolarHBondContact O-N 2.86Å; W123-E127 HydrophobicContact CZ3-CB 4.47Å; W123-E127 WeakPolarHBondContact CZ3-OE2 3.37Å; W123-E127 PolarHBondContact O-N 2.6Å
124	K	84.5	Confident	84.5	Confident	63 Å²	63	77.7 Å²	77.7	27%	0.274	34%	0.341	S	S	.	.	H	α-helix	trans	-67.4	-37.3	177.1	-169.4	62.8	-178.3	173.3	0	112.3	V96 V100 R120 I121 E127 V128	V96-K124 HydrophobicContact CG1-CB 3.82Å; V96-K124 HydrophobicContact CG1-CG 3.79Å; V100-K124 HydrophobicContact CG2-CB 4.16Å; V100-K124 HydrophobicContact CG2-CG 4.28Å; R120-K124 WeakPolarHBondContact O-CB 3.18Å; R120-K124 PolarHBondContact O-N 3.03Å; I121-K124 PolarHBondContact O-N 2.84Å; K124-E127 IonicContact NZ-OE1 3.73Å; K124-E127 PolarHBondContact NZ-OE1 2.97Å; K124-E127 PolarHBondContact O-N 2.95Å; K124-V128 HydrophobicContact CD-CG2 4.5Å; K124-V128 WeakPolarHBondContact O-CG2 3.34Å; K124-V128 PolarHBondContact O-N 2.84Å
125	K	84.5	Confident	85.2	Confident	29 Å²	29	70.7 Å²	70.7	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-60.7	-47.5	174.9	-177.9	-173.4	-172.3	178.8	0	110.4	A89 E93 V96 I121 L122 A129	A89-K125 HydrophobicContact CB-CG 4.47Å; A89-K125 WeakPolarHBondContact O-CE 3.14Å; E93-K125 IonicContact OE1-NZ 2.68Å; E93-K125 PolarHBondContact OE1-NZ 2.68Å; E93-K125 IonicContact OE2-NZ 2.7Å; E93-K125 PolarHBondContact OE2-NZ 2.6Å; V96-K125 HydrophobicContact CG1-CB 4.34Å; I121-K125 VanDerWaalsContact O-CB 3.23Å; I121-K125 WeakPolarHBondContact O-CB 3.2Å; I121-K125 PolarHBondContact O-N 2.78Å; L122-K125 WeakPolarHBondContact O-CB 3.43Å; L122-K125 PolarHBondContact O-N 3.08Å; K125-A129 WeakPolarHBondContact O-CB 3.16Å; K125-A129 PolarHBondContact O-N 2.7Å
126	N	86.7	Confident	85.9	Confident	32 Å²	32	68.6 Å²	68.6	17%	0.171	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-42.2	178.3	-165.7	12.5	0	0	0	111.7	K85 L122 W123 A129 D130	K85-N126 WeakPolarHBondContact CE-OD1 3.41Å; K85-N126 PolarHBondContact NZ-OD1 3.44Å; L122-N126 WeakPolarHBondContact O-CB 3.49Å; L122-N126 PolarHBondContact O-N 2.91Å; W123-N126 PolarHBondContact O-N 2.86Å; N126-A129 PolarHBondContact O-N 3.38Å; N126-D130 VanDerWaalsContact O-CB 3.26Å; N126-D130 WeakPolarHBondContact O-CB 3.33Å; N126-D130 PolarHBondContact O-N 2.83Å
127	E	86.2	Confident	86.4	Confident	89 Å²	89	64 Å²	64	42%	0.416	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-48.9	176.6	-175.6	-174.6	82.4	0	0	112.2	W123 K124 D130 Y131	W123-E127 HydrophobicContact CZ3-CB 4.47Å; W123-E127 WeakPolarHBondContact CZ3-OE2 3.37Å; W123-E127 PolarHBondContact O-N 2.6Å; K124-E127 IonicContact NZ-OE1 3.73Å; K124-E127 PolarHBondContact NZ-OE1 2.97Å; K124-E127 PolarHBondContact O-N 2.95Å; E127-D130 PolarHBondContact O-N 3.35Å; E127-Y131 WeakPolarHBondContact O-CB 3.33Å; E127-Y131 PolarHBondContact O-N 3.19Å
128	V	86.8	Confident	87.1	Confident	31 Å²	31	63.4 Å²	63.4	19%	0.188	29%	0.29	C	S	.	.	H	α-helix	trans	-65.1	-43.8	179.1	172.5	0	0	0	0	110.7	V96 K124 D130 Y131 E132	V96-V128 HydrophobicContact CG2-CG2 4.48Å; K124-V128 HydrophobicContact CD-CG2 4.5Å; K124-V128 WeakPolarHBondContact O-CG2 3.34Å; K124-V128 PolarHBondContact O-N 2.84Å; V128-D130 PolarHBondContact O-N 3.5Å; V128-Y131 PolarHBondContact O-N 3.39Å; V128-E132 HydrophobicContact CG1-CG 4.27Å; V128-E132 WeakPolarHBondContact O-CB 3.21Å; V128-E132 PolarHBondContact O-N 2.82Å
129	A	87.3	Confident	87.6	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-41.3	177.8	0	0	0	0	0	112	K85 V88 A89 K125 N126 A133	K85-A129 HydrophobicContact CG-CB 4.3Å; V88-A129 HydrophobicContact CG1-CB 4.15Å; A89-A129 HydrophobicContact CB-CB 3.94Å; K125-A129 WeakPolarHBondContact O-CB 3.16Å; K125-A129 PolarHBondContact O-N 2.7Å; N126-A129 PolarHBondContact O-N 3.38Å; A129-A133 WeakPolarHBondContact O-CB 3.17Å; A129-A133 PolarHBondContact O-N 2.84Å
130	D	87.8	Confident	88.1	Confident	45 Å²	45	65.6 Å²	65.6	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-43.5	177.3	-163.7	72.2	0	0	0	111.5	K81 N126 E127 V128 T134	K81-D130 WeakPolarHBondContact CE-OD1 3.49Å; K81-D130 IonicContact NZ-OD1 3.22Å; K81-D130 PolarHBondContact NZ-OD1 3.29Å; K81-D130 IonicContact NZ-OD2 3.41Å; K81-D130 PolarHBondContact NZ-OD2 3.06Å; K81-D130 VanDerWaalsContact NZ-OD2 3.08Å; N126-D130 VanDerWaalsContact O-CB 3.26Å; N126-D130 WeakPolarHBondContact O-CB 3.33Å; N126-D130 PolarHBondContact O-N 2.83Å; E127-D130 PolarHBondContact O-N 3.35Å; V128-D130 PolarHBondContact O-N 3.5Å; D130-T134 WeakPolarHBondContact O-CB 3.37Å; D130-T134 PolarHBondContact O-N 2.86Å; D130-T134 PolarHBondContact O-OG1 3.3Å
131	Y	88.2	Confident	88.7	Confident	168 Å²	168	58.4 Å²	58.4	66%	0.659	27%	0.265	S	S	*	.	H	α-helix	trans	-67.2	-50.4	178.9	-179.8	-98.9	0	0	0	112.8	E127 V128 T134 T135	E127-Y131 WeakPolarHBondContact O-CB 3.33Å; E127-Y131 PolarHBondContact O-N 3.19Å; V128-Y131 PolarHBondContact O-N 3.39Å; Y131-T134 PolarHBondContact O-N 3.48Å; Y131-T135 WeakPolarHBondContact O-CB 3.18Å; Y131-T135 PolarHBondContact O-N 3.35Å; Y131-T135 PolarHBondContact O-OG1 2.9Å
132	E	89.6	Confident	89.3	Confident	57 Å²	57	58.7 Å²	58.7	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-45.1	178.1	-75.3	-167.6	165.3	0	0	110.5	V88 R92 V128 T135 F136	V88-E132 HydrophobicContact CG1-CB 4Å; V88-E132 WeakPolarHBondContact CG1-OE2 3.26Å; R92-E132 IonicContact CZ-OE1 3.92Å; R92-E132 IonicContact CZ-OE2 2.82Å; R92-E132 IonicContact NE-OE1 2.74Å; R92-E132 PolarHBondContact NE-OE1 3.16Å; R92-E132 IonicContact NE-OE2 2.78Å; R92-E132 PolarHBondContact NE-OE2 3.33Å; R92-E132 VanDerWaalsContact NE-OE2 3.16Å; R92-E132 IonicContact NH2-OE1 3.16Å; R92-E132 PolarHBondContact NH2-OE1 3.29Å; R92-E132 IonicContact NH2-OE2 2.68Å; V128-E132 HydrophobicContact CG1-CG 4.27Å; V128-E132 WeakPolarHBondContact O-CB 3.21Å; V128-E132 PolarHBondContact O-N 2.82Å; E132-T135 PolarHBondContact O-N 2.76Å; E132-F136 VanDerWaalsContact O-CB 3.25Å; E132-F136 WeakPolarHBondContact O-CB 3.39Å; E132-F136 PolarHBondContact O-N 3.26Å
133	A	90.5	Very high	89.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-41.4	179	0	0	0	0	0	112.3	K81 L84 K85 A129 S137	K81-A133 HydrophobicContact CG-CB 4.14Å; L84-A133 HydrophobicContact CB-CB 4.26Å; K85-A133 HydrophobicContact CB-CB 4.04Å; A129-A133 WeakPolarHBondContact O-CB 3.17Å; A129-A133 PolarHBondContact O-N 2.84Å; A133-S137 WeakPolarHBondContact O-CB 3.48Å; A133-S137 PolarHBondContact O-N 3.16Å; A133-S137 PolarHBondContact O-OG 3.06Å
134	T	90.8	Very high	90.4	Very high	10 Å²	10	51.7 Å²	51.7	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-51.5	176	-60.2	0	0	0	0	110.6	F32 K81 D130 Y131 S137 I138	F32-T134 HydrophobicContact CD1-CG2 4.42Å; F32-T134 HydrophobicContact CE1-CG2 3.56Å; F32-T134 HydrophobicContact CZ-CG2 4.15Å; K81-T134 WeakPolarHBondContact CD-OG1 3.4Å; K81-T134 WeakPolarHBondContact CE-OG1 3.42Å; K81-T134 PolarHBondContact NZ-OG1 3.39Å; D130-T134 WeakPolarHBondContact O-CB 3.37Å; D130-T134 PolarHBondContact O-N 2.86Å; D130-T134 PolarHBondContact O-OG1 3.3Å; Y131-T134 PolarHBondContact O-N 3.48Å; T134-S137 PolarHBondContact O-N 3.42Å; T134-I138 HydrophobicContact CG2-CD1 4.13Å; T134-I138 WeakPolarHBondContact O-CG1 3.47Å; T134-I138 PolarHBondContact O-N 3.36Å; T134-I138 VanDerWaalsContact O-N 3.12Å
135	T	91.9	Very high	90.9	Very high	67 Å²	67	48.7 Å²	48.7	41%	0.411	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-47.6	-176.7	-55.5	0	0	0	0	111.4	Y131 E132 S137 I138 F139	Y131-T135 WeakPolarHBondContact O-CB 3.18Å; Y131-T135 PolarHBondContact O-N 3.35Å; Y131-T135 PolarHBondContact O-OG1 2.9Å; E132-T135 PolarHBondContact O-N 2.76Å; T135-S137 VanDerWaalsContact C-N 3.34Å; T135-S137 PolarHBondContact O-N 2.98Å; T135-I138 PolarHBondContact O-N 2.85Å; T135-F139 PolarHBondContact O-N 2.89Å
136	F	92.2	Very high	91.4	Very high	99 Å²	99	49.8 Å²	49.8	43%	0.434	24%	0.238	S	C	.	.	H	α-helix	trans	-64.4	-40.3	179.1	-170.8	-84.7	0	0	0	111.8	L84 E132 I138 F139 Y140	L84-F136 HydrophobicContact CD1-CD1 4.45Å; L84-F136 HydrophobicContact CD1-CE1 4.43Å; L84-F136 HydrophobicContact CD2-CB 3.61Å; L84-F136 HydrophobicContact CD2-CD1 3.15Å; L84-F136 HydrophobicContact CD2-CD2 4.49Å; L84-F136 HydrophobicContact CD2-CE1 3.89Å; L84-F136 HydrophobicContact CD2-CG 3.5Å; L84-F136 VanDerWaalsContact CD2-CG 3.5Å; L84-F136 HydrophobicContact CG-CD1 4.42Å; E132-F136 VanDerWaalsContact O-CB 3.25Å; E132-F136 WeakPolarHBondContact O-CB 3.39Å; E132-F136 PolarHBondContact O-N 3.26Å; F136-I138 VanDerWaalsContact C-N 3.33Å; F136-I138 PolarHBondContact O-N 2.82Å; F136-F139 PolarHBondContact O-N 3.43Å; F136-Y140 HydrophobicContact CE1-CD2 4.32Å; F136-Y140 HydrophobicContact CE1-CG 4.18Å; F136-Y140 VanDerWaalsContact O-CB 3.22Å; F136-Y140 WeakPolarHBondContact O-CB 3.34Å; F136-Y140 PolarHBondContact O-N 3.42Å
137	S	92.1	Very high	91.8	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-41	179.4	-60.7	0	0	0	0	112.1	Y77 K81 A133 T134 T135 N141	Y77-S137 WeakPolarHBondContact CD1-O 3.04Å; K81-S137 WeakPolarHBondContact CA-OG 3.48Å; K81-S137 WeakPolarHBondContact CB-OG 3.37Å; K81-S137 PolarHBondContact N-OG 3.07Å; A133-S137 WeakPolarHBondContact O-CB 3.48Å; A133-S137 PolarHBondContact O-N 3.16Å; A133-S137 PolarHBondContact O-OG 3.06Å; T134-S137 PolarHBondContact O-N 3.42Å; T135-S137 VanDerWaalsContact C-N 3.34Å; T135-S137 PolarHBondContact O-N 2.98Å; S137-N141 WeakPolarHBondContact O-CB 3.26Å; S137-N141 PolarHBondContact O-N 3.42Å; S137-N141 PolarHBondContact O-ND2 3.35Å
138	I	93.4	Very high	92.2	Very high	25 Å²	25	49.1 Å²	49.1	13%	0.128	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-52.8	175.3	-66.5	167.1	0	0	0	109.7	F32 N35 Y77 T134 T135 F136 Y140 N142	F32-I138 HydrophobicContact CD1-CD1 3.98Å; F32-I138 HydrophobicContact CD1-CG1 3.87Å; F32-I138 HydrophobicContact CE1-CD1 3.97Å; F32-I138 HydrophobicContact CE1-CG1 3.79Å; N35-I138 HydrophobicContact CB-CG2 4.17Å; Y77-I138 HydrophobicContact CD2-CG1 4.33Å; Y77-I138 HydrophobicContact CE2-CG1 4.34Å; T134-I138 HydrophobicContact CG2-CD1 4.13Å; T134-I138 WeakPolarHBondContact O-CG1 3.47Å; T134-I138 PolarHBondContact O-N 3.36Å; T134-I138 VanDerWaalsContact O-N 3.12Å; T135-I138 PolarHBondContact O-N 2.85Å; F136-I138 VanDerWaalsContact C-N 3.33Å; F136-I138 PolarHBondContact O-N 2.82Å; I138-Y140 PolarHBondContact O-N 2.68Å; I138-N142 WeakPolarHBondContact CG2-ND2 3.17Å; I138-N142 WeakPolarHBondContact O-CB 3.1Å; I138-N142 PolarHBondContact O-N 3.39Å; I138-N142 PolarHBondContact O-ND2 2.99Å
139	F	94.5	Very high	92.6	Very high	136 Å²	136	47.8 Å²	47.8	60%	0.596	23%	0.232	S	C	*	.	H	α-helix	trans	-60.7	-49.1	-176.4	176.4	-103.5	0	0	0	112.9	T135 F136 N142 T143	T135-F139 PolarHBondContact O-N 2.89Å; F136-F139 PolarHBondContact O-N 3.43Å; F139-N142 PolarHBondContact O-N 2.93Å; F139-T143 WeakPolarHBondContact O-CB 3.03Å; F139-T143 PolarHBondContact O-N 3.5Å; F139-T143 PolarHBondContact O-OG1 2.97Å
140	Y	93.1	Very high	92.9	Very high	106 Å²	106	51.3 Å²	51.3	42%	0.416	25%	0.25	S	S	.	.	H	α-helix	trans	-62.1	-51.3	-177	176.6	-100.3	0	0	0	111.7	F136 I138 N142 T143 L144	F136-Y140 HydrophobicContact CE1-CD2 4.32Å; F136-Y140 HydrophobicContact CE1-CG 4.18Å; F136-Y140 VanDerWaalsContact O-CB 3.22Å; F136-Y140 WeakPolarHBondContact O-CB 3.34Å; F136-Y140 PolarHBondContact O-N 3.42Å; I138-Y140 PolarHBondContact O-N 2.68Å; Y140-N142 PolarHBondContact O-N 3.39Å; Y140-T143 PolarHBondContact O-N 3.41Å; Y140-L144 HydrophobicContact CE1-CD2 4.28Å; Y140-L144 WeakPolarHBondContact O-CB 3.21Å; Y140-L144 PolarHBondContact O-N 3.45Å
141	N	94.1	Very high	93.2	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-68	-36.2	-179.6	-76.1	-74.5	0	0	0	112	A76 Y77 V80 S137 F145	A76-N141 WeakPolarHBondContact CB-OD1 3.36Å; Y77-N141 HydrophobicContact CD1-CB 3.45Å; Y77-N141 VanDerWaalsContact CD1-CB 3.45Å; Y77-N141 HydrophobicContact CE1-CB 3.44Å; Y77-N141 VanDerWaalsContact CE1-CB 3.44Å; V80-N141 VanDerWaalsContact CG2-ND2 3.34Å; V80-N141 WeakPolarHBondContact CG2-ND2 3.44Å; S137-N141 WeakPolarHBondContact O-CB 3.26Å; S137-N141 PolarHBondContact O-N 3.42Å; S137-N141 PolarHBondContact O-ND2 3.35Å; N141-F145 WeakPolarHBondContact O-CB 3.47Å; N141-F145 PolarHBondContact O-N 2.99Å
142	N	94.3	Very high	93.5	Very high	26 Å²	26	44.8 Å²	44.8	14%	0.139	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-46.7	176.1	-77.9	-8.8	0	0	0	112.7	V39 Y77 I138 F139 Y140 L144 F145 L146	V39-N142 WeakPolarHBondContact CG1-OD1 3.43Å; V39-N142 HydrophobicContact CG2-CB 4.29Å; Y77-N142 VanDerWaalsContact OH-CG 3.24Å; Y77-N142 PolarHBondContact OH-ND2 3.49Å; Y77-N142 PolarHBondContact OH-OD1 3.08Å; I138-N142 WeakPolarHBondContact CG2-ND2 3.17Å; I138-N142 WeakPolarHBondContact O-CB 3.1Å; I138-N142 PolarHBondContact O-N 3.39Å; I138-N142 PolarHBondContact O-ND2 2.99Å; F139-N142 PolarHBondContact O-N 2.93Å; Y140-N142 PolarHBondContact O-N 3.39Å; N142-L144 VanDerWaalsContact C-N 3.32Å; N142-L144 PolarHBondContact O-N 2.9Å; N142-F145 PolarHBondContact O-N 2.92Å; N142-L146 WeakPolarHBondContact O-CB 3.3Å; N142-L146 WeakPolarHBondContact O-CG 3.31Å; N142-L146 PolarHBondContact O-N 3.28Å
143	T	94.7	Very high	93.6	Very high	60 Å²	60	42 Å²	42	37%	0.368	22%	0.218	S	C	.	.	H	α-helix	trans	-60.4	-48.7	178.1	-56.9	0	0	0	0	109.6	F139 Y140 F145 L146 V147	F139-T143 WeakPolarHBondContact O-CB 3.03Å; F139-T143 PolarHBondContact O-N 3.5Å; F139-T143 PolarHBondContact O-OG1 2.97Å; Y140-T143 PolarHBondContact O-N 3.41Å; T143-F145 PolarHBondContact O-N 3.21Å; T143-L146 PolarHBondContact O-N 3.34Å; T143-V147 HydrophobicContact CG2-CG2 4.34Å; T143-V147 WeakPolarHBondContact O-CB 3.22Å; T143-V147 WeakPolarHBondContact O-CG2 3.02Å; T143-V147 PolarHBondContact O-N 2.82Å
144	L	94.4	Very high	93.6	Very high	41 Å²	41	45.3 Å²	45.3	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-44.8	179.3	-171.9	61	0	0	0	111.7	Y140 N142 V147 V148 I177 L180	Y140-L144 HydrophobicContact CE1-CD2 4.28Å; Y140-L144 WeakPolarHBondContact O-CB 3.21Å; Y140-L144 PolarHBondContact O-N 3.45Å; N142-L144 VanDerWaalsContact C-N 3.32Å; N142-L144 PolarHBondContact O-N 2.9Å; L144-V147 PolarHBondContact O-N 3.01Å; L144-V148 HydrophobicContact CD1-CG2 4.19Å; L144-V148 HydrophobicContact CG-CG2 4.46Å; L144-V148 WeakPolarHBondContact O-CB 3.06Å; L144-V148 WeakPolarHBondContact O-CG2 3.25Å; L144-V148 PolarHBondContact O-N 3.16Å; L144-I177 HydrophobicContact CB-CG2 4.18Å; L144-I177 HydrophobicContact CD2-CG2 3.87Å; L144-I177 HydrophobicContact CG-CG2 3.86Å; L144-L180 HydrophobicContact CD2-CD1 3.84Å
145	F	95.9	Very high	93.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-53.4	176.6	176.3	-103	0	0	0	111.8	V39 P43 V73 N141 N142 T143 V147 V148 V149 I170 I177	V39-F145 HydrophobicContact CG2-CD1 3.91Å; V39-F145 HydrophobicContact CG2-CE1 4.36Å; P43-F145 HydrophobicContact CG-CE1 3.98Å; P43-F145 HydrophobicContact CG-CZ 4.25Å; V73-F145 HydrophobicContact CG2-CD2 4.12Å; V73-F145 HydrophobicContact CG2-CE2 4.3Å; V73-F145 HydrophobicContact CG2-CG 4.45Å; N141-F145 WeakPolarHBondContact O-CB 3.47Å; N141-F145 PolarHBondContact O-N 2.99Å; N142-F145 PolarHBondContact O-N 2.92Å; T143-F145 PolarHBondContact O-N 3.21Å; F145-V147 PolarHBondContact O-N 3.35Å; F145-V148 PolarHBondContact O-N 2.92Å; F145-V149 HydrophobicContact CD1-CG2 4.32Å; F145-V149 HydrophobicContact CD2-CG2 4.24Å; F145-V149 HydrophobicContact CE1-CG2 3.98Å; F145-V149 HydrophobicContact CE2-CG2 3.88Å; F145-V149 HydrophobicContact CG-CG2 4.46Å; F145-V149 HydrophobicContact CZ-CG2 3.75Å; F145-V149 WeakPolarHBondContact O-CB 3.25Å; F145-V149 VanDerWaalsContact O-CG2 3.29Å; F145-V149 WeakPolarHBondContact O-CG2 3.41Å; F145-V149 PolarHBondContact O-N 2.82Å; F145-I170 HydrophobicContact CZ-CD1 4.12Å; F145-I177 HydrophobicContact CB-CD1 4.1Å; F145-I177 HydrophobicContact CB-CG2 4.42Å; F145-I177 HydrophobicContact CD2-CD1 3.98Å; F145-I177 HydrophobicContact CG-CD1 4.41Å
146	L	94.6	Very high	93.6	Very high	51 Å²	51	54.5 Å²	54.5	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-64.1	-41	-177.7	-69.3	174.2	0	0	0	112	V39 I42 N142 T143 V149 I150	V39-L146 HydrophobicContact CG2-CD1 4.21Å; V39-L146 HydrophobicContact CG2-CD2 4.02Å; V39-L146 HydrophobicContact CG2-CG 3.98Å; I42-L146 HydrophobicContact CB-CD2 4.38Å; I42-L146 HydrophobicContact CD1-CD2 4.41Å; I42-L146 HydrophobicContact CG2-CD2 4.13Å; N142-L146 WeakPolarHBondContact O-CB 3.3Å; N142-L146 WeakPolarHBondContact O-CG 3.31Å; N142-L146 PolarHBondContact O-N 3.28Å; T143-L146 PolarHBondContact O-N 3.34Å; L146-V149 PolarHBondContact O-N 2.81Å; L146-I150 WeakPolarHBondContact O-CB 3.43Å; L146-I150 WeakPolarHBondContact O-CD1 3.39Å; L146-I150 VanDerWaalsContact O-CG1 3.23Å; L146-I150 WeakPolarHBondContact O-CG1 3.18Å; L146-I150 PolarHBondContact O-N 3.22Å
147	V	95.5	Very high	93.5	Very high	78 Å²	78	50.7 Å²	50.7	47%	0.473	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-48.2	176.4	169.1	0	0	0	0	110.6	T143 L144 F145 V149 I150 V151	T143-V147 HydrophobicContact CG2-CG2 4.34Å; T143-V147 WeakPolarHBondContact O-CB 3.22Å; T143-V147 WeakPolarHBondContact O-CG2 3.02Å; T143-V147 PolarHBondContact O-N 2.82Å; L144-V147 PolarHBondContact O-N 3.01Å; F145-V147 PolarHBondContact O-N 3.35Å; V147-V149 PolarHBondContact O-N 2.83Å; V147-I150 PolarHBondContact O-N 3.46Å; V147-V151 HydrophobicContact CG1-CG2 4.38Å; V147-V151 WeakPolarHBondContact O-CB 3.23Å; V147-V151 VanDerWaalsContact O-CG2 3.29Å; V147-V151 WeakPolarHBondContact O-CG2 3.11Å; V147-V151 PolarHBondContact O-N 2.82Å
148	V	94.8	Very high	93.3	Very high	30 Å²	30	55.9 Å²	55.9	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-39.8	-179.9	-178.5	0	0	0	0	110.7	L144 F145 I150 V151 A152 S173 L176	L144-V148 HydrophobicContact CD1-CG2 4.19Å; L144-V148 HydrophobicContact CG-CG2 4.46Å; L144-V148 WeakPolarHBondContact O-CB 3.06Å; L144-V148 WeakPolarHBondContact O-CG2 3.25Å; L144-V148 PolarHBondContact O-N 3.16Å; F145-V148 PolarHBondContact O-N 2.92Å; V148-I150 PolarHBondContact O-N 2.94Å; V148-V151 PolarHBondContact O-N 3.45Å; V148-A152 WeakPolarHBondContact O-CB 3.35Å; V148-A152 PolarHBondContact O-N 3.12Å; V148-S173 VanDerWaalsContact CG1-OG 3.29Å; V148-S173 WeakPolarHBondContact CG1-OG 3.46Å; V148-L176 HydrophobicContact CG1-CD2 4.17Å; V148-L176 HydrophobicContact CG2-CD2 4.1Å
149	V	94.9	Very high	93	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-49.2	175.5	168.8	0	0	0	0	110.2	P43 F145 L146 V147 A152 S153 I170 S173	P43-V149 HydrophobicContact CB-CG1 4.2Å; P43-V149 HydrophobicContact CG-CG1 4.12Å; F145-V149 HydrophobicContact CD1-CG2 4.32Å; F145-V149 HydrophobicContact CD2-CG2 4.24Å; F145-V149 HydrophobicContact CE1-CG2 3.98Å; F145-V149 HydrophobicContact CE2-CG2 3.88Å; F145-V149 HydrophobicContact CG-CG2 4.46Å; F145-V149 HydrophobicContact CZ-CG2 3.75Å; F145-V149 WeakPolarHBondContact O-CB 3.25Å; F145-V149 VanDerWaalsContact O-CG2 3.29Å; F145-V149 WeakPolarHBondContact O-CG2 3.41Å; F145-V149 PolarHBondContact O-N 2.82Å; L146-V149 PolarHBondContact O-N 2.81Å; V147-V149 PolarHBondContact O-N 2.83Å; V149-A152 PolarHBondContact O-N 2.89Å; V149-S153 WeakPolarHBondContact O-CB 3.26Å; V149-S153 PolarHBondContact O-N 2.84Å; V149-S153 PolarHBondContact O-OG 3.24Å; V149-I170 HydrophobicContact CG1-CD1 4.45Å; V149-I170 HydrophobicContact CG2-CD1 4.1Å; V149-S173 WeakPolarHBondContact CA-OG 3.11Å; V149-S173 WeakPolarHBondContact CG2-OG 3.35Å; V149-S173 PolarHBondContact N-OG 2.8Å; V149-S173 VanDerWaalsContact N-OG 3.08Å
150	I	93.7	Very high	92.8	Very high	75 Å²	75	60.3 Å²	60.3	39%	0.385	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-48.8	-180	-69.3	166	0	0	0	110.2	L46 L146 V147 V148 A152 S153 F154	L46-I150 HydrophobicContact CD1-CG1 4.3Å; L146-I150 WeakPolarHBondContact O-CB 3.43Å; L146-I150 WeakPolarHBondContact O-CD1 3.39Å; L146-I150 VanDerWaalsContact O-CG1 3.23Å; L146-I150 WeakPolarHBondContact O-CG1 3.18Å; L146-I150 PolarHBondContact O-N 3.22Å; V147-I150 PolarHBondContact O-N 3.46Å; V148-I150 PolarHBondContact O-N 2.94Å; I150-A152 PolarHBondContact O-N 3.46Å; I150-S153 PolarHBondContact O-N 2.92Å; I150-F154 HydrophobicContact CB-CD2 4.43Å; I150-F154 HydrophobicContact CG2-CD2 3.83Å; I150-F154 HydrophobicContact CG2-CE2 4.17Å; I150-F154 VanDerWaalsContact O-CD2 3.27Å; I150-F154 WeakPolarHBondContact O-CD2 3.38Å; I150-F154 PolarHBondContact O-N 3.43Å
151	V	94.8	Very high	92.6	Very high	68 Å²	68	59.9 Å²	59.9	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-46.6	-179.8	172.8	0	0	0	0	111.1	V147 V148 F155 I156	V147-V151 HydrophobicContact CG1-CG2 4.38Å; V147-V151 WeakPolarHBondContact O-CB 3.23Å; V147-V151 VanDerWaalsContact O-CG2 3.29Å; V147-V151 WeakPolarHBondContact O-CG2 3.11Å; V147-V151 PolarHBondContact O-N 2.82Å; V148-V151 PolarHBondContact O-N 3.45Å; V151-F155 WeakPolarHBondContact O-CB 3.25Å; V151-F155 PolarHBondContact O-N 3.33Å; V151-I156 HydrophobicContact CG1-CD1 4.38Å; V151-I156 PolarHBondContact O-N 3.32Å
152	A	93.5	Very high	92.4	Very high	8 Å²	8	61.6 Å²	61.6	7%	0.066	32%	0.318	C	S	.	.	I	π-helix	trans	-62.2	-45.2	177.8	0	0	0	0	0	111.7	V148 V149 I150 I156 L157	V148-A152 WeakPolarHBondContact O-CB 3.35Å; V148-A152 PolarHBondContact O-N 3.12Å; V149-A152 PolarHBondContact O-N 2.89Å; I150-A152 PolarHBondContact O-N 3.46Å; A152-I156 PolarHBondContact O-N 3.16Å; A152-L157 WeakPolarHBondContact O-CB 3.46Å; A152-L157 PolarHBondContact O-N 2.74Å
153	S	91.9	Very high	92.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	I	π-helix	trans	-66.9	-49.9	-175.4	-53.5	0	0	0	0	112.4	Y47 W51 V149 I150 N165 S169	Y47-S153 PolarHBondContact OH-OG 3.45Å; W51-S153 WeakPolarHBondContact CZ2-O 3.2Å; V149-S153 WeakPolarHBondContact O-CB 3.26Å; V149-S153 PolarHBondContact O-N 2.84Å; V149-S153 PolarHBondContact O-OG 3.24Å; I150-S153 PolarHBondContact O-N 2.92Å; S153-N165 WeakPolarHBondContact CA-OD1 3.23Å; S153-N165 PolarHBondContact O-ND2 2.66Å; S153-S169 PolarHBondContact N-OG 3.42Å; S153-S169 PolarHBondContact OG-OG 3.08Å
154	F	91.3	Very high	92.1	Very high	68 Å²	68	62.5 Å²	62.5	30%	0.298	32%	0.324	S	S	.	.	I	π-helix	trans	-94.2	-25.5	-168.6	-69.7	-88.3	0	0	0	114.5	L46 I50 I150 K158	L46-F154 HydrophobicContact CD1-CE2 3.85Å; L46-F154 HydrophobicContact CD1-CZ 4.29Å; L46-F154 HydrophobicContact CD2-CE2 3.78Å; L46-F154 HydrophobicContact CD2-CZ 3.81Å; L46-F154 HydrophobicContact CG-CE2 4.19Å; L46-F154 HydrophobicContact CG-CZ 4.19Å; I50-F154 HydrophobicContact CD1-CE1 3.9Å; I50-F154 HydrophobicContact CD1-CZ 3.45Å; I50-F154 VanDerWaalsContact CD1-CZ 3.45Å; I50-F154 HydrophobicContact CG2-CE1 3.8Å; I50-F154 HydrophobicContact CG2-CZ 4.29Å; I150-F154 HydrophobicContact CB-CD2 4.43Å; I150-F154 HydrophobicContact CG2-CD2 3.83Å; I150-F154 HydrophobicContact CG2-CE2 4.17Å; I150-F154 VanDerWaalsContact O-CD2 3.27Å; I150-F154 WeakPolarHBondContact O-CD2 3.38Å; I150-F154 PolarHBondContact O-N 3.43Å; F154-K158 WeakPolarHBondContact O-CB 3.25Å
155	F	91.5	Very high	92	Very high	153 Å²	153	60.6 Å²	60.6	67%	0.671	31%	0.314	S	S	*	.	I	π-helix	trans	-109.7	-43.6	-174.1	-64.5	-89.6	0	0	0	112.3	V151	V151-F155 WeakPolarHBondContact O-CB 3.25Å; V151-F155 PolarHBondContact O-N 3.33Å
156	I	90.9	Very high	91.9	Very high	117 Å²	117	60.6 Å²	60.6	60%	0.6	31%	0.314	S	S	*	.	I	π-helix	trans	-86.3	-51.8	-175	-54.4	179.3	0	0	0	110.8	V151 A152	V151-I156 HydrophobicContact CG1-CD1 4.38Å; V151-I156 PolarHBondContact O-N 3.32Å; A152-I156 PolarHBondContact O-N 3.16Å
157	L	89.7	Confident	91.8	Very high	19 Å²	19	61.1 Å²	61.1	10%	0.099	32%	0.316	C	S	.	.	S	Bend	trans	-101.5	13.2	-169.2	-63.8	167.1	0	0	0	113.4	A152 N159 F160 N165 L168 S169	A152-L157 WeakPolarHBondContact O-CB 3.46Å; A152-L157 PolarHBondContact O-N 2.74Å; L157-N159 PolarHBondContact O-N 3.49Å; L157-N159 VanDerWaalsContact O-N 3.07Å; L157-F160 HydrophobicContact CB-CD2 4.31Å; L157-F160 HydrophobicContact CD2-CD1 4.44Å; L157-F160 HydrophobicContact CD2-CD2 3.82Å; L157-F160 HydrophobicContact CD2-CE2 3.98Å; L157-F160 HydrophobicContact CD2-CG 4.06Å; L157-F160 HydrophobicContact CD2-CZ 4.37Å; L157-F160 WeakPolarHBondContact O-CB 3.48Å; L157-F160 PolarHBondContact O-N 2.99Å; L157-N165 HydrophobicContact CB-CB 4.1Å; L157-N165 VanDerWaalsContact CB-ND2 3.34Å; L157-N165 WeakPolarHBondContact CB-ND2 3.38Å; L157-N165 PolarHBondContact O-ND2 2.94Å; L157-L168 HydrophobicContact CD1-CB 3.61Å; L157-L168 HydrophobicContact CD1-CD1 4.39Å; L157-L168 HydrophobicContact CD2-CD1 4.01Å; L157-S169 WeakPolarHBondContact CD1-OG 3.48Å
158	K	87.8	Confident	91.8	Very high	110 Å²	110	61.2 Å²	61.2	48%	0.478	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.3	-172	69.5	175	-172.2	177.2	0	115.4	W51 F154	W51-K158 VanDerWaalsContact CH2-CA 3.49Å; W51-K158 HydrophobicContact CH2-CB 4.01Å; W51-K158 WeakPolarHBondContact CH2-O 3.25Å; W51-K158 HydrophobicContact CZ2-CB 4.43Å; W51-K158 VanDerWaalsContact CZ3-O 3.32Å; W51-K158 WeakPolarHBondContact CZ3-O 3.26Å; F154-K158 WeakPolarHBondContact O-CB 3.25Å
159	N	88.4	Confident	91.8	Very high	144 Å²	144	59.8 Å²	59.8	77%	0.77	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-0.9	-178.4	-63.2	-33.7	0	0	0	112.5	L157	L157-N159 PolarHBondContact O-N 3.49Å; L157-N159 VanDerWaalsContact O-N 3.07Å
160	F	88.4	Confident	91.8	Very high	110 Å²	110	59.8 Å²	59.8	48%	0.482	31%	0.305	S	S	.	.	S	Bend	trans	-85.4	161.8	179.6	-73	-106	0	0	0	110.7	L157 V164	L157-F160 HydrophobicContact CB-CD2 4.31Å; L157-F160 HydrophobicContact CD2-CD1 4.44Å; L157-F160 HydrophobicContact CD2-CD2 3.82Å; L157-F160 HydrophobicContact CD2-CE2 3.98Å; L157-F160 HydrophobicContact CD2-CG 4.06Å; L157-F160 HydrophobicContact CD2-CZ 4.37Å; L157-F160 WeakPolarHBondContact O-CB 3.48Å; L157-F160 PolarHBondContact O-N 2.99Å; F160-V164 HydrophobicContact CD1-CG1 4.25Å
161	N	90.7	Very high	91.8	Very high	96 Å²	96	58.6 Å²	58.6	51%	0.513	30%	0.304	S	S	.	.			trans	-53.3	133.4	170.7	-177.9	-57.9	0	0	0	109.7	T163 V164 N165	N161-T163 PolarHBondContact O-N 2.88Å; N161-T163 VanDerWaalsContact O-N 3.07Å; N161-T163 VanDerWaalsContact OD1-CB 3.3Å; N161-T163 WeakPolarHBondContact OD1-CB 3.49Å; N161-T163 PolarHBondContact OD1-N 2.78Å; N161-T163 PolarHBondContact OD1-OG1 3.16Å; N161-V164 HydrophobicContact CB-CB 4.37Å; N161-V164 HydrophobicContact CB-CG2 4.16Å; N161-V164 PolarHBondContact O-N 3.16Å; N161-N165 WeakPolarHBondContact O-CB 3.38Å; N161-N165 PolarHBondContact O-N 3.36Å
162	P	89.6	Confident	91.7	Very high	37 Å²	37	58 Å²	58	24%	0.24	31%	0.306	C	S	.	.	H	α-helix	trans	-48	-37	178.6	-33.9	38.6	0	0	0	115.1	W51 M53 N165 Y166	W51-P162 HydrophobicContact CB-CB 4.07Å; W51-P162 HydrophobicContact CB-CG 4.4Å; W51-P162 HydrophobicContact CE3-CG 4.18Å; M53-P162 HydrophobicContact CG-CB 3.39Å; M53-P162 HydrophobicContact SD-CB 3.6Å; P162-N165 PolarHBondContact O-N 3.1Å; P162-Y166 WeakPolarHBondContact O-CB 3.38Å; P162-Y166 PolarHBondContact O-N 3.49Å
163	T	90.3	Very high	91.8	Very high	46 Å²	46	57.7 Å²	57.7	28%	0.282	30%	0.303	S	S	.	.	H	α-helix	trans	-67	-46.9	178.5	-52.7	0	0	0	0	111.2	M53 L61 N161 Y166 I167	M53-T163 PolarHBondContact SD-N 3.22Å; M53-T163 PolarHBondContact SD-OG1 3.44Å; L61-T163 HydrophobicContact CD1-CG2 3.56Å; N161-T163 PolarHBondContact O-N 2.88Å; N161-T163 VanDerWaalsContact O-N 3.07Å; N161-T163 VanDerWaalsContact OD1-CB 3.3Å; N161-T163 WeakPolarHBondContact OD1-CB 3.49Å; N161-T163 PolarHBondContact OD1-N 2.78Å; N161-T163 PolarHBondContact OD1-OG1 3.16Å; T163-Y166 PolarHBondContact O-N 2.82Å; T163-I167 HydrophobicContact CG2-CD1 4.23Å; T163-I167 WeakPolarHBondContact O-CG1 3.33Å; T163-I167 PolarHBondContact O-N 3.3Å
164	V	92	Very high	91.9	Very high	60 Å²	60	57.7 Å²	57.7	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-66.6	-41.9	177.8	176	0	0	0	0	110.1	F160 N161 Y166 I167 L168	F160-V164 HydrophobicContact CD1-CG1 4.25Å; N161-V164 HydrophobicContact CB-CB 4.37Å; N161-V164 HydrophobicContact CB-CG2 4.16Å; N161-V164 PolarHBondContact O-N 3.16Å; V164-Y166 VanDerWaalsContact C-N 3.32Å; V164-Y166 PolarHBondContact O-N 3.28Å; V164-I167 PolarHBondContact O-N 3.19Å; V164-L168 HydrophobicContact CG1-CD1 3.65Å; V164-L168 HydrophobicContact CG1-CG 4.17Å; V164-L168 WeakPolarHBondContact O-CB 3.34Å; V164-L168 WeakPolarHBondContact O-CG 3.38Å; V164-L168 PolarHBondContact O-N 2.95Å
165	N	92.9	Very high	92.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.2	-46.2	175.2	-177.1	-42.2	0	0	0	110.7	Y47 S153 L157 N161 P162 S169	Y47-N165 HydrophobicContact CE1-CB 4.14Å; Y47-N165 VanDerWaalsContact CE1-OD1 3.29Å; Y47-N165 WeakPolarHBondContact CE1-OD1 3.42Å; Y47-N165 VanDerWaalsContact CZ-OD1 3.27Å; Y47-N165 PolarHBondContact OH-O 3.33Å; Y47-N165 VanDerWaalsContact OH-O 3.13Å; Y47-N165 PolarHBondContact OH-OD1 2.82Å; S153-N165 WeakPolarHBondContact CA-OD1 3.23Å; S153-N165 PolarHBondContact O-ND2 2.66Å; L157-N165 HydrophobicContact CB-CB 4.1Å; L157-N165 VanDerWaalsContact CB-ND2 3.34Å; L157-N165 WeakPolarHBondContact CB-ND2 3.38Å; L157-N165 PolarHBondContact O-ND2 2.94Å; N161-N165 WeakPolarHBondContact O-CB 3.38Å; N161-N165 PolarHBondContact O-N 3.36Å; P162-N165 PolarHBondContact O-N 3.1Å; N165-S169 WeakPolarHBondContact O-CB 3.39Å; N165-S169 PolarHBondContact O-N 2.92Å; N165-S169 PolarHBondContact O-OG 3.43Å; N165-S169 PolarHBondContact OD1-OG 3.42Å
166	Y	92.7	Very high	92.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-52.8	177.3	-179.6	-101.8	0	0	0	112.7	P43 Y47 M53 L61 Y62 M65 P162 T163 V164 L168 S169 I170	P43-Y166 HydrophobicContact CB-CE2 4.3Å; Y47-Y166 HydrophobicContact CD1-CD2 4.09Å; Y47-Y166 HydrophobicContact CD1-CG 4.39Å; Y47-Y166 AromaticContact CD2-CD2 3.49Å; Y47-Y166 HydrophobicContact CD2-CD2 3.49Å; Y47-Y166 VanDerWaalsContact CD2-CD2 3.49Å; Y47-Y166 HydrophobicContact CD2-CE2 4.18Å; Y47-Y166 VanDerWaalsContact CE1-CA 3.46Å; Y47-Y166 HydrophobicContact CE1-CD2 4.24Å; Y47-Y166 HydrophobicContact CE1-CG 4.44Å; Y47-Y166 AromaticContact CE2-CD2 3.63Å; Y47-Y166 HydrophobicContact CE2-CD2 3.63Å; Y47-Y166 HydrophobicContact CE2-CE2 4.45Å; Y47-Y166 AromaticContact CG-CD2 3.67Å; Y47-Y166 HydrophobicContact CG-CD2 3.67Å; Y47-Y166 HydrophobicContact CG-CG 4.38Å; Y47-Y166 VanDerWaalsContact CZ-CA 3.47Å; Y47-Y166 AromaticContact CZ-CD2 3.99Å; Y47-Y166 WeakPolarHBondContact OH-CA 3.15Å; M53-Y166 HydrophobicContact CE-CG 4.47Å; L61-Y166 HydrophobicContact CD2-CD1 3.45Å; L61-Y166 VanDerWaalsContact CD2-CD1 3.45Å; L61-Y166 HydrophobicContact CD2-CE1 3.68Å; L61-Y166 HydrophobicContact CD2-CG 4.5Å; Y62-Y166 HydrophobicContact CD1-CD1 4.35Å; Y62-Y166 AromaticContact CD1-CE1 3.67Å; Y62-Y166 HydrophobicContact CD1-CE1 3.67Å; Y62-Y166 HydrophobicContact CD1-CE2 4.01Å; Y62-Y166 AromaticContact CD1-CZ 3.49Å; Y62-Y166 VanDerWaalsContact CD1-CZ 3.49Å; Y62-Y166 HydrophobicContact CE1-CD1 4.33Å; Y62-Y166 HydrophobicContact CE1-CD2 4.18Å; Y62-Y166 HydrophobicContact CE1-CE1 4.06Å; Y62-Y166 AromaticContact CE1-CE2 3.95Å; Y62-Y166 HydrophobicContact CE1-CE2 3.95Å; Y62-Y166 HydrophobicContact CE1-CG 4.36Å; Y62-Y166 AromaticContact CE1-CZ 3.89Å; M65-Y166 HydrophobicContact CB-CE1 3.57Å; M65-Y166 HydrophobicContact CG-CD1 4.3Å; M65-Y166 HydrophobicContact CG-CE1 3.75Å; P162-Y166 WeakPolarHBondContact O-CB 3.38Å; P162-Y166 PolarHBondContact O-N 3.49Å; T163-Y166 PolarHBondContact O-N 2.82Å; V164-Y166 VanDerWaalsContact C-N 3.32Å; V164-Y166 PolarHBondContact O-N 3.28Å; Y166-L168 VanDerWaalsContact C-N 3.32Å; Y166-L168 PolarHBondContact O-N 2.97Å; Y166-S169 PolarHBondContact O-N 2.9Å; Y166-I170 HydrophobicContact CD2-CG1 3.9Å; Y166-I170 HydrophobicContact CE1-CG1 4.35Å; Y166-I170 HydrophobicContact CE2-CD1 4.05Å; Y166-I170 HydrophobicContact CE2-CG1 3.63Å; Y166-I170 HydrophobicContact CG-CG1 4.36Å; Y166-I170 WeakPolarHBondContact O-CB 3.37Å; Y166-I170 VanDerWaalsContact O-CG1 3.23Å; Y166-I170 WeakPolarHBondContact O-CG1 3.43Å; Y166-I170 PolarHBondContact O-N 2.92Å
167	I	93.6	Very high	92.3	Very high	62 Å²	62	46.2 Å²	46.2	32%	0.318	26%	0.258	S	S	.	.	H	α-helix	trans	-58	-48.6	-178.3	-65.8	169	0	0	0	110.3	L61 M65 T163 V164 S171	L61-I167 HydrophobicContact CD1-CD1 3.78Å; L61-I167 HydrophobicContact CD1-CG1 4Å; L61-I167 HydrophobicContact CG-CG1 4.49Å; M65-I167 HydrophobicContact CE-CB 4.23Å; M65-I167 HydrophobicContact CE-CG2 3.98Å; M65-I167 VanDerWaalsContact CE-O 3.31Å; M65-I167 WeakPolarHBondContact CE-O 3.22Å; M65-I167 HydrophobicContact SD-CG2 4.38Å; T163-I167 HydrophobicContact CG2-CD1 4.23Å; T163-I167 WeakPolarHBondContact O-CG1 3.33Å; T163-I167 PolarHBondContact O-N 3.3Å; V164-I167 PolarHBondContact O-N 3.19Å; I167-S171 WeakPolarHBondContact O-CB 3.49Å; I167-S171 PolarHBondContact O-N 3.4Å; I167-S171 PolarHBondContact O-OG 3.05Å
168	L	93.9	Very high	92.5	Very high	81 Å²	81	45.8 Å²	45.8	42%	0.424	26%	0.257	S	S	.	.	H	α-helix	trans	-69.4	-44.4	-177.5	-69.1	179.5	0	0	0	111.9	L157 V164 Y166 I170 S171 A172	L157-L168 HydrophobicContact CD1-CB 3.61Å; L157-L168 HydrophobicContact CD1-CD1 4.39Å; L157-L168 HydrophobicContact CD2-CD1 4.01Å; V164-L168 HydrophobicContact CG1-CD1 3.65Å; V164-L168 HydrophobicContact CG1-CG 4.17Å; V164-L168 WeakPolarHBondContact O-CB 3.34Å; V164-L168 WeakPolarHBondContact O-CG 3.38Å; V164-L168 PolarHBondContact O-N 2.95Å; Y166-L168 VanDerWaalsContact C-N 3.32Å; Y166-L168 PolarHBondContact O-N 2.97Å; L168-I170 PolarHBondContact O-N 3.28Å; L168-S171 PolarHBondContact O-N 3.36Å; L168-A172 WeakPolarHBondContact O-CA 3.35Å; L168-A172 WeakPolarHBondContact O-CB 3.36Å; L168-A172 PolarHBondContact O-N 3.45Å
169	S	94.6	Very high	92.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-43.5	179.9	-60.6	0	0	0	0	111.7	Y47 S153 L157 N165 Y166 S173	Y47-S169 WeakPolarHBondContact OH-CB 3.49Å; Y47-S169 PolarHBondContact OH-OG 2.6Å; Y47-S169 VanDerWaalsContact OH-OG 3.1Å; S153-S169 PolarHBondContact N-OG 3.42Å; S153-S169 PolarHBondContact OG-OG 3.08Å; L157-S169 WeakPolarHBondContact CD1-OG 3.48Å; N165-S169 WeakPolarHBondContact O-CB 3.39Å; N165-S169 PolarHBondContact O-N 2.92Å; N165-S169 PolarHBondContact O-OG 3.43Å; N165-S169 PolarHBondContact OD1-OG 3.42Å; Y166-S169 PolarHBondContact O-N 2.9Å; S169-S173 WeakPolarHBondContact O-CB 2.88Å; S169-S173 PolarHBondContact O-N 3.4Å; S169-S173 PolarHBondContact O-OG 3.33Å
170	I	94.9	Very high	92.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-69.7	-46.6	179.3	-62	-64.2	0	0	0	111.1	P43 M65 F145 V149 Y166 L168 S173 S174	P43-I170 HydrophobicContact CB-CD1 3.45Å; P43-I170 VanDerWaalsContact CB-CD1 3.45Å; P43-I170 HydrophobicContact CG-CD1 3.56Å; M65-I170 HydrophobicContact CB-CG2 4.44Å; M65-I170 HydrophobicContact CE-CB 3.92Å; M65-I170 HydrophobicContact CE-CG2 3.99Å; F145-I170 HydrophobicContact CZ-CD1 4.12Å; V149-I170 HydrophobicContact CG1-CD1 4.45Å; V149-I170 HydrophobicContact CG2-CD1 4.1Å; Y166-I170 HydrophobicContact CD2-CG1 3.9Å; Y166-I170 HydrophobicContact CE1-CG1 4.35Å; Y166-I170 HydrophobicContact CE2-CD1 4.05Å; Y166-I170 HydrophobicContact CE2-CG1 3.63Å; Y166-I170 HydrophobicContact CG-CG1 4.36Å; Y166-I170 WeakPolarHBondContact O-CB 3.37Å; Y166-I170 VanDerWaalsContact O-CG1 3.23Å; Y166-I170 WeakPolarHBondContact O-CG1 3.43Å; Y166-I170 PolarHBondContact O-N 2.92Å; L168-I170 PolarHBondContact O-N 3.28Å; I170-S173 PolarHBondContact O-N 3.2Å; I170-S174 VanDerWaalsContact O-CB 3.28Å; I170-S174 WeakPolarHBondContact O-CB 3.5Å; I170-S174 PolarHBondContact O-N 2.91Å; I170-S174 PolarHBondContact O-OG 3.11Å
171	S	94.2	Very high	92.8	Very high	51 Å²	51	39 Å²	39	36%	0.357	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-44.6	179.3	-59.3	0	0	0	0	111.7	M65 I167 L168 S174 G175	M65-S171 WeakPolarHBondContact CE-OG 3.47Å; I167-S171 WeakPolarHBondContact O-CB 3.49Å; I167-S171 PolarHBondContact O-N 3.4Å; I167-S171 PolarHBondContact O-OG 3.05Å; L168-S171 PolarHBondContact O-N 3.36Å; S171-S174 PolarHBondContact O-OG 2.97Å; S171-G175 WeakPolarHBondContact O-CA 3.21Å; S171-G175 PolarHBondContact O-N 3.03Å
172	A	93.9	Very high	92.7	Very high	56 Å²	56	38 Å²	38	46%	0.463	23%	0.228	S	C	.	.	H	α-helix	trans	-64.8	-44.9	178.3	0	0	0	0	0	111	L168 L176	L168-A172 WeakPolarHBondContact O-CA 3.35Å; L168-A172 WeakPolarHBondContact O-CB 3.36Å; L168-A172 PolarHBondContact O-N 3.45Å; A172-L176 WeakPolarHBondContact O-CB 3.29Å; A172-L176 PolarHBondContact O-N 2.92Å
173	S	95	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.3	-49	-179.7	-54.8	0	0	0	0	111.8	V148 V149 S169 I170 L176 I177	V148-S173 VanDerWaalsContact CG1-OG 3.29Å; V148-S173 WeakPolarHBondContact CG1-OG 3.46Å; V149-S173 WeakPolarHBondContact CA-OG 3.11Å; V149-S173 WeakPolarHBondContact CG2-OG 3.35Å; V149-S173 PolarHBondContact N-OG 2.8Å; V149-S173 VanDerWaalsContact N-OG 3.08Å; S169-S173 WeakPolarHBondContact O-CB 2.88Å; S169-S173 PolarHBondContact O-N 3.4Å; S169-S173 PolarHBondContact O-OG 3.33Å; I170-S173 PolarHBondContact O-N 3.2Å; S173-L176 PolarHBondContact O-N 3.31Å; S173-I177 WeakPolarHBondContact O-CG1 3.31Å; S173-I177 WeakPolarHBondContact O-CG2 3.45Å; S173-I177 PolarHBondContact O-N 3.07Å
174	S	94.7	Very high	90.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-37.4	179.8	60.1	0	0	0	0	112.9	L72 I170 S171 I177 A178	L72-S174 WeakPolarHBondContact CD1-OG 3.32Å; I170-S174 VanDerWaalsContact O-CB 3.28Å; I170-S174 WeakPolarHBondContact O-CB 3.5Å; I170-S174 PolarHBondContact O-N 2.91Å; I170-S174 PolarHBondContact O-OG 3.11Å; S171-S174 PolarHBondContact O-OG 2.97Å; S174-I177 WeakPolarHBondContact O-CG1 3.39Å; S174-A178 VanDerWaalsContact O-CB 3.28Å; S174-A178 WeakPolarHBondContact O-CB 3.49Å; S174-A178 PolarHBondContact O-N 2.97Å; S174-A178 VanDerWaalsContact O-N 3.13Å
175	G	93.9	Very high	88.4	Confident	22 Å²	22	49.7 Å²	49.7	23%	0.227	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-44.6	173.2	0	0	0	0	0	112.2	S171 A178 L179	S171-G175 WeakPolarHBondContact O-CA 3.21Å; S171-G175 PolarHBondContact O-N 3.03Å; G175-A178 PolarHBondContact O-N 2.82Å; G175-L179 WeakPolarHBondContact O-CB 3.04Å; G175-L179 VanDerWaalsContact O-CG 3.3Å; G175-L179 WeakPolarHBondContact O-CG 3.33Å; G175-L179 PolarHBondContact O-N 2.9Å
176	L	94.1	Very high	88.1	Confident	74 Å²	74	52.2 Å²	52.2	39%	0.387	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-47.6	-179.8	-178.1	63.8	0	0	0	111.7	V148 A172 S173 A178 L179 L180	V148-L176 HydrophobicContact CG1-CD2 4.17Å; V148-L176 HydrophobicContact CG2-CD2 4.1Å; A172-L176 WeakPolarHBondContact O-CB 3.29Å; A172-L176 PolarHBondContact O-N 2.92Å; S173-L176 PolarHBondContact O-N 3.31Å; L176-A178 VanDerWaalsContact C-N 3.29Å; L176-A178 PolarHBondContact O-N 3.09Å; L176-L179 PolarHBondContact O-N 3.04Å; L176-L180 HydrophobicContact CD1-CD1 4.1Å; L176-L180 HydrophobicContact CD1-CG 4.2Å; L176-L180 HydrophobicContact CG-CD1 3.9Å; L176-L180 HydrophobicContact CG-CG 4.39Å; L176-L180 WeakPolarHBondContact O-CB 3.25Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.19Å; L176-L180 PolarHBondContact O-N 3.25Å
177	I	94	Very high	87.9	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-37.8	176.6	66.1	-179	0	0	0	111.4	V73 A76 L144 F145 S173 S174 L180 S181	V73-I177 HydrophobicContact CB-CD1 4.13Å; V73-I177 HydrophobicContact CG1-CD1 4.44Å; V73-I177 HydrophobicContact CG2-CD1 3.5Å; V73-I177 VanDerWaalsContact CG2-CD1 3.5Å; A76-I177 HydrophobicContact CB-CB 4.41Å; A76-I177 HydrophobicContact CB-CD1 4.37Å; A76-I177 HydrophobicContact CB-CG1 4.09Å; L144-I177 HydrophobicContact CB-CG2 4.18Å; L144-I177 HydrophobicContact CD2-CG2 3.87Å; L144-I177 HydrophobicContact CG-CG2 3.86Å; F145-I177 HydrophobicContact CB-CD1 4.1Å; F145-I177 HydrophobicContact CB-CG2 4.42Å; F145-I177 HydrophobicContact CD2-CD1 3.98Å; F145-I177 HydrophobicContact CG-CD1 4.41Å; S173-I177 WeakPolarHBondContact O-CG1 3.31Å; S173-I177 WeakPolarHBondContact O-CG2 3.45Å; S173-I177 PolarHBondContact O-N 3.07Å; S174-I177 WeakPolarHBondContact O-CG1 3.39Å; I177-L180 PolarHBondContact O-N 3.24Å; I177-S181 VanDerWaalsContact O-CB 3.26Å; I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.01Å
178	A	92.8	Very high	87.6	Confident	9 Å²	9	54.6 Å²	54.6	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-44.9	178.4	0	0	0	0	0	110.4	L72 F75 S174 G175 L176 S181 T182	L72-A178 HydrophobicContact CB-CB 4.47Å; L72-A178 HydrophobicContact CD2-CB 4.22Å; F75-A178 HydrophobicContact CD1-CB 4.23Å; S174-A178 VanDerWaalsContact O-CB 3.28Å; S174-A178 WeakPolarHBondContact O-CB 3.49Å; S174-A178 PolarHBondContact O-N 2.97Å; S174-A178 VanDerWaalsContact O-N 3.13Å; G175-A178 PolarHBondContact O-N 2.82Å; L176-A178 VanDerWaalsContact C-N 3.29Å; L176-A178 PolarHBondContact O-N 3.09Å; A178-S181 PolarHBondContact O-N 3.29Å; A178-S181 PolarHBondContact O-OG 2.95Å; A178-T182 WeakPolarHBondContact O-CG2 3.5Å; A178-T182 PolarHBondContact O-N 3.12Å
179	L	92.5	Very high	87.2	Confident	122 Å²	122	53 Å²	53	64%	0.639	32%	0.319	S	S	*	.	H	α-helix	trans	-63.2	-48.1	175.4	-70.1	173.1	0	0	0	111.9	G175 L176 S181 T182 G183	G175-L179 WeakPolarHBondContact O-CB 3.04Å; G175-L179 VanDerWaalsContact O-CG 3.3Å; G175-L179 WeakPolarHBondContact O-CG 3.33Å; G175-L179 PolarHBondContact O-N 2.9Å; L176-L179 PolarHBondContact O-N 3.04Å; L179-S181 PolarHBondContact O-N 3.42Å; L179-T182 PolarHBondContact O-N 3.33Å; L179-T182 PolarHBondContact O-OG1 3.04Å; L179-G183 PolarHBondContact O-N 3.49Å; L179-G183 VanDerWaalsContact O-N 3.13Å
180	L	90.6	Very high	86.8	Confident	90 Å²	90	56.3 Å²	56.3	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-34.7	178	-70.5	174.1	0	0	0	112	L144 L176 I177 T182 G183	L144-L180 HydrophobicContact CD2-CD1 3.84Å; L176-L180 HydrophobicContact CD1-CD1 4.1Å; L176-L180 HydrophobicContact CD1-CG 4.2Å; L176-L180 HydrophobicContact CG-CD1 3.9Å; L176-L180 HydrophobicContact CG-CG 4.39Å; L176-L180 WeakPolarHBondContact O-CB 3.25Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.19Å; L176-L180 PolarHBondContact O-N 3.25Å; I177-L180 PolarHBondContact O-N 3.24Å; L180-T182 VanDerWaalsContact C-N 3.25Å; L180-T182 PolarHBondContact O-N 2.91Å; L180-G183 PolarHBondContact O-N 3.42Å
181	S	88.7	Confident	86.2	Confident	10 Å²	10	60 Å²	60	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-65.8	-28.1	175.4	82.2	0	0	0	0	113.2	A76 N79 I177 A178 L179	A76-S181 WeakPolarHBondContact CA-OG 3.27Å; N79-S181 WeakPolarHBondContact CB-O 3.48Å; N79-S181 PolarHBondContact ND2-OG 3.5Å; I177-S181 VanDerWaalsContact O-CB 3.26Å; I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.01Å; A178-S181 PolarHBondContact O-N 3.29Å; A178-S181 PolarHBondContact O-OG 2.95Å; L179-S181 PolarHBondContact O-N 3.42Å
182	T	88.2	Confident	85.6	Confident	74 Å²	74	60.6 Å²	60.6	45%	0.454	36%	0.362	S	S	.	.	H	α-helix	trans	-82.6	-21.6	175.3	62.9	0	0	0	0	112.7	F75 A178 L179 L180 S184	F75-T182 HydrophobicContact CE1-CG2 3.85Å; F75-T182 HydrophobicContact CZ-CG2 4.17Å; A178-T182 WeakPolarHBondContact O-CG2 3.5Å; A178-T182 PolarHBondContact O-N 3.12Å; L179-T182 PolarHBondContact O-N 3.33Å; L179-T182 PolarHBondContact O-OG1 3.04Å; L180-T182 VanDerWaalsContact C-N 3.25Å; L180-T182 PolarHBondContact O-N 2.91Å; T182-S184 PolarHBondContact O-N 3.48Å
183	G	78.4	Confident	85	Confident	58 Å²	58	61 Å²	61	60%	0.598	35%	0.354	S	S	*	.			trans	-71	85.3	177.2	0	0	0	0	0	111.6	L179 L180 K185	L179-G183 PolarHBondContact O-N 3.49Å; L179-G183 VanDerWaalsContact O-N 3.13Å; L180-G183 PolarHBondContact O-N 3.42Å; G183-K185 PolarHBondContact O-N 3.14Å
184	S	58.6	Low	84.2	Confident	86 Å²	86	66.1 Å²	66.1	60%	0.601	38%	0.384	S	S	*	.			trans	-84.2	107.2	176.1	-161.8	0	0	0	0	110	T182	T182-S184 PolarHBondContact O-N 3.48Å
185	K	43.4	Very low	83.2	Confident	246 Å²	246	72 Å²	72	100%	1.07	42%	0.418	S	S	*	.			trans	-105	0	152	-75.4	-172.5	-179.6	175.8	0	109.7	K87 G183	K87-K185 PolarHBondContact NZ-O 2.86Å; G183-K185 PolarHBondContact O-N 3.14Å

Retrieved 185 of 185 residues in 83.4 ms (Link to these results)

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