A0A077Z3P7_TRITR Loading...

MARVEL domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z3P7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 192 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	36.7	Very low	38.8	Very low	232 Å²	232	172.6 Å²	172.6	100%	1.143	89%	0.886	S	S	*	*				0	109.8	0	-71.1	176.7	177.7	0	0	107.2
2	L	37.5	Very low	38.8	Very low	180 Å²	180	167.9 Å²	167.9	94%	0.942	87%	0.872	S	S	*	*			trans	-72.5	125.7	-177.5	-86.4	145.6	0	0	0	109.8	S4	L2-S4 PolarHBondContact O-N 3.48Å
3	F	39	Very low	39.2	Very low	204 Å²	204	163.5 Å²	163.5	90%	0.895	86%	0.864	S	S	*	*			trans	-68.7	123.9	179.1	-83.5	-93.8	0	0	0	111.1
4	S	38.6	Very low	39.2	Very low	115 Å²	115	168.1 Å²	168.1	80%	0.804	86%	0.864	S	S	*	*			trans	-102	104.5	172.4	166.2	0	0	0	0	109	L2	L2-S4 PolarHBondContact O-N 3.48Å
5	Q	42	Very low	39.6	Very low	181 Å²	181	162.6 Å²	162.6	85%	0.846	85%	0.853	S	S	*	*			trans	-140.2	102.8	161.6	-82.1	-175.5	-28.5	0	0	107
6	A	39.6	Very low	39.9	Very low	85 Å²	85	163.6 Å²	163.6	70%	0.702	85%	0.852	S	S	*	*				73.7	85.7	85.4	0	0	0	0	0	113
7	H	40	Very low	40.2	Very low	200 Å²	200	160.5 Å²	160.5	93%	0.926	85%	0.847	S	S	*	*			trans	-145.9	81.8	148.7	-96.7	-75.6	0	0	0	108.9
8	R	33.1	Very low	40.3	Very low	248 Å²	248	155.9 Å²	155.9	94%	0.936	84%	0.836	S	S	*	*			trans	-126.1	95	162	-86.6	-172.5	-175.8	176.8	3.1	107.7
9	S	42.8	Very low	40.5	Very low	122 Å²	122	154.4 Å²	154.4	85%	0.853	83%	0.832	S	S	*	*			trans	-131	99.6	158.6	-68.8	0	0	0	0	108.1	A11	S9-A11 PolarHBondContact O-N 3.25Å
10	R	36.1	Very low	40.6	Very low	232 Å²	232	155.4 Å²	155.4	88%	0.875	83%	0.831	S	S	*	*			trans	-50.9	114.6	168.9	-95.5	167.7	167.6	166.5	-4	109.9	T12	R10-T12 HydrophobicContact CG-CG2 4.44Å
11	A	41.3	Very low	40.6	Very low	100 Å²	100	159 Å²	159	83%	0.826	83%	0.833	S	S	*	*			trans	-99.7	85.5	153.2	0	0	0	0	0	107.6	S9 S13	S9-A11 PolarHBondContact O-N 3.25Å; A11-S13 VanDerWaalsContact C-N 3.3Å; A11-S13 PolarHBondContact O-N 3.07Å
12	T	38.7	Very low	41.1	Very low	116 Å²	116	156.6 Å²	156.6	71%	0.712	82%	0.819	S	S	*	*			trans	-76.4	83.3	169.9	42.5	0	0	0	0	109	R10 R14	R10-T12 HydrophobicContact CG-CG2 4.44Å; T12-R14 PolarHBondContact O-N 3.31Å
13	S	44.2	Very low	41.6	Very low	111 Å²	111	153.8 Å²	153.8	78%	0.776	81%	0.814	S	S	*	*			trans	-82.3	89.3	163.3	-173.1	0	0	0	0	108.2	A11 A15	A11-S13 VanDerWaalsContact C-N 3.3Å; A11-S13 PolarHBondContact O-N 3.07Å; S13-A15 PolarHBondContact O-N 2.86Å
14	R	39.6	Very low	42	Very low	228 Å²	228	155.4 Å²	155.4	86%	0.86	82%	0.815	S	S	*	*			trans	-70.8	84.6	163.8	-99.6	179.4	174.2	162.6	-2.6	107.2	T12 H16	T12-R14 PolarHBondContact O-N 3.31Å; R14-H16 PolarHBondContact O-N 2.95Å; R14-H16 VanDerWaalsContact O-N 3.07Å
15	A	44.9	Very low	42.5	Very low	85 Å²	85	153.7 Å²	153.7	70%	0.702	81%	0.807	S	S	*	*			trans	-65.3	105.3	163.7	0	0	0	0	0	107.7	S13 S17	S13-A15 PolarHBondContact O-N 2.86Å; A15-S17 PolarHBondContact O-N 3.06Å
16	H	43.8	Very low	43	Very low	179 Å²	179	150.8 Å²	150.8	83%	0.829	80%	0.804	S	S	*	*			trans	-55.7	110.9	170.4	-88.8	-101.8	0	0	0	108.8	R14 A18	R14-H16 PolarHBondContact O-N 2.95Å; R14-H16 VanDerWaalsContact O-N 3.07Å; H16-A18 PolarHBondContact O-N 2.99Å
17	S	45.4	Very low	43.8	Very low	111 Å²	111	152 Å²	152	78%	0.776	81%	0.807	S	S	*	*			trans	-63.9	86	162.3	-87	0	0	0	0	108.4	A15 V19	A15-S17 PolarHBondContact O-N 3.06Å; S17-V19 PolarHBondContact O-N 3.07Å
18	A	41.2	Very low	44.6	Very low	78 Å²	78	147.2 Å²	147.2	65%	0.645	79%	0.788	S	S	*	*			trans	-69.8	85.4	157.9	0	0	0	0	0	106.6	H16 H20	H16-A18 PolarHBondContact O-N 2.99Å; A18-H20 PolarHBondContact O-N 2.9Å
19	V	44.6	Very low	45.6	Very low	126 Å²	126	139.6 Å²	139.6	76%	0.764	77%	0.77	S	S	*	*			trans	-62.7	88.4	166.2	177.5	0	0	0	0	106.2	S17 R21	S17-V19 PolarHBondContact O-N 3.07Å; V19-R21 PolarHBondContact O-N 2.87Å
20	H	42.4	Very low	46.5	Very low	174 Å²	174	140.1 Å²	140.1	81%	0.806	76%	0.764	S	S	*	*			trans	-62.8	91.5	162.9	-89.2	-72.1	0	0	0	106.7	A18 Q22	A18-H20 PolarHBondContact O-N 2.9Å; H20-Q22 VanDerWaalsContact C-N 3.28Å; H20-Q22 PolarHBondContact O-N 2.83Å
21	R	40.7	Very low	47.6	Very low	232 Å²	232	131.8 Å²	131.8	88%	0.875	74%	0.744	S	S	*	*			trans	-59.8	97.2	165	-165.2	-179.5	-161.1	177.9	4.7	105.9	V19 S23	V19-R21 PolarHBondContact O-N 2.87Å; R21-S23 PolarHBondContact O-N 2.81Å
22	Q	47	Very low	48.6	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	72%	0.723	S	S	*	*			trans	-55.1	108	167.6	-92.1	174.6	-24.1	0	0	106.5	H20 R24	H20-Q22 VanDerWaalsContact C-N 3.28Å; H20-Q22 PolarHBondContact O-N 2.83Å; Q22-R24 VanDerWaalsContact C-N 3.29Å; Q22-R24 PolarHBondContact O-N 2.84Å
23	S	49.3	Very low	49.6	Very low	121 Å²	121	127.4 Å²	127.4	85%	0.846	71%	0.706	S	S	*	*			trans	-59.9	100.1	167.4	-137.2	0	0	0	0	105.6	R21 A25	R21-S23 PolarHBondContact O-N 2.81Å; S23-A25 PolarHBondContact O-N 2.87Å
24	R	46.3	Very low	50.3	Low	239 Å²	239	127 Å²	127	90%	0.902	69%	0.692	S	S	*	*			trans	-63.1	92.5	166.7	-90.4	-176.9	-177.8	163.7	0.8	105.6	Q22	Q22-R24 VanDerWaalsContact C-N 3.29Å; Q22-R24 PolarHBondContact O-N 2.84Å
25	A	50	Low	51.2	Low	79 Å²	79	124.9 Å²	124.9	65%	0.653	68%	0.684	S	S	*	*			trans	-51.3	136.9	155	0	0	0	0	0	106.6	S23 S27	S23-A25 PolarHBondContact O-N 2.87Å; A25-S27 PolarHBondContact O-N 2.82Å; A25-S27 VanDerWaalsContact O-N 3.1Å
26	P	51.9	Low	51.9	Low	119 Å²	119	123.4 Å²	123.4	77%	0.773	67%	0.672	S	S	*	*			trans	-52.5	125	-179.9	-20.5	29.4	0	0	0	108.3	I28	P26-I28 VanDerWaalsContact C-N 3.3Å; P26-I28 PolarHBondContact O-N 3.1Å
27	S	55.9	Low	52.6	Low	110 Å²	110	121.4 Å²	121.4	77%	0.769	66%	0.661	S	S	*	*			trans	-60.2	101.3	170.5	53.3	0	0	0	0	106.4	A25 P29	A25-S27 PolarHBondContact O-N 2.82Å; A25-S27 VanDerWaalsContact O-N 3.1Å; S27-P29 WeakPolarHBondContact O-CD 3.08Å
28	I	56.6	Low	53.3	Low	101 Å²	101	117.6 Å²	117.6	52%	0.518	63%	0.633	S	S	.	*			trans	-50.8	117.7	167.8	-64	173.6	0	0	0	104.6	P26 N30 S32 L33	P26-I28 VanDerWaalsContact C-N 3.3Å; P26-I28 PolarHBondContact O-N 3.1Å; I28-N30 PolarHBondContact O-N 3.47Å; I28-S32 WeakPolarHBondContact CG2-OG 3.33Å; I28-L33 HydrophobicContact CB-CD1 3.92Å; I28-L33 HydrophobicContact CD1-CD1 4.29Å; I28-L33 HydrophobicContact CG2-CB 4.45Å; I28-L33 HydrophobicContact CG2-CD1 3.67Å; I28-L33 HydrophobicContact CG2-CG 4.06Å
29	P	54.5	Low	54.3	Low	87 Å²	87	121.5 Å²	121.5	57%	0.565	64%	0.636	S	S	*	*			trans	-58.4	123.4	-175.2	10.5	-16	0	0	0	106.7	S27 A31 S32	S27-P29 WeakPolarHBondContact O-CD 3.08Å; P29-A31 CarbonylContact O-C 3.49Å; P29-A31 PolarHBondContact O-N 2.83Å; P29-S32 PolarHBondContact O-N 3.02Å; P29-S32 PolarHBondContact O-OG 2.76Å
30	N	62.5	Low	55.5	Low	134 Å²	134	120.4 Å²	120.4	72%	0.717	63%	0.625	S	S	*	*	H	α-helix	trans	-44.7	-31	-175.3	-71.3	-15.2	0	0	0	112.3	I28 S32 L33 Q34	I28-N30 PolarHBondContact O-N 3.47Å; N30-S32 PolarHBondContact O-N 2.92Å; N30-L33 PolarHBondContact O-N 2.83Å; N30-Q34 WeakPolarHBondContact O-CB 3.19Å; N30-Q34 PolarHBondContact O-N 2.88Å
31	A	59.2	Low	56.9	Low	57 Å²	57	113.4 Å²	113.4	47%	0.471	59%	0.592	S	S	.	*	H	α-helix	trans	-58	-41.1	173.6	0	0	0	0	0	114.9	P29 R35	P29-A31 CarbonylContact O-C 3.49Å; P29-A31 PolarHBondContact O-N 2.83Å; A31-R35 WeakPolarHBondContact O-CB 3.38Å; A31-R35 PolarHBondContact O-N 2.8Å
32	S	62	Low	58.5	Low	53 Å²	53	105 Å²	105	37%	0.371	57%	0.568	S	S	.	*	H	α-helix	trans	-71.1	-41.6	179.1	60.6	0	0	0	0	112.1	I28 P29 N30 R35 A36	I28-S32 WeakPolarHBondContact CG2-OG 3.33Å; P29-S32 PolarHBondContact O-N 3.02Å; P29-S32 PolarHBondContact O-OG 2.76Å; N30-S32 PolarHBondContact O-N 2.92Å; S32-R35 PolarHBondContact O-N 3.42Å; S32-A36 WeakPolarHBondContact O-CB 3.18Å; S32-A36 PolarHBondContact O-N 3.45Å
33	L	58.6	Low	59.9	Low	71 Å²	71	100 Å²	100	37%	0.372	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-48	172.5	-110.6	151.3	0	0	0	110.9	I28 N30 R35 A36 F37	I28-L33 HydrophobicContact CB-CD1 3.92Å; I28-L33 HydrophobicContact CD1-CD1 4.29Å; I28-L33 HydrophobicContact CG2-CB 4.45Å; I28-L33 HydrophobicContact CG2-CD1 3.67Å; I28-L33 HydrophobicContact CG2-CG 4.06Å; N30-L33 PolarHBondContact O-N 2.83Å; L33-R35 VanDerWaalsContact C-N 3.35Å; L33-R35 PolarHBondContact O-N 3.31Å; L33-A36 PolarHBondContact O-N 3.45Å; L33-F37 HydrophobicContact CD2-CD2 3.97Å; L33-F37 HydrophobicContact CD2-CE2 3.39Å; L33-F37 HydrophobicContact CD2-CZ 4.29Å; L33-F37 WeakPolarHBondContact O-CD2 3.34Å; L33-F37 PolarHBondContact O-N 2.9Å
34	Q	60.3	Low	61.4	Low	102 Å²	102	96 Å²	96	48%	0.477	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-41.6	177.2	-169.1	174.1	-8.5	0	0	111.5	N30 F37 T38	N30-Q34 WeakPolarHBondContact O-CB 3.19Å; N30-Q34 PolarHBondContact O-N 2.88Å; Q34-F37 PolarHBondContact O-N 3.07Å; Q34-T38 VanDerWaalsContact O-CG2 3.31Å; Q34-T38 WeakPolarHBondContact O-CG2 3.31Å; Q34-T38 PolarHBondContact O-N 3.36Å; Q34-T38 PolarHBondContact O-OG1 2.89Å
35	R	57.3	Low	63.1	Low	184 Å²	184	89.8 Å²	89.8	69%	0.694	51%	0.513	S	S	*	.	H	α-helix	trans	-65.1	-43	176.6	-158.5	-178	-62	167.1	-1	111.8	A31 S32 L33 T38 F39	A31-R35 WeakPolarHBondContact O-CB 3.38Å; A31-R35 PolarHBondContact O-N 2.8Å; S32-R35 PolarHBondContact O-N 3.42Å; L33-R35 VanDerWaalsContact C-N 3.35Å; L33-R35 PolarHBondContact O-N 3.31Å; R35-T38 WeakPolarHBondContact CA-OG1 3.14Å; R35-T38 PolarHBondContact O-N 3.08Å; R35-T38 PolarHBondContact O-OG1 2.73Å; R35-F39 PolarHBondContact O-N 3.32Å; R35-F39 VanDerWaalsContact O-N 3.08Å
36	A	59.4	Low	64.6	Low	53 Å²	53	88.1 Å²	88.1	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-43.4	174.6	0	0	0	0	0	112	S32 L33 F39 N40	S32-A36 WeakPolarHBondContact O-CB 3.18Å; S32-A36 PolarHBondContact O-N 3.45Å; L33-A36 PolarHBondContact O-N 3.45Å; A36-F39 PolarHBondContact O-N 3.09Å; A36-N40 WeakPolarHBondContact O-CB 3.48Å; A36-N40 PolarHBondContact O-N 3.23Å
37	F	59.3	Low	66.2	Low	138 Å²	138	82.5 Å²	82.5	61%	0.605	46%	0.455	S	S	*	.	H	α-helix	trans	-62.5	-41.5	174.5	-84.2	-63.2	0	0	0	112.6	L33 Q34 F39 N40 W41	L33-F37 HydrophobicContact CD2-CD2 3.97Å; L33-F37 HydrophobicContact CD2-CE2 3.39Å; L33-F37 HydrophobicContact CD2-CZ 4.29Å; L33-F37 WeakPolarHBondContact O-CD2 3.34Å; L33-F37 PolarHBondContact O-N 2.9Å; Q34-F37 PolarHBondContact O-N 3.07Å; F37-F39 PolarHBondContact O-N 3.41Å; F37-N40 PolarHBondContact O-N 3.48Å; F37-W41 PolarHBondContact O-N 3.29Å; F37-W41 VanDerWaalsContact O-N 3.12Å
38	T	61.1	Low	67.7	Low	31 Å²	31	81.5 Å²	81.5	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-64.8	-38.4	178.5	52.4	0	0	0	0	112.7	Q34 R35 Q100	Q34-T38 VanDerWaalsContact O-CG2 3.31Å; Q34-T38 WeakPolarHBondContact O-CG2 3.31Å; Q34-T38 PolarHBondContact O-N 3.36Å; Q34-T38 PolarHBondContact O-OG1 2.89Å; R35-T38 WeakPolarHBondContact CA-OG1 3.14Å; R35-T38 PolarHBondContact O-N 3.08Å; R35-T38 PolarHBondContact O-OG1 2.73Å; T38-Q100 VanDerWaalsContact CG2-NE2 3.32Å
39	F	60.7	Low	69.2	Low	159 Å²	159	78.4 Å²	78.4	70%	0.697	43%	0.425	S	S	*	.	H	α-helix	trans	-68.7	-42.5	177.1	-168.4	-98.2	0	0	0	111.4	R35 A36 F37 W41	R35-F39 PolarHBondContact O-N 3.32Å; R35-F39 VanDerWaalsContact O-N 3.08Å; A36-F39 PolarHBondContact O-N 3.09Å; F37-F39 PolarHBondContact O-N 3.41Å; F39-W41 VanDerWaalsContact C-N 3.25Å; F39-W41 PolarHBondContact O-N 3.21Å
40	N	71.2	Confident	70.9	Confident	103 Å²	103	74.5 Å²	74.5	55%	0.551	40%	0.399	S	S	*	.	H	α-helix	trans	-72.4	-14.7	-179	-75.3	-11.9	0	0	0	114	A36 F37 C43 S44	A36-N40 WeakPolarHBondContact O-CB 3.48Å; A36-N40 PolarHBondContact O-N 3.23Å; F37-N40 PolarHBondContact O-N 3.48Å; N40-C43 CarbonylContact O-C 3.58Å; N40-C43 PolarHBondContact O-N 3.41Å; N40-S44 PolarHBondContact O-N 2.99Å
41	W	70.8	Confident	72.3	Confident	28 Å²	28	73.2 Å²	73.2	11%	0.106	38%	0.384	C	S	.	.	H	α-helix	trans	-65.7	-45.5	-179.7	176	77.8	0	0	0	112.7	F37 F39 C43 S44 A47 L92 K95 F96 I99	F37-W41 PolarHBondContact O-N 3.29Å; F37-W41 VanDerWaalsContact O-N 3.12Å; F39-W41 VanDerWaalsContact C-N 3.25Å; F39-W41 PolarHBondContact O-N 3.21Å; W41-C43 PolarHBondContact O-N 3.3Å; W41-S44 VanDerWaalsContact O-CB 3.24Å; W41-S44 WeakPolarHBondContact O-CB 3.37Å; W41-S44 PolarHBondContact O-N 3.12Å; W41-S44 PolarHBondContact O-OG 3.04Å; W41-A47 WeakPolarHBondContact O-CB 3.5Å; W41-L92 HydrophobicContact CH2-CB 4Å; W41-L92 HydrophobicContact CH2-CD2 3.59Å; W41-L92 HydrophobicContact CH2-CG 4.4Å; W41-L92 VanDerWaalsContact CH2-O 3.25Å; W41-L92 WeakPolarHBondContact CH2-O 3.16Å; W41-L92 HydrophobicContact CZ2-CD2 3.8Å; W41-K95 HydrophobicContact CZ2-CB 3.84Å; W41-K95 HydrophobicContact CZ2-CD 3.92Å; W41-K95 HydrophobicContact CZ2-CG 3.87Å; W41-F96 HydrophobicContact CE3-CD2 4.25Å; W41-F96 HydrophobicContact CH2-CB 4.19Å; W41-F96 HydrophobicContact CZ3-CB 4.14Å; W41-F96 HydrophobicContact CZ3-CD2 4.36Å; W41-I99 HydrophobicContact CB-CD1 4.29Å; W41-I99 HydrophobicContact CD2-CD1 4.1Å; W41-I99 HydrophobicContact CG-CD1 3.56Å; W41-I99 VanDerWaalsContact NE1-CD1 3.3Å
42	C	75.4	Confident	73.9	Confident	54 Å²	54	73.5 Å²	73.5	37%	0.365	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-26.5	177.5	-68	0	0	0	0	112.3	A47	C42-A47 WeakPolarHBondContact O-CB 3.33Å
43	C	75.1	Confident	75.3	Confident	77 Å²	77	71 Å²	71	52%	0.52	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	1.2	177.1	-58.5	0	0	0	0	113.2	N40 W41 L48	N40-C43 CarbonylContact O-C 3.58Å; N40-C43 PolarHBondContact O-N 3.41Å; W41-C43 PolarHBondContact O-N 3.3Å; C43-L48 WeakPolarHBondContact O-CD1 3.46Å
44	S	80.8	Confident	77	Confident	38 Å²	38	68.3 Å²	68.3	27%	0.266	35%	0.348	S	S	.	.	S	Bend	trans	-63.4	146.6	173.1	68.9	0	0	0	0	110	N40 W41 F46 A47 L48	N40-S44 PolarHBondContact O-N 2.99Å; W41-S44 VanDerWaalsContact O-CB 3.24Å; W41-S44 WeakPolarHBondContact O-CB 3.37Å; W41-S44 PolarHBondContact O-N 3.12Å; W41-S44 PolarHBondContact O-OG 3.04Å; S44-F46 PolarHBondContact O-N 3.37Å; S44-F46 VanDerWaalsContact O-N 3.11Å; S44-A47 PolarHBondContact O-N 3.4Å; S44-A47 WeakPolarHBondContact OG-CB 3.33Å; S44-A47 PolarHBondContact OG-N 2.99Å; S44-L48 PolarHBondContact O-N 3.43Å
45	T	81.6	Confident	78.7	Confident	108 Å²	108	67.4 Å²	67.4	66%	0.663	35%	0.349	S	S	*	.	H	α-helix	trans	-50.8	-39.8	177.2	-49.5	0	0	0	0	111.6	L49	T45-L49 HydrophobicContact CG2-CD1 4.29Å; T45-L49 VanDerWaalsContact O-CG 3.23Å; T45-L49 WeakPolarHBondContact O-CG 3.45Å; T45-L49 PolarHBondContact O-N 3.49Å; T45-L49 VanDerWaalsContact O-N 3.1Å
46	F	82	Confident	80.5	Confident	44 Å²	44	60.2 Å²	60.2	19%	0.193	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-50.2	175.5	177.3	-91.3	0	0	0	112.8	S44 L49 K50 L92 K95 F109	S44-F46 PolarHBondContact O-N 3.37Å; S44-F46 VanDerWaalsContact O-N 3.11Å; F46-L49 PolarHBondContact O-N 3.2Å; F46-K50 HydrophobicContact CD1-CG 4.42Å; F46-K50 HydrophobicContact CE1-CG 4.03Å; F46-K50 HydrophobicContact CZ-CD 4.34Å; F46-K50 HydrophobicContact CZ-CG 4.13Å; F46-K50 VanDerWaalsContact O-CG 3.31Å; F46-K50 WeakPolarHBondContact O-CG 3.5Å; F46-K50 PolarHBondContact O-N 3.36Å; F46-L92 HydrophobicContact CE1-CD2 4.43Å; F46-K95 HydrophobicContact CD1-CD 3.98Å; F46-K95 HydrophobicContact CE1-CD 3.58Å; F46-K95 VanDerWaalsContact CE1-NZ 3.32Å; F46-K95 HydrophobicContact CZ-CD 4.39Å; F46-F109 HydrophobicContact CE1-CE1 4.22Å; F46-F109 AromaticContact CZ-CE1 3.76Å; F46-F109 HydrophobicContact CZ-CE1 3.76Å; F46-F109 HydrophobicContact CZ-CZ 4.29Å
47	A	85.6	Confident	82.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-40.4	-178	0	0	0	0	0	111.7	W41 C42 S44 L49 K50 W51 L92	W41-A47 WeakPolarHBondContact O-CB 3.5Å; C42-A47 WeakPolarHBondContact O-CB 3.33Å; S44-A47 PolarHBondContact O-N 3.4Å; S44-A47 WeakPolarHBondContact OG-CB 3.33Å; S44-A47 PolarHBondContact OG-N 2.99Å; A47-L49 VanDerWaalsContact C-N 3.35Å; A47-L49 PolarHBondContact O-N 2.84Å; A47-K50 PolarHBondContact O-N 3.3Å; A47-W51 PolarHBondContact O-N 2.9Å; A47-L92 HydrophobicContact CB-CD2 4.31Å
48	L	87.8	Confident	84	Confident	90 Å²	90	55.5 Å²	55.5	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-44.9	176	-72.3	173.2	0	0	0	111.8	C43 S44 K50 W51 V52	C43-L48 WeakPolarHBondContact O-CD1 3.46Å; S44-L48 PolarHBondContact O-N 3.43Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 3.07Å; L48-W51 PolarHBondContact O-N 3.18Å; L48-V52 WeakPolarHBondContact O-CG2 3.41Å; L48-V52 PolarHBondContact O-N 2.95Å
49	L	88.2	Confident	85.6	Confident	36 Å²	36	56.8 Å²	56.8	19%	0.188	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-39.9	177.1	-70.6	172.7	0	0	0	112.4	T45 F46 A47 E53 F176 R180	T45-L49 HydrophobicContact CG2-CD1 4.29Å; T45-L49 VanDerWaalsContact O-CG 3.23Å; T45-L49 WeakPolarHBondContact O-CG 3.45Å; T45-L49 PolarHBondContact O-N 3.49Å; T45-L49 VanDerWaalsContact O-N 3.1Å; F46-L49 PolarHBondContact O-N 3.2Å; A47-L49 VanDerWaalsContact C-N 3.35Å; A47-L49 PolarHBondContact O-N 2.84Å; L49-E53 WeakPolarHBondContact O-CB 3.24Å; L49-E53 PolarHBondContact O-N 3.01Å; L49-F176 HydrophobicContact CD2-CD1 3.76Å; L49-F176 HydrophobicContact CD2-CE1 3.7Å; L49-R180 HydrophobicContact CD1-CG 4.45Å
50	K	89.7	Confident	87.2	Confident	5 Å²	5	49.2 Å²	49.2	2%	0.022	27%	0.272	C	S	.	.	H	α-helix	trans	-67.5	-37.7	176.3	-67.2	-83	177.8	-169.6	0	111.9	F46 A47 L48 E53 I54 T88 L92 D113 R180	F46-K50 HydrophobicContact CD1-CG 4.42Å; F46-K50 HydrophobicContact CE1-CG 4.03Å; F46-K50 HydrophobicContact CZ-CD 4.34Å; F46-K50 HydrophobicContact CZ-CG 4.13Å; F46-K50 VanDerWaalsContact O-CG 3.31Å; F46-K50 WeakPolarHBondContact O-CG 3.5Å; F46-K50 PolarHBondContact O-N 3.36Å; A47-K50 PolarHBondContact O-N 3.3Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 3.07Å; K50-E53 PolarHBondContact O-N 3.33Å; K50-I54 WeakPolarHBondContact O-CG1 3.5Å; K50-I54 PolarHBondContact O-N 3.25Å; K50-I54 VanDerWaalsContact O-N 3.08Å; K50-T88 HydrophobicContact CB-CG2 4Å; K50-T88 HydrophobicContact CD-CG2 3.65Å; K50-T88 HydrophobicContact CG-CG2 4.47Å; K50-L92 HydrophobicContact CB-CD1 3.77Å; K50-L92 HydrophobicContact CB-CD2 3.77Å; K50-L92 HydrophobicContact CB-CG 3.89Å; K50-L92 HydrophobicContact CG-CD2 4.08Å; K50-L92 HydrophobicContact CG-CG 4.41Å; K50-D113 WeakPolarHBondContact CE-OD1 3.41Å; K50-D113 IonicContact NZ-OD1 3.83Å; K50-D113 PolarHBondContact NZ-OD1 3.43Å; K50-D113 IonicContact NZ-OD2 3.06Å; K50-R180 VanDerWaalsContact CD-NH1 3.3Å
51	W	91.6	Very high	88.3	Confident	106 Å²	106	46 Å²	46	40%	0.402	26%	0.256	S	S	.	.	H	α-helix	trans	-66	-44.3	174.6	-80.4	120	0	0	0	112.5	A47 L48 E53 I54 V55 F89 L92	A47-W51 PolarHBondContact O-N 2.9Å; L48-W51 PolarHBondContact O-N 3.18Å; W51-E53 VanDerWaalsContact C-N 3.31Å; W51-E53 PolarHBondContact O-N 3.09Å; W51-I54 HydrophobicContact CE3-CD1 3.98Å; W51-I54 HydrophobicContact CZ3-CD1 4.15Å; W51-I54 PolarHBondContact O-N 3.24Å; W51-V55 WeakPolarHBondContact O-CG2 3.48Å; W51-V55 PolarHBondContact O-N 3.24Å; W51-F89 HydrophobicContact CH2-CD2 4.4Å; W51-F89 HydrophobicContact CH2-CE2 4.19Å; W51-L92 HydrophobicContact CD2-CD1 4.27Å; W51-L92 HydrophobicContact CZ2-CD1 4.43Å
52	V	92.7	Very high	89.4	Confident	63 Å²	63	48.2 Å²	48.2	38%	0.382	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-44.2	176	170.6	0	0	0	0	110.7	L48 I54 V55 L56 F176	L48-V52 WeakPolarHBondContact O-CG2 3.41Å; L48-V52 PolarHBondContact O-N 2.95Å; V52-I54 PolarHBondContact O-N 2.96Å; V52-V55 PolarHBondContact O-N 3.35Å; V52-L56 HydrophobicContact CG1-CD1 3.91Å; V52-L56 HydrophobicContact CG1-CG 4.3Å; V52-L56 VanDerWaalsContact O-CG 3.3Å; V52-L56 WeakPolarHBondContact O-CG 3.2Å; V52-L56 PolarHBondContact O-N 2.7Å; V52-F176 HydrophobicContact CG1-CE2 3.87Å; V52-F176 HydrophobicContact CG1-CZ 3.9Å
53	E	91.9	Very high	90.1	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-45.2	175	173.5	-172.3	-154.4	0	0	112.8	L49 K50 W51 V55 L56 C57 C84 T88 H177 R180	L49-E53 WeakPolarHBondContact O-CB 3.24Å; L49-E53 PolarHBondContact O-N 3.01Å; K50-E53 PolarHBondContact O-N 3.33Å; W51-E53 VanDerWaalsContact C-N 3.31Å; W51-E53 PolarHBondContact O-N 3.09Å; E53-V55 VanDerWaalsContact C-N 3.33Å; E53-V55 PolarHBondContact O-N 3.23Å; E53-L56 PolarHBondContact O-N 2.91Å; E53-C57 WeakPolarHBondContact O-CB 3.31Å; E53-C57 PolarHBondContact O-N 2.93Å; E53-C57 PolarHBondContact O-SG 3.44Å; E53-C84 PolarHBondContact OE1-SG 3.16Å; E53-T88 HydrophobicContact CG-CG2 4.47Å; E53-T88 PolarHBondContact OE1-OG1 2.85Å; E53-T88 VanDerWaalsContact OE2-CG2 3.23Å; E53-T88 WeakPolarHBondContact OE2-CG2 3.49Å; E53-T88 PolarHBondContact OE2-OG1 2.66Å; E53-H177 IonicContact OE1-CE1 3.1Å; E53-H177 PolarHBondContact OE1-CE1 3.19Å; E53-H177 IonicContact OE1-ND1 3.44Å; E53-H177 IonicContact OE1-NE2 2.8Å; E53-H177 PolarHBondContact OE1-NE2 2.87Å; E53-H177 VanDerWaalsContact OE1-NE2 3.1Å; E53-R180 IonicContact OE1-CZ 3.67Å; E53-R180 IonicContact OE1-NH1 3.63Å; E53-R180 IonicContact OE1-NH2 2.67Å; E53-R180 PolarHBondContact OE1-NH2 3.11Å; E53-R180 IonicContact OE2-CZ 3.26Å; E53-R180 VanDerWaalsContact OE2-CZ 3.26Å; E53-R180 IonicContact OE2-NH1 2.64Å; E53-R180 PolarHBondContact OE2-NH1 2.97Å; E53-R180 IonicContact OE2-NH2 2.74Å; E53-R180 PolarHBondContact OE2-NH2 3.11Å
54	I	93.9	Very high	90.9	Very high	14 Å²	14	44 Å²	44	7%	0.072	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-47.9	176.3	-70.3	164.7	0	0	0	110.1	K50 W51 V52 L56 C57 I58 T88 F89 L92	K50-I54 WeakPolarHBondContact O-CG1 3.5Å; K50-I54 PolarHBondContact O-N 3.25Å; K50-I54 VanDerWaalsContact O-N 3.08Å; W51-I54 HydrophobicContact CE3-CD1 3.98Å; W51-I54 HydrophobicContact CZ3-CD1 4.15Å; W51-I54 PolarHBondContact O-N 3.24Å; V52-I54 PolarHBondContact O-N 2.96Å; I54-L56 PolarHBondContact O-N 2.93Å; I54-C57 PolarHBondContact O-N 2.73Å; I54-I58 HydrophobicContact CG2-CD1 3.76Å; I54-I58 HydrophobicContact CG2-CG1 4.47Å; I54-I58 VanDerWaalsContact O-CG1 3.31Å; I54-I58 WeakPolarHBondContact O-CG1 3.27Å; I54-I58 PolarHBondContact O-N 3.42Å; I54-T88 HydrophobicContact CD1-CG2 3.93Å; I54-T88 HydrophobicContact CG1-CG2 3.67Å; I54-F89 HydrophobicContact CD1-CB 4.14Å; I54-F89 HydrophobicContact CD1-CD2 4.36Å; I54-L92 HydrophobicContact CD1-CD1 3.9Å
55	V	96	Very high	91.3	Very high	84 Å²	84	48.1 Å²	48.1	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-45.6	179.1	172.8	0	0	0	0	110.8	W51 V52 E53 C57 I58 V59	W51-V55 WeakPolarHBondContact O-CG2 3.48Å; W51-V55 PolarHBondContact O-N 3.24Å; V52-V55 PolarHBondContact O-N 3.35Å; E53-V55 VanDerWaalsContact C-N 3.33Å; E53-V55 PolarHBondContact O-N 3.23Å; V55-C57 VanDerWaalsContact C-N 3.34Å; V55-C57 PolarHBondContact O-N 2.98Å; V55-I58 PolarHBondContact O-N 3.35Å; V55-V59 HydrophobicContact CG1-CG2 4.38Å; V55-V59 WeakPolarHBondContact O-CG2 3.25Å; V55-V59 PolarHBondContact O-N 2.85Å
56	L	95.9	Very high	91.4	Very high	32 Å²	32	46.2 Å²	46.2	17%	0.168	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-41.7	177.7	-71.1	172.6	0	0	0	112.1	V52 E53 I54 V59 L60 I169 T172 I173 F176	V52-L56 HydrophobicContact CG1-CD1 3.91Å; V52-L56 HydrophobicContact CG1-CG 4.3Å; V52-L56 VanDerWaalsContact O-CG 3.3Å; V52-L56 WeakPolarHBondContact O-CG 3.2Å; V52-L56 PolarHBondContact O-N 2.7Å; E53-L56 PolarHBondContact O-N 2.91Å; I54-L56 PolarHBondContact O-N 2.93Å; L56-V59 PolarHBondContact O-N 3.18Å; L56-L60 VanDerWaalsContact O-CB 3.27Å; L56-L60 WeakPolarHBondContact O-CB 3.35Å; L56-L60 PolarHBondContact O-N 3.35Å; L56-I169 HydrophobicContact CB-CG2 4.31Å; L56-I169 HydrophobicContact CD2-CG2 4.36Å; L56-T172 HydrophobicContact CD1-CG2 3.86Å; L56-I173 HydrophobicContact CB-CD1 4.04Å; L56-I173 HydrophobicContact CB-CG1 3.83Å; L56-I173 HydrophobicContact CD1-CG1 4.09Å; L56-F176 HydrophobicContact CD1-CD2 3.83Å; L56-F176 HydrophobicContact CD1-CE2 3.67Å
57	C	96	Very high	91.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-40.3	176.1	-68.7	0	0	0	0	111.9	E53 I54 V55 L60 V61 A85	E53-C57 WeakPolarHBondContact O-CB 3.31Å; E53-C57 PolarHBondContact O-N 2.93Å; E53-C57 PolarHBondContact O-SG 3.44Å; I54-C57 PolarHBondContact O-N 2.73Å; V55-C57 VanDerWaalsContact C-N 3.34Å; V55-C57 PolarHBondContact O-N 2.98Å; C57-L60 WeakPolarHBondContact O-CB 3.23Å; C57-L60 PolarHBondContact O-N 3.29Å; C57-V61 WeakPolarHBondContact O-CG2 3.46Å; C57-V61 PolarHBondContact O-N 3.24Å; C57-A85 HydrophobicContact CB-CB 3.9Å
58	I	95.3	Very high	90.9	Very high	93 Å²	93	46 Å²	46	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-48.3	176.3	-68.5	166	0	0	0	110.2	I54 V55 L60 V61 T62	I54-I58 HydrophobicContact CG2-CD1 3.76Å; I54-I58 HydrophobicContact CG2-CG1 4.47Å; I54-I58 VanDerWaalsContact O-CG1 3.31Å; I54-I58 WeakPolarHBondContact O-CG1 3.27Å; I54-I58 PolarHBondContact O-N 3.42Å; V55-I58 PolarHBondContact O-N 3.35Å; I58-L60 VanDerWaalsContact C-N 3.28Å; I58-L60 PolarHBondContact O-N 2.98Å; I58-V61 PolarHBondContact O-N 3.47Å; I58-T62 HydrophobicContact CG2-CG2 4.49Å; I58-T62 WeakPolarHBondContact O-CG2 3.42Å; I58-T62 PolarHBondContact O-N 3.21Å; I58-T62 PolarHBondContact O-OG1 2.81Å
59	V	95.7	Very high	90.5	Very high	58 Å²	58	49.1 Å²	49.1	35%	0.352	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-44	177.2	175.2	0	0	0	0	110.3	V55 L56 V61 T62 L63 I169	V55-V59 HydrophobicContact CG1-CG2 4.38Å; V55-V59 WeakPolarHBondContact O-CG2 3.25Å; V55-V59 PolarHBondContact O-N 2.85Å; L56-V59 PolarHBondContact O-N 3.18Å; V59-V61 PolarHBondContact O-N 2.91Å; V59-T62 WeakPolarHBondContact CA-OG1 3.47Å; V59-T62 PolarHBondContact O-N 3.44Å; V59-T62 PolarHBondContact O-OG1 3.42Å; V59-L63 HydrophobicContact CG1-CD1 4.1Å; V59-L63 HydrophobicContact CG1-CG 4.37Å; V59-L63 WeakPolarHBondContact O-CG 3.3Å; V59-L63 PolarHBondContact O-N 3.22Å; V59-I169 HydrophobicContact CG1-CD1 3.74Å
60	L	94.7	Very high	90.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-44.7	177.3	-174.4	58	0	0	0	112.3	L56 C57 I58 L63 I64 I77 S81 F124 V166 I169 I170 I173	L56-L60 VanDerWaalsContact O-CB 3.27Å; L56-L60 WeakPolarHBondContact O-CB 3.35Å; L56-L60 PolarHBondContact O-N 3.35Å; C57-L60 WeakPolarHBondContact O-CB 3.23Å; C57-L60 PolarHBondContact O-N 3.29Å; I58-L60 VanDerWaalsContact C-N 3.28Å; I58-L60 PolarHBondContact O-N 2.98Å; L60-L63 PolarHBondContact O-N 3.46Å; L60-I64 HydrophobicContact CD1-CD1 3.76Å; L60-I64 HydrophobicContact CG-CD1 4.17Å; L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 2.95Å; L60-I77 HydrophobicContact CD1-CG2 4.5Å; L60-I77 HydrophobicContact CD2-CG2 4.24Å; L60-I77 HydrophobicContact CG-CG2 4.34Å; L60-S81 WeakPolarHBondContact CD2-OG 3.34Å; L60-F124 HydrophobicContact CD2-CE1 4.03Å; L60-V166 HydrophobicContact CD1-CB 4.12Å; L60-V166 HydrophobicContact CD1-CG1 3.83Å; L60-V166 HydrophobicContact CD1-CG2 4.04Å; L60-I169 HydrophobicContact CB-CG2 4.01Å; L60-I169 HydrophobicContact CD1-CB 4.43Å; L60-I169 HydrophobicContact CD1-CG2 4.23Å; L60-I169 HydrophobicContact CD2-CG2 4.41Å; L60-I169 HydrophobicContact CG-CG2 4.47Å; L60-I170 HydrophobicContact CD1-CD1 4.45Å; L60-I170 HydrophobicContact CD1-CG1 4.07Å; L60-I170 HydrophobicContact CD2-CG1 3.79Å; L60-I173 HydrophobicContact CD2-CD1 3.94Å
61	V	94.1	Very high	89.7	Confident	35 Å²	35	50 Å²	50	21%	0.212	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-49.1	174.4	170.9	0	0	0	0	110.5	C57 I58 V59 L63 I64 E65	C57-V61 WeakPolarHBondContact O-CG2 3.46Å; C57-V61 PolarHBondContact O-N 3.24Å; I58-V61 PolarHBondContact O-N 3.47Å; V59-V61 PolarHBondContact O-N 2.91Å; V61-L63 VanDerWaalsContact C-N 3.29Å; V61-L63 PolarHBondContact O-N 3.1Å; V61-I64 PolarHBondContact O-N 2.92Å; V61-I64 VanDerWaalsContact O-N 3.15Å; V61-E65 WeakPolarHBondContact O-CB 3.34Å; V61-E65 PolarHBondContact O-N 3.48Å
62	T	92.8	Very high	89.5	Confident	74 Å²	74	55 Å²	55	45%	0.454	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-32.8	-177.9	59.7	0	0	0	0	113.6	I58 V59 I64	I58-T62 HydrophobicContact CG2-CG2 4.49Å; I58-T62 WeakPolarHBondContact O-CG2 3.42Å; I58-T62 PolarHBondContact O-N 3.21Å; I58-T62 PolarHBondContact O-OG1 2.81Å; V59-T62 WeakPolarHBondContact CA-OG1 3.47Å; V59-T62 PolarHBondContact O-N 3.44Å; V59-T62 PolarHBondContact O-OG1 3.42Å; T62-I64 VanDerWaalsContact C-N 3.35Å
63	L	91.5	Very high	89.3	Confident	42 Å²	42	52.8 Å²	52.8	22%	0.22	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-36.6	177.2	-73.9	173.6	0	0	0	112.1	V59 L60 V61 R162 V166 I169	V59-L63 HydrophobicContact CG1-CD1 4.1Å; V59-L63 HydrophobicContact CG1-CG 4.37Å; V59-L63 WeakPolarHBondContact O-CG 3.3Å; V59-L63 PolarHBondContact O-N 3.22Å; L60-L63 PolarHBondContact O-N 3.46Å; V61-L63 VanDerWaalsContact C-N 3.29Å; V61-L63 PolarHBondContact O-N 3.1Å; L63-R162 HydrophobicContact CD2-CG 4.45Å; L63-V166 HydrophobicContact CB-CG2 3.97Å; L63-V166 HydrophobicContact CD1-CG2 4.32Å; L63-I169 HydrophobicContact CD1-CD1 3.44Å; L63-I169 VanDerWaalsContact CD1-CD1 3.44Å
64	I	90.9	Very high	89.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-93	-25.1	-172.1	-63.2	175.1	0	0	0	112.3	L60 V61 T62 A66 G67 V68 Y74 I77 M78 V166	L60-I64 HydrophobicContact CD1-CD1 3.76Å; L60-I64 HydrophobicContact CG-CD1 4.17Å; L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 2.95Å; V61-I64 PolarHBondContact O-N 2.92Å; V61-I64 VanDerWaalsContact O-N 3.15Å; T62-I64 VanDerWaalsContact C-N 3.35Å; I64-A66 VanDerWaalsContact C-N 3.26Å; I64-A66 PolarHBondContact O-N 3.28Å; I64-A66 VanDerWaalsContact O-N 3.14Å; I64-G67 WeakPolarHBondContact O-CA 3.43Å; I64-G67 PolarHBondContact O-N 3.35Å; I64-V68 PolarHBondContact O-N 3.45Å; I64-Y74 VanDerWaalsContact CG2-CB 3.42Å; I64-Y74 HydrophobicContact CG2-CD1 4.04Å; I64-Y74 HydrophobicContact CG2-CG 3.86Å; I64-I77 HydrophobicContact CD1-CB 3.97Å; I64-I77 HydrophobicContact CD1-CD1 4.48Å; I64-I77 HydrophobicContact CD1-CG2 3.36Å; I64-M78 HydrophobicContact CB-CG 4.13Å; I64-M78 HydrophobicContact CG2-CG 3.77Å; I64-V166 HydrophobicContact CD1-CB 4.41Å; I64-V166 HydrophobicContact CD1-CG1 3.73Å; I64-V166 HydrophobicContact CD1-CG2 3.77Å; I64-V166 HydrophobicContact CG1-CB 4.5Å; I64-V166 HydrophobicContact CG1-CG1 4.28Å; I64-V166 HydrophobicContact CG1-CG2 3.42Å; I64-V166 VanDerWaalsContact CG1-CG2 3.42Å
65	E	89.6	Confident	89.2	Confident	125 Å²	125	53.3 Å²	53.3	58%	0.584	28%	0.283	S	S	*	.	H	α-helix	trans	-48.8	-45.1	-175.7	-177.7	177.4	-167.9	0	0	112.8	V61 G67 V68 M78	V61-E65 WeakPolarHBondContact O-CB 3.34Å; V61-E65 PolarHBondContact O-N 3.48Å; E65-G67 PolarHBondContact O-N 3.45Å; E65-V68 VanDerWaalsContact O-CG2 3.28Å; E65-V68 WeakPolarHBondContact O-CG2 3.45Å; E65-M78 HydrophobicContact CB-SD 4.39Å
66	A	82.6	Confident	89	Confident	68 Å²	68	52.9 Å²	52.9	56%	0.562	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.4	178.7	0	0	0	0	0	113.6	I64	I64-A66 VanDerWaalsContact C-N 3.26Å; I64-A66 PolarHBondContact O-N 3.28Å; I64-A66 VanDerWaalsContact O-N 3.14Å
67	G	79.8	Confident	89	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	1	-175.3	0	0	0	0	0	115.9	I64 E65 H69 L70 Y74	I64-G67 WeakPolarHBondContact O-CA 3.43Å; I64-G67 PolarHBondContact O-N 3.35Å; E65-G67 PolarHBondContact O-N 3.45Å; G67-H69 PolarHBondContact O-N 3.2Å; G67-L70 VanDerWaalsContact CA-CD1 3.47Å; G67-L70 WeakPolarHBondContact O-CA 3.23Å; G67-L70 WeakPolarHBondContact O-CB 3.39Å; G67-L70 PolarHBondContact O-N 3.02Å; G67-Y74 WeakPolarHBondContact O-CD2 3.3Å
68	V	79.2	Confident	88.9	Confident	41 Å²	41	53.4 Å²	53.4	25%	0.248	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-30.8	-177	-177.6	0	0	0	0	112.5	I64 E65 L70 M78	I64-V68 PolarHBondContact O-N 3.45Å; E65-V68 VanDerWaalsContact O-CG2 3.28Å; E65-V68 WeakPolarHBondContact O-CG2 3.45Å; V68-L70 VanDerWaalsContact C-N 3.31Å; V68-M78 HydrophobicContact CB-CE 4.07Å; V68-M78 HydrophobicContact CG1-CE 3.77Å; V68-M78 HydrophobicContact CG2-CE 3.09Å; V68-M78 HydrophobicContact CG2-CG 4.22Å; V68-M78 HydrophobicContact CG2-SD 3.24Å; V68-M78 WeakPolarHBondContact CG2-SD 3.5Å
69	H	79	Confident	88.8	Confident	154 Å²	154	55.9 Å²	55.9	71%	0.713	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.2	176.3	-56.8	-67.8	0	0	0	113.9	G67 N148	G67-H69 PolarHBondContact O-N 3.2Å; H69-N148 PolarHBondContact O-ND2 2.91Å
70	L	78.4	Confident	88.8	Confident	23 Å²	23	53.8 Å²	53.8	12%	0.12	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-39.7	178.1	-57.3	164.1	0	0	0	111	G67 V68 Y74 H146 D147 N148 W159	G67-L70 VanDerWaalsContact CA-CD1 3.47Å; G67-L70 WeakPolarHBondContact O-CA 3.23Å; G67-L70 WeakPolarHBondContact O-CB 3.39Å; G67-L70 PolarHBondContact O-N 3.02Å; V68-L70 VanDerWaalsContact C-N 3.31Å; L70-Y74 HydrophobicContact CB-CD2 4.5Å; L70-Y74 HydrophobicContact CB-CE2 4.13Å; L70-H146 HydrophobicContact CB-CB 4.46Å; L70-D147 PolarHBondContact O-N 3.27Å; L70-N148 HydrophobicContact CD2-CB 4.28Å; L70-N148 WeakPolarHBondContact CD2-O 3.4Å; L70-W159 HydrophobicContact CD1-CD2 3.66Å; L70-W159 HydrophobicContact CD1-CE3 4.01Å; L70-W159 HydrophobicContact CD1-CG 4.21Å; L70-W159 HydrophobicContact CD1-CH2 4.25Å; L70-W159 HydrophobicContact CD1-CZ2 3.82Å; L70-W159 HydrophobicContact CD1-CZ3 4.3Å
71	W	82.6	Confident	88.8	Confident	37 Å²	37	53.8 Å²	53.8	14%	0.14	27%	0.271	C	S	.	.			trans	-153.1	129.1	-174.7	-168.3	46.7	0	0	0	112.5	A73 Y74 L130 Y133 D134	W71-A73 HydrophobicContact CD2-CB 3.55Å; W71-A73 HydrophobicContact CE3-CB 3.49Å; W71-A73 VanDerWaalsContact CE3-CB 3.49Å; W71-A73 HydrophobicContact CG-CB 4.39Å; W71-A73 HydrophobicContact CH2-CB 3.51Å; W71-A73 HydrophobicContact CZ2-CB 3.55Å; W71-A73 HydrophobicContact CZ3-CB 3.48Å; W71-A73 VanDerWaalsContact CZ3-CB 3.48Å; W71-A73 PolarHBondContact O-N 3.44Å; W71-A73 VanDerWaalsContact O-N 3.11Å; W71-Y74 HydrophobicContact CB-CD2 3.5Å; W71-Y74 HydrophobicContact CB-CE2 3.43Å; W71-Y74 VanDerWaalsContact CB-CE2 3.43Å; W71-Y74 HydrophobicContact CB-CG 4.29Å; W71-Y74 AromaticContact CE3-CD1 3.9Å; W71-Y74 HydrophobicContact CE3-CD1 3.9Å; W71-Y74 HydrophobicContact CE3-CD2 4.39Å; W71-Y74 AromaticContact CE3-CE1 3.6Å; W71-Y74 HydrophobicContact CE3-CE1 3.6Å; W71-Y74 HydrophobicContact CE3-CE2 4.15Å; W71-Y74 HydrophobicContact CE3-CG 4.28Å; W71-Y74 AromaticContact CE3-CZ 3.74Å; W71-Y74 HydrophobicContact CG-CE2 4.43Å; W71-Y74 HydrophobicContact CZ3-CE1 4.13Å; W71-Y74 VanDerWaalsContact O-CB 3.29Å; W71-Y74 WeakPolarHBondContact O-CB 3.27Å; W71-Y74 WeakPolarHBondContact O-CD2 3.15Å; W71-Y74 PolarHBondContact O-N 2.92Å; W71-L130 HydrophobicContact CH2-CB 4.08Å; W71-L130 HydrophobicContact CH2-CD2 4.01Å; W71-L130 HydrophobicContact CZ2-CD2 4.4Å; W71-L130 HydrophobicContact CZ3-CB 4.38Å; W71-Y133 HydrophobicContact CH2-CD1 4.15Å; W71-Y133 HydrophobicContact CZ2-CD1 4.12Å; W71-Y133 HydrophobicContact CZ2-CE1 4.37Å; W71-D134 HydrophobicContact CE3-CB 4.43Å; W71-D134 HydrophobicContact CH2-CB 4.2Å; W71-D134 HydrophobicContact CZ3-CB 3.76Å
72	R	86.8	Confident	88.9	Confident	212 Å²	212	54.6 Å²	54.6	80%	0.8	28%	0.282	S	S	*	.	H	α-helix	trans	-56.5	-31.4	-178.8	-68.9	-178.4	175.9	-170.5	-2.2	113.8	Y74 G75 F76	R72-Y74 PolarHBondContact O-N 3.39Å; R72-G75 PolarHBondContact O-N 3.23Å; R72-F76 PolarHBondContact O-N 3.46Å
73	A	89.7	Confident	89.1	Confident	15 Å²	15	52.9 Å²	52.9	12%	0.124	28%	0.276	C	S	.	.	H	α-helix	trans	-67.9	-25.9	-178.1	0	0	0	0	0	112.3	W71 G75 F76 I77 L130	W71-A73 HydrophobicContact CD2-CB 3.55Å; W71-A73 HydrophobicContact CE3-CB 3.49Å; W71-A73 VanDerWaalsContact CE3-CB 3.49Å; W71-A73 HydrophobicContact CG-CB 4.39Å; W71-A73 HydrophobicContact CH2-CB 3.51Å; W71-A73 HydrophobicContact CZ2-CB 3.55Å; W71-A73 HydrophobicContact CZ3-CB 3.48Å; W71-A73 VanDerWaalsContact CZ3-CB 3.48Å; W71-A73 PolarHBondContact O-N 3.44Å; W71-A73 VanDerWaalsContact O-N 3.11Å; A73-G75 VanDerWaalsContact C-N 3.28Å; A73-G75 PolarHBondContact O-N 3.08Å; A73-F76 WeakPolarHBondContact O-CB 3.2Å; A73-F76 PolarHBondContact O-N 3.49Å; A73-F76 VanDerWaalsContact O-N 3.11Å; A73-I77 WeakPolarHBondContact O-CG1 3.49Å; A73-I77 PolarHBondContact O-N 3.47Å; A73-L130 HydrophobicContact CB-CD1 4.09Å; A73-L130 HydrophobicContact CB-CD2 4.13Å
74	Y	91.2	Very high	89.3	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-37	170.3	-65.3	-36.5	0	0	0	112.3	I64 G67 L70 W71 R72 F76 I77 M78 D134 H146 W159 I163	I64-Y74 VanDerWaalsContact CG2-CB 3.42Å; I64-Y74 HydrophobicContact CG2-CD1 4.04Å; I64-Y74 HydrophobicContact CG2-CG 3.86Å; G67-Y74 WeakPolarHBondContact O-CD2 3.3Å; L70-Y74 HydrophobicContact CB-CD2 4.5Å; L70-Y74 HydrophobicContact CB-CE2 4.13Å; W71-Y74 HydrophobicContact CB-CD2 3.5Å; W71-Y74 HydrophobicContact CB-CE2 3.43Å; W71-Y74 VanDerWaalsContact CB-CE2 3.43Å; W71-Y74 HydrophobicContact CB-CG 4.29Å; W71-Y74 AromaticContact CE3-CD1 3.9Å; W71-Y74 HydrophobicContact CE3-CD1 3.9Å; W71-Y74 HydrophobicContact CE3-CD2 4.39Å; W71-Y74 AromaticContact CE3-CE1 3.6Å; W71-Y74 HydrophobicContact CE3-CE1 3.6Å; W71-Y74 HydrophobicContact CE3-CE2 4.15Å; W71-Y74 HydrophobicContact CE3-CG 4.28Å; W71-Y74 AromaticContact CE3-CZ 3.74Å; W71-Y74 HydrophobicContact CG-CE2 4.43Å; W71-Y74 HydrophobicContact CZ3-CE1 4.13Å; W71-Y74 VanDerWaalsContact O-CB 3.29Å; W71-Y74 WeakPolarHBondContact O-CB 3.27Å; W71-Y74 WeakPolarHBondContact O-CD2 3.15Å; W71-Y74 PolarHBondContact O-N 2.92Å; R72-Y74 PolarHBondContact O-N 3.39Å; Y74-F76 VanDerWaalsContact C-N 3.28Å; Y74-F76 PolarHBondContact O-N 2.83Å; Y74-I77 HydrophobicContact CD1-CD1 4.43Å; Y74-I77 PolarHBondContact O-N 3.35Å; Y74-M78 WeakPolarHBondContact O-CG 3.25Å; Y74-M78 PolarHBondContact O-N 3.22Å; Y74-D134 WeakPolarHBondContact CE1-OD2 3.47Å; Y74-D134 VanDerWaalsContact CZ-OD2 3.25Å; Y74-D134 PolarHBondContact OH-OD1 3.02Å; Y74-D134 PolarHBondContact OH-OD2 3.25Å; Y74-H146 PolarHBondContact OH-CE1 3.46Å; Y74-H146 PolarHBondContact OH-NE2 3.44Å; Y74-W159 AromaticContact CD2-CZ2 3.94Å; Y74-W159 HydrophobicContact CD2-CZ2 3.94Å; Y74-W159 HydrophobicContact CE1-CZ2 4.03Å; Y74-W159 AromaticContact CE2-CE2 3.94Å; Y74-W159 HydrophobicContact CE2-CH2 4.34Å; Y74-W159 AromaticContact CE2-CZ2 3.32Å; Y74-W159 HydrophobicContact CE2-CZ2 3.32Å; Y74-W159 AromaticContact CZ-CE2 3.9Å; Y74-W159 AromaticContact CZ-CZ2 3.38Å; Y74-W159 AromaticContact CZ-NE1 3.8Å; Y74-W159 WeakPolarHBondContact OH-CZ2 3.49Å; Y74-W159 PolarHBondContact OH-NE1 3.32Å; Y74-I163 HydrophobicContact CD1-CD1 4.47Å; Y74-I163 HydrophobicContact CE1-CD1 3.49Å; Y74-I163 VanDerWaalsContact CE1-CD1 3.49Å; Y74-I163 WeakPolarHBondContact OH-CD1 3.36Å
75	G	91.8	Very high	89.4	Confident	25 Å²	25	51.9 Å²	51.9	26%	0.258	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-39.6	172.2	0	0	0	0	0	112.5	R72 A73 F79	R72-G75 PolarHBondContact O-N 3.23Å; A73-G75 VanDerWaalsContact C-N 3.28Å; A73-G75 PolarHBondContact O-N 3.08Å; G75-F79 WeakPolarHBondContact O-CB 3.49Å; G75-F79 PolarHBondContact O-N 3.21Å
76	F	92.4	Very high	89.7	Confident	76 Å²	76	48.8 Å²	48.8	33%	0.333	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-47	173.7	173.6	-98.8	0	0	0	112.1	R72 A73 Y74 M78 F79 V80 I126 L130	R72-F76 PolarHBondContact O-N 3.46Å; A73-F76 WeakPolarHBondContact O-CB 3.2Å; A73-F76 PolarHBondContact O-N 3.49Å; A73-F76 VanDerWaalsContact O-N 3.11Å; Y74-F76 VanDerWaalsContact C-N 3.28Å; Y74-F76 PolarHBondContact O-N 2.83Å; F76-M78 VanDerWaalsContact C-N 3.33Å; F76-M78 PolarHBondContact O-N 3.35Å; F76-F79 PolarHBondContact O-N 3.05Å; F76-V80 HydrophobicContact CD1-CG2 4.33Å; F76-V80 HydrophobicContact CD2-CG2 4.22Å; F76-V80 HydrophobicContact CE1-CG2 3.88Å; F76-V80 HydrophobicContact CE2-CG2 3.76Å; F76-V80 HydrophobicContact CG-CG2 4.49Å; F76-V80 HydrophobicContact CZ-CG2 3.58Å; F76-V80 WeakPolarHBondContact O-CG2 3.39Å; F76-V80 PolarHBondContact O-N 3.21Å; F76-I126 HydrophobicContact CE1-CB 4.31Å; F76-I126 HydrophobicContact CE1-CG2 3.84Å; F76-I126 HydrophobicContact CZ-CG2 4.16Å; F76-L130 HydrophobicContact CD1-CD1 3.78Å; F76-L130 HydrophobicContact CE1-CD1 4.22Å
77	I	94.2	Very high	90.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-43.7	179.1	-60.3	174.1	0	0	0	110.7	L60 I64 A73 Y74 V80 S81 A127 I170	L60-I77 HydrophobicContact CD1-CG2 4.5Å; L60-I77 HydrophobicContact CD2-CG2 4.24Å; L60-I77 HydrophobicContact CG-CG2 4.34Å; I64-I77 HydrophobicContact CD1-CB 3.97Å; I64-I77 HydrophobicContact CD1-CD1 4.48Å; I64-I77 HydrophobicContact CD1-CG2 3.36Å; A73-I77 WeakPolarHBondContact O-CG1 3.49Å; A73-I77 PolarHBondContact O-N 3.47Å; Y74-I77 HydrophobicContact CD1-CD1 4.43Å; Y74-I77 PolarHBondContact O-N 3.35Å; I77-V80 PolarHBondContact O-N 2.88Å; I77-S81 WeakPolarHBondContact O-CB 3.38Å; I77-S81 PolarHBondContact O-N 3.06Å; I77-S81 PolarHBondContact O-OG 2.83Å; I77-A127 HydrophobicContact CG1-CB 3.99Å; I77-A127 HydrophobicContact CG2-CB 4.49Å; I77-I170 HydrophobicContact CD1-CD1 4.5Å; I77-I170 HydrophobicContact CG2-CD1 4.19Å
78	M	93.8	Very high	90.9	Very high	42 Å²	42	49 Å²	49	21%	0.207	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-47.3	174.9	-74.5	-157.5	-46.8	0	0	112.1	I64 E65 V68 Y74 F76 V80 S81 A82	I64-M78 HydrophobicContact CB-CG 4.13Å; I64-M78 HydrophobicContact CG2-CG 3.77Å; E65-M78 HydrophobicContact CB-SD 4.39Å; V68-M78 HydrophobicContact CB-CE 4.07Å; V68-M78 HydrophobicContact CG1-CE 3.77Å; V68-M78 HydrophobicContact CG2-CE 3.09Å; V68-M78 HydrophobicContact CG2-CG 4.22Å; V68-M78 HydrophobicContact CG2-SD 3.24Å; V68-M78 WeakPolarHBondContact CG2-SD 3.5Å; Y74-M78 WeakPolarHBondContact O-CG 3.25Å; Y74-M78 PolarHBondContact O-N 3.22Å; F76-M78 VanDerWaalsContact C-N 3.33Å; F76-M78 PolarHBondContact O-N 3.35Å; M78-V80 PolarHBondContact O-N 3.05Å; M78-S81 PolarHBondContact O-N 2.67Å; M78-A82 WeakPolarHBondContact O-CB 3.41Å; M78-A82 PolarHBondContact O-N 2.95Å
79	F	94.6	Very high	91.6	Very high	145 Å²	145	52.5 Å²	52.5	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-60	-48.1	-179.8	175	-99.8	0	0	0	111.5	G75 F76 S81 A82 A83	G75-F79 WeakPolarHBondContact O-CB 3.49Å; G75-F79 PolarHBondContact O-N 3.21Å; F76-F79 PolarHBondContact O-N 3.05Å; F79-S81 VanDerWaalsContact C-N 3.3Å; F79-S81 PolarHBondContact O-N 2.95Å; F79-A82 PolarHBondContact O-N 3.43Å; F79-A83 VanDerWaalsContact O-CB 3.23Å; F79-A83 WeakPolarHBondContact O-CB 3.15Å; F79-A83 PolarHBondContact O-N 3.13Å
80	V	95.3	Very high	92.2	Very high	14 Å²	14	47.8 Å²	47.8	9%	0.085	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-43.5	177.2	170.4	0	0	0	0	110.9	F76 I77 M78 C84 C123 F124	F76-V80 HydrophobicContact CD1-CG2 4.33Å; F76-V80 HydrophobicContact CD2-CG2 4.22Å; F76-V80 HydrophobicContact CE1-CG2 3.88Å; F76-V80 HydrophobicContact CE2-CG2 3.76Å; F76-V80 HydrophobicContact CG-CG2 4.49Å; F76-V80 HydrophobicContact CZ-CG2 3.58Å; F76-V80 WeakPolarHBondContact O-CG2 3.39Å; F76-V80 PolarHBondContact O-N 3.21Å; I77-V80 PolarHBondContact O-N 2.88Å; M78-V80 PolarHBondContact O-N 3.05Å; V80-C84 WeakPolarHBondContact O-CB 3.49Å; V80-C84 PolarHBondContact O-N 2.64Å; V80-C123 HydrophobicContact CG1-CB 3.67Å; V80-C123 HydrophobicContact CG2-CB 4.17Å; V80-F124 HydrophobicContact CG1-CD1 4.32Å; V80-F124 HydrophobicContact CG1-CD2 4.38Å; V80-F124 HydrophobicContact CG1-CE1 4.15Å; V80-F124 HydrophobicContact CG1-CE2 4.2Å; V80-F124 HydrophobicContact CG1-CG 4.44Å; V80-F124 HydrophobicContact CG1-CZ 4.08Å
81	S	95.5	Very high	92.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-45.4	-178.9	-54.6	0	0	0	0	112.1	L60 I77 M78 F79 C84 A85	L60-S81 WeakPolarHBondContact CD2-OG 3.34Å; I77-S81 WeakPolarHBondContact O-CB 3.38Å; I77-S81 PolarHBondContact O-N 3.06Å; I77-S81 PolarHBondContact O-OG 2.83Å; M78-S81 PolarHBondContact O-N 2.67Å; F79-S81 VanDerWaalsContact C-N 3.3Å; F79-S81 PolarHBondContact O-N 2.95Å; S81-C84 PolarHBondContact O-N 3.03Å; S81-A85 WeakPolarHBondContact O-CB 3.4Å; S81-A85 PolarHBondContact O-N 3.42Å
82	A	95.7	Very high	93	Very high	53 Å²	53	46.2 Å²	46.2	44%	0.438	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-44.1	177.6	0	0	0	0	0	111.8	M78 F79 C84 A85 A86	M78-A82 WeakPolarHBondContact O-CB 3.41Å; M78-A82 PolarHBondContact O-N 2.95Å; F79-A82 PolarHBondContact O-N 3.43Å; A82-C84 VanDerWaalsContact C-N 3.35Å; A82-A85 PolarHBondContact O-N 3.23Å; A82-A86 WeakPolarHBondContact O-CB 3.4Å; A82-A86 PolarHBondContact O-N 3.36Å
83	A	95.8	Very high	93.1	Very high	38 Å²	38	38.2 Å²	38.2	31%	0.314	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-42.3	175.9	0	0	0	0	0	111.4	F79 A86 V87	F79-A83 VanDerWaalsContact O-CB 3.23Å; F79-A83 WeakPolarHBondContact O-CB 3.15Å; F79-A83 PolarHBondContact O-N 3.13Å; A83-A86 PolarHBondContact O-N 2.86Å; A83-V87 WeakPolarHBondContact O-CG2 3.31Å; A83-V87 PolarHBondContact O-N 3.45Å
84	C	95.6	Very high	92.9	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-50.6	175.7	-179.3	0	0	0	0	111.2	E53 V80 S81 A82 A86 V87 T88 F124	E53-C84 PolarHBondContact OE1-SG 3.16Å; V80-C84 WeakPolarHBondContact O-CB 3.49Å; V80-C84 PolarHBondContact O-N 2.64Å; S81-C84 PolarHBondContact O-N 3.03Å; A82-C84 VanDerWaalsContact C-N 3.35Å; C84-A86 VanDerWaalsContact C-N 3.32Å; C84-A86 PolarHBondContact O-N 3.36Å; C84-V87 PolarHBondContact O-N 2.95Å; C84-T88 VanDerWaalsContact O-CB 3.24Å; C84-T88 WeakPolarHBondContact O-CB 3.33Å; C84-T88 PolarHBondContact O-N 3.35Å; C84-T88 PolarHBondContact O-OG1 3Å; C84-T88 VanDerWaalsContact O-OG1 3.05Å; C84-F124 HydrophobicContact CB-CE2 3.84Å; C84-F124 HydrophobicContact CB-CZ 3.99Å
85	A	94.9	Very high	92.5	Very high	15 Å²	15	43.6 Å²	43.6	12%	0.124	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-44.9	177.7	0	0	0	0	0	112.1	C57 S81 A82 F89	C57-A85 HydrophobicContact CB-CB 3.9Å; S81-A85 WeakPolarHBondContact O-CB 3.4Å; S81-A85 PolarHBondContact O-N 3.42Å; A82-A85 PolarHBondContact O-N 3.23Å; A85-F89 VanDerWaalsContact O-CB 3.3Å; A85-F89 WeakPolarHBondContact O-CB 3.49Å; A85-F89 PolarHBondContact O-N 3.32Å
86	A	95.7	Very high	92.2	Very high	60 Å²	60	46.4 Å²	46.4	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-46.3	179.8	0	0	0	0	0	112.4	A82 A83 C84 F89 A90	A82-A86 WeakPolarHBondContact O-CB 3.4Å; A82-A86 PolarHBondContact O-N 3.36Å; A83-A86 PolarHBondContact O-N 2.86Å; C84-A86 VanDerWaalsContact C-N 3.32Å; C84-A86 PolarHBondContact O-N 3.36Å; A86-F89 PolarHBondContact O-N 2.9Å; A86-A90 WeakPolarHBondContact O-CB 3.41Å; A86-A90 PolarHBondContact O-N 3.38Å
87	V	93.6	Very high	91.8	Very high	70 Å²	70	46.1 Å²	46.1	42%	0.424	27%	0.274	S	S	.	.	H	α-helix	trans	-69.9	-39.7	179.7	177.1	0	0	0	0	111.3	A83 C84 F89 A90 G91 F116	A83-V87 WeakPolarHBondContact O-CG2 3.31Å; A83-V87 PolarHBondContact O-N 3.45Å; C84-V87 PolarHBondContact O-N 2.95Å; V87-F89 VanDerWaalsContact C-N 3.34Å; V87-F89 PolarHBondContact O-N 3.04Å; V87-A90 PolarHBondContact O-N 3.36Å; V87-G91 PolarHBondContact O-N 2.97Å; V87-F116 HydrophobicContact CB-CD2 4.1Å; V87-F116 HydrophobicContact CB-CE2 3.42Å; V87-F116 VanDerWaalsContact CB-CE2 3.42Å; V87-F116 HydrophobicContact CB-CZ 3.72Å; V87-F116 HydrophobicContact CG1-CD1 4.41Å; V87-F116 HydrophobicContact CG1-CD2 3.36Å; V87-F116 HydrophobicContact CG1-CE1 4.31Å; V87-F116 HydrophobicContact CG1-CE2 3.24Å; V87-F116 HydrophobicContact CG1-CG 3.96Å; V87-F116 HydrophobicContact CG1-CZ 3.73Å; V87-F116 HydrophobicContact CG2-CE2 4.08Å
88	T	92.8	Very high	91.1	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-43.8	174.8	-69.8	0	0	0	0	111.3	K50 E53 I54 C84 G91 L92 F116	K50-T88 HydrophobicContact CB-CG2 4Å; K50-T88 HydrophobicContact CD-CG2 3.65Å; K50-T88 HydrophobicContact CG-CG2 4.47Å; E53-T88 HydrophobicContact CG-CG2 4.47Å; E53-T88 PolarHBondContact OE1-OG1 2.85Å; E53-T88 VanDerWaalsContact OE2-CG2 3.23Å; E53-T88 WeakPolarHBondContact OE2-CG2 3.49Å; E53-T88 PolarHBondContact OE2-OG1 2.66Å; I54-T88 HydrophobicContact CD1-CG2 3.93Å; I54-T88 HydrophobicContact CG1-CG2 3.67Å; C84-T88 VanDerWaalsContact O-CB 3.24Å; C84-T88 WeakPolarHBondContact O-CB 3.33Å; C84-T88 PolarHBondContact O-N 3.35Å; C84-T88 PolarHBondContact O-OG1 3Å; C84-T88 VanDerWaalsContact O-OG1 3.05Å; T88-G91 PolarHBondContact O-N 3.33Å; T88-L92 PolarHBondContact O-N 3.41Å; T88-F116 WeakPolarHBondContact OG1-CE1 3.33Å
89	F	93.3	Very high	90.4	Very high	115 Å²	115	48 Å²	48	50%	0.504	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-44.9	174.5	-177.3	-96.7	0	0	0	112	W51 I54 A85 A86 V87 G91 L92 A93	W51-F89 HydrophobicContact CH2-CD2 4.4Å; W51-F89 HydrophobicContact CH2-CE2 4.19Å; I54-F89 HydrophobicContact CD1-CB 4.14Å; I54-F89 HydrophobicContact CD1-CD2 4.36Å; A85-F89 VanDerWaalsContact O-CB 3.3Å; A85-F89 WeakPolarHBondContact O-CB 3.49Å; A85-F89 PolarHBondContact O-N 3.32Å; A86-F89 PolarHBondContact O-N 2.9Å; V87-F89 VanDerWaalsContact C-N 3.34Å; V87-F89 PolarHBondContact O-N 3.04Å; F89-G91 VanDerWaalsContact C-N 3.29Å; F89-G91 PolarHBondContact O-N 2.97Å; F89-L92 WeakPolarHBondContact O-CB 3.48Å; F89-L92 PolarHBondContact O-N 2.91Å; F89-A93 PolarHBondContact O-N 3.27Å
90	A	91.7	Very high	89.6	Confident	55 Å²	55	45 Å²	45	46%	0.455	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-39.6	175.9	0	0	0	0	0	111.9	A86 V87 A93 F94	A86-A90 WeakPolarHBondContact O-CB 3.41Å; A86-A90 PolarHBondContact O-N 3.38Å; V87-A90 PolarHBondContact O-N 3.36Å; A90-A93 PolarHBondContact O-N 3.47Å; A90-F94 WeakPolarHBondContact O-CB 3.41Å; A90-F94 PolarHBondContact O-N 2.96Å
91	G	89.1	Confident	88.8	Confident	21 Å²	21	48.6 Å²	48.6	22%	0.216	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-42.6	174.8	0	0	0	0	0	112.7	V87 T88 F89 F94 K95 F109	V87-G91 PolarHBondContact O-N 2.97Å; T88-G91 PolarHBondContact O-N 3.33Å; F89-G91 VanDerWaalsContact C-N 3.29Å; F89-G91 PolarHBondContact O-N 2.97Å; G91-F94 PolarHBondContact O-N 3.05Å; G91-K95 WeakPolarHBondContact O-CB 3.37Å; G91-K95 PolarHBondContact O-N 3.36Å; G91-F109 WeakPolarHBondContact O-CE2 3.24Å; G91-F109 WeakPolarHBondContact O-CZ 3.27Å
92	L	89.2	Confident	87.7	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-47.4	172.9	-77	175.9	0	0	0	111.8	W41 F46 A47 K50 W51 I54 T88 F89 F94 K95 F96	W41-L92 HydrophobicContact CH2-CB 4Å; W41-L92 HydrophobicContact CH2-CD2 3.59Å; W41-L92 HydrophobicContact CH2-CG 4.4Å; W41-L92 VanDerWaalsContact CH2-O 3.25Å; W41-L92 WeakPolarHBondContact CH2-O 3.16Å; W41-L92 HydrophobicContact CZ2-CD2 3.8Å; F46-L92 HydrophobicContact CE1-CD2 4.43Å; A47-L92 HydrophobicContact CB-CD2 4.31Å; K50-L92 HydrophobicContact CB-CD1 3.77Å; K50-L92 HydrophobicContact CB-CD2 3.77Å; K50-L92 HydrophobicContact CB-CG 3.89Å; K50-L92 HydrophobicContact CG-CD2 4.08Å; K50-L92 HydrophobicContact CG-CG 4.41Å; W51-L92 HydrophobicContact CD2-CD1 4.27Å; W51-L92 HydrophobicContact CZ2-CD1 4.43Å; I54-L92 HydrophobicContact CD1-CD1 3.9Å; T88-L92 PolarHBondContact O-N 3.41Å; F89-L92 WeakPolarHBondContact O-CB 3.48Å; F89-L92 PolarHBondContact O-N 2.91Å; L92-F94 VanDerWaalsContact C-N 3.33Å; L92-F94 PolarHBondContact O-N 3.22Å; L92-K95 PolarHBondContact O-N 2.96Å; L92-F96 WeakPolarHBondContact O-CB 3.37Å; L92-F96 PolarHBondContact O-N 3.43Å
93	A	88.6	Confident	86.4	Confident	44 Å²	44	56.9 Å²	56.9	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-42.8	178.3	0	0	0	0	0	111.7	F89 A90 F96 C97	F89-A93 PolarHBondContact O-N 3.27Å; A90-A93 PolarHBondContact O-N 3.47Å; A93-F96 WeakPolarHBondContact O-CB 3.29Å; A93-F96 PolarHBondContact O-N 2.91Å; A93-C97 PolarHBondContact O-N 3.48Å; A93-C97 PolarHBondContact O-SG 2.8Å; A93-C97 VanDerWaalsContact O-SG 3.35Å
94	F	86.3	Confident	85	Confident	86 Å²	86	60.2 Å²	60.2	38%	0.377	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-46	176.5	-175.7	-87.9	0	0	0	111.7	A90 G91 L92 F96 C97 Q98 F107 F109	A90-F94 WeakPolarHBondContact O-CB 3.41Å; A90-F94 PolarHBondContact O-N 2.96Å; G91-F94 PolarHBondContact O-N 3.05Å; L92-F94 VanDerWaalsContact C-N 3.33Å; L92-F94 PolarHBondContact O-N 3.22Å; F94-F96 VanDerWaalsContact C-N 3.31Å; F94-F96 PolarHBondContact O-N 2.89Å; F94-C97 PolarHBondContact O-N 2.97Å; F94-Q98 PolarHBondContact O-N 2.89Å; F94-F107 HydrophobicContact CD1-CD1 4.22Å; F94-F107 HydrophobicContact CD1-CE1 4.28Å; F94-F107 HydrophobicContact CE1-CB 4.12Å; F94-F107 AromaticContact CE1-CD1 3.24Å; F94-F107 HydrophobicContact CE1-CD1 3.24Å; F94-F107 HydrophobicContact CE1-CD2 4.5Å; F94-F107 AromaticContact CE1-CE1 3.64Å; F94-F107 HydrophobicContact CE1-CE1 3.64Å; F94-F107 AromaticContact CE1-CG 3.72Å; F94-F107 HydrophobicContact CE1-CG 3.72Å; F94-F107 HydrophobicContact CE1-CZ 4.41Å; F94-F107 HydrophobicContact CZ-CB 3.99Å; F94-F107 AromaticContact CZ-CD1 3.58Å; F94-F107 HydrophobicContact CZ-CD1 3.58Å; F94-F107 AromaticContact CZ-CD2 4Å; F94-F107 HydrophobicContact CZ-CD2 4Å; F94-F107 AromaticContact CZ-CE1 3.95Å; F94-F107 HydrophobicContact CZ-CE1 3.95Å; F94-F107 HydrophobicContact CZ-CE2 4.34Å; F94-F107 AromaticContact CZ-CG 3.58Å; F94-F107 HydrophobicContact CZ-CG 3.58Å; F94-F107 HydrophobicContact CZ-CZ 4.3Å; F94-F109 AromaticContact CD1-CD2 3.65Å; F94-F109 HydrophobicContact CD1-CD2 3.65Å; F94-F109 AromaticContact CD1-CE2 3.97Å; F94-F109 HydrophobicContact CD1-CE2 3.97Å; F94-F109 HydrophobicContact CE1-CD2 4.1Å
95	K	83.4	Confident	83.4	Confident	42 Å²	42	63.9 Å²	63.9	18%	0.183	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-39.6	177.6	-171.4	171.4	-169.5	166.9	0	111.7	W41 F46 G91 L92 Q98 I99 F109	W41-K95 HydrophobicContact CZ2-CB 3.84Å; W41-K95 HydrophobicContact CZ2-CD 3.92Å; W41-K95 HydrophobicContact CZ2-CG 3.87Å; F46-K95 HydrophobicContact CD1-CD 3.98Å; F46-K95 HydrophobicContact CE1-CD 3.58Å; F46-K95 VanDerWaalsContact CE1-NZ 3.32Å; F46-K95 HydrophobicContact CZ-CD 4.39Å; G91-K95 WeakPolarHBondContact O-CB 3.37Å; G91-K95 PolarHBondContact O-N 3.36Å; L92-K95 PolarHBondContact O-N 2.96Å; K95-Q98 PolarHBondContact O-N 3.39Å; K95-I99 HydrophobicContact CG-CD1 4.34Å; K95-I99 WeakPolarHBondContact O-CG1 3.4Å; K95-I99 PolarHBondContact O-N 2.87Å; K95-F109 HydrophobicContact CB-CE1 4.37Å; K95-F109 HydrophobicContact CB-CE2 4Å; K95-F109 HydrophobicContact CB-CZ 3.87Å; K95-F109 HydrophobicContact CD-CD1 4.36Å; K95-F109 HydrophobicContact CD-CE1 3.79Å; K95-F109 HydrophobicContact CD-CZ 4.07Å; K95-F109 HydrophobicContact CG-CE1 4.41Å; K95-F109 HydrophobicContact CG-CZ 4.4Å
96	F	84.3	Confident	82	Confident	85 Å²	85	67.3 Å²	67.3	37%	0.373	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-49.2	173.3	177.4	-98.7	0	0	0	111.8	W41 L92 A93 F94 Q98 I99 Q100	W41-F96 HydrophobicContact CE3-CD2 4.25Å; W41-F96 HydrophobicContact CH2-CB 4.19Å; W41-F96 HydrophobicContact CZ3-CB 4.14Å; W41-F96 HydrophobicContact CZ3-CD2 4.36Å; L92-F96 WeakPolarHBondContact O-CB 3.37Å; L92-F96 PolarHBondContact O-N 3.43Å; A93-F96 WeakPolarHBondContact O-CB 3.29Å; A93-F96 PolarHBondContact O-N 2.91Å; F94-F96 VanDerWaalsContact C-N 3.31Å; F94-F96 PolarHBondContact O-N 2.89Å; F96-Q98 VanDerWaalsContact C-N 3.29Å; F96-Q98 PolarHBondContact O-N 3.31Å; F96-I99 PolarHBondContact O-N 3.21Å; F96-Q100 HydrophobicContact CD1-CG 4.22Å; F96-Q100 HydrophobicContact CE1-CG 3.83Å; F96-Q100 HydrophobicContact CE2-CG 4.29Å; F96-Q100 HydrophobicContact CZ-CG 3.87Å; F96-Q100 VanDerWaalsContact CZ-NE2 3.29Å; F96-Q100 WeakPolarHBondContact O-CG 3.39Å; F96-Q100 PolarHBondContact O-N 3.44Å
97	C	83.6	Confident	80.7	Confident	70 Å²	70	68.2 Å²	68.2	47%	0.473	40%	0.402	S	S	.	.	H	α-helix	trans	-60.3	-37.5	176.3	-70.4	0	0	0	0	112.6	A93 F94 Q100 T101	A93-C97 PolarHBondContact O-N 3.48Å; A93-C97 PolarHBondContact O-SG 2.8Å; A93-C97 VanDerWaalsContact O-SG 3.35Å; F94-C97 PolarHBondContact O-N 2.97Å; C97-Q100 PolarHBondContact O-N 3.2Å; C97-T101 WeakPolarHBondContact O-CB 3.42Å; C97-T101 WeakPolarHBondContact O-CG2 3.3Å; C97-T101 PolarHBondContact O-N 2.88Å; C97-T101 PolarHBondContact O-OG1 3.22Å
98	Q	81	Confident	80	Confident	24 Å²	24	68.2 Å²	68.2	11%	0.112	40%	0.403	C	S	.	.	H	α-helix	trans	-64.5	-40.9	176.8	-167.8	178.7	10.9	0	0	111.9	F94 K95 F96 T101 G102 R103 V104	F94-Q98 PolarHBondContact O-N 2.89Å; K95-Q98 PolarHBondContact O-N 3.39Å; F96-Q98 VanDerWaalsContact C-N 3.29Å; F96-Q98 PolarHBondContact O-N 3.31Å; Q98-T101 PolarHBondContact O-OG1 3.38Å; Q98-G102 PolarHBondContact O-N 3.32Å; Q98-G102 VanDerWaalsContact O-N 3.09Å; Q98-R103 WeakPolarHBondContact CG-O 3.36Å; Q98-R103 PolarHBondContact NE2-O 3.08Å; Q98-R103 VanDerWaalsContact NE2-O 3.09Å; Q98-R103 PolarHBondContact O-N 3.1Å; Q98-V104 PolarHBondContact NE2-O 2.82Å
99	I	78.3	Confident	79.4	Confident	58 Å²	58	69 Å²	69	30%	0.297	41%	0.407	S	S	.	.	H	α-helix	trans	-65	-43.9	175.6	-68.3	165.4	0	0	0	110.7	W41 K95 F96 T101 G102	W41-I99 HydrophobicContact CB-CD1 4.29Å; W41-I99 HydrophobicContact CD2-CD1 4.1Å; W41-I99 HydrophobicContact CG-CD1 3.56Å; W41-I99 VanDerWaalsContact NE1-CD1 3.3Å; K95-I99 HydrophobicContact CG-CD1 4.34Å; K95-I99 WeakPolarHBondContact O-CG1 3.4Å; K95-I99 PolarHBondContact O-N 2.87Å; F96-I99 PolarHBondContact O-N 3.21Å; I99-T101 PolarHBondContact O-N 3.21Å; I99-G102 PolarHBondContact O-N 3.42Å
100	Q	77.5	Confident	78.8	Confident	82 Å²	82	68.8 Å²	68.8	38%	0.383	41%	0.411	S	S	.	.	H	α-helix	trans	-65.5	-37.5	179.3	-68.8	-66.9	-9.5	0	0	112.9	T38 F96 C97	T38-Q100 VanDerWaalsContact CG2-NE2 3.32Å; F96-Q100 HydrophobicContact CD1-CG 4.22Å; F96-Q100 HydrophobicContact CE1-CG 3.83Å; F96-Q100 HydrophobicContact CE2-CG 4.29Å; F96-Q100 HydrophobicContact CZ-CG 3.87Å; F96-Q100 VanDerWaalsContact CZ-NE2 3.29Å; F96-Q100 WeakPolarHBondContact O-CG 3.39Å; F96-Q100 PolarHBondContact O-N 3.44Å; C97-Q100 PolarHBondContact O-N 3.2Å
101	T	79.8	Confident	78.5	Confident	89 Å²	89	73.5 Å²	73.5	55%	0.546	42%	0.421	S	S	.	.	H	α-helix	trans	-84.2	-10.6	-179	55.8	0	0	0	0	113.8	C97 Q98 I99 R103	C97-T101 WeakPolarHBondContact O-CB 3.42Å; C97-T101 WeakPolarHBondContact O-CG2 3.3Å; C97-T101 PolarHBondContact O-N 2.88Å; C97-T101 PolarHBondContact O-OG1 3.22Å; Q98-T101 PolarHBondContact O-OG1 3.38Å; I99-T101 PolarHBondContact O-N 3.21Å; T101-R103 PolarHBondContact O-N 2.86Å
102	G	71	Confident	78.3	Confident	56 Å²	56	76 Å²	76	58%	0.577	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	8.9	-176.7	0	0	0	0	0	114.5	Q98 I99 V104	Q98-G102 PolarHBondContact O-N 3.32Å; Q98-G102 VanDerWaalsContact O-N 3.09Å; I99-G102 PolarHBondContact O-N 3.42Å; G102-V104 PolarHBondContact O-N 2.98Å
103	R	69.4	Low	78.2	Confident	171 Å²	171	76.3 Å²	76.3	65%	0.645	43%	0.434	S	S	*	.			trans	-84.7	50.2	-176.7	-61.3	179.1	89.6	168.2	6.6	111.8	Q98 T101 G105	Q98-R103 WeakPolarHBondContact CG-O 3.36Å; Q98-R103 PolarHBondContact NE2-O 3.08Å; Q98-R103 VanDerWaalsContact NE2-O 3.09Å; Q98-R103 PolarHBondContact O-N 3.1Å; T101-R103 PolarHBondContact O-N 2.86Å; R103-G105 PolarHBondContact O-N 3.37Å
104	V	66.4	Low	78.2	Confident	108 Å²	108	77 Å²	77	66%	0.655	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.7	-174.9	-175.6	0	0	0	0	112	Q98 G102	Q98-V104 PolarHBondContact NE2-O 2.82Å; G102-V104 PolarHBondContact O-N 2.98Å
105	G	62.3	Low	78.3	Confident	83 Å²	83	76.4 Å²	76.4	86%	0.856	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.7	-174.3	0	0	0	0	0	117.8	R103	R103-G105 PolarHBondContact O-N 3.37Å
106	S	65	Low	78.7	Confident	87 Å²	87	76.2 Å²	76.2	61%	0.608	43%	0.434	S	S	*	.	S	Bend	trans	-90.8	-24.2	-167.5	61.1	0	0	0	0	115.4
107	F	67.5	Low	79	Confident	78 Å²	78	72.2 Å²	72.2	34%	0.342	42%	0.416	S	S	.	.	S	Bend	trans	-121.5	125.7	-173.8	-172	-99.4	0	0	0	110.8	F94 F109 V112	F94-F107 HydrophobicContact CD1-CD1 4.22Å; F94-F107 HydrophobicContact CD1-CE1 4.28Å; F94-F107 HydrophobicContact CE1-CB 4.12Å; F94-F107 AromaticContact CE1-CD1 3.24Å; F94-F107 HydrophobicContact CE1-CD1 3.24Å; F94-F107 HydrophobicContact CE1-CD2 4.5Å; F94-F107 AromaticContact CE1-CE1 3.64Å; F94-F107 HydrophobicContact CE1-CE1 3.64Å; F94-F107 AromaticContact CE1-CG 3.72Å; F94-F107 HydrophobicContact CE1-CG 3.72Å; F94-F107 HydrophobicContact CE1-CZ 4.41Å; F94-F107 HydrophobicContact CZ-CB 3.99Å; F94-F107 AromaticContact CZ-CD1 3.58Å; F94-F107 HydrophobicContact CZ-CD1 3.58Å; F94-F107 AromaticContact CZ-CD2 4Å; F94-F107 HydrophobicContact CZ-CD2 4Å; F94-F107 AromaticContact CZ-CE1 3.95Å; F94-F107 HydrophobicContact CZ-CE1 3.95Å; F94-F107 HydrophobicContact CZ-CE2 4.34Å; F94-F107 AromaticContact CZ-CG 3.58Å; F94-F107 HydrophobicContact CZ-CG 3.58Å; F94-F107 HydrophobicContact CZ-CZ 4.3Å; F107-F109 HydrophobicContact CD1-CB 3.95Å; F107-F109 HydrophobicContact CD1-CD2 4.37Å; F107-F109 HydrophobicContact CE1-CB 4.37Å; F107-F109 HydrophobicContact CE1-CD2 4.25Å; F107-F109 PolarHBondContact O-N 3.13Å; F107-V112 HydrophobicContact CE1-CB 4.21Å; F107-V112 HydrophobicContact CE1-CG2 3.91Å; F107-V112 HydrophobicContact CZ-CB 4.31Å; F107-V112 HydrophobicContact CZ-CG1 4.41Å; F107-V112 HydrophobicContact CZ-CG2 3.7Å
108	P	79.2	Confident	79.4	Confident	71 Å²	71	72.7 Å²	72.7	46%	0.461	41%	0.413	S	S	.	.			trans	-77.6	64.8	179.9	34.5	-36.3	0	0	0	110.6	D110 K111 V112	P108-D110 PolarHBondContact O-N 2.99Å; P108-K111 HydrophobicContact CB-CB 4.25Å; P108-K111 HydrophobicContact CB-CD 4.11Å; P108-K111 HydrophobicContact CB-CG 4.23Å; P108-K111 PolarHBondContact O-N 2.98Å; P108-V112 PolarHBondContact O-N 3.46Å
109	F	81.2	Confident	80	Confident	18 Å²	18	77.8 Å²	77.8	8%	0.079	44%	0.435	C	S	.	.	H	α-helix	trans	-52.6	-42.8	-175.1	-176.1	-94.2	0	0	0	111.9	F46 G91 F94 K95 F107 K111 V112 D113	F46-F109 HydrophobicContact CE1-CE1 4.22Å; F46-F109 AromaticContact CZ-CE1 3.76Å; F46-F109 HydrophobicContact CZ-CE1 3.76Å; F46-F109 HydrophobicContact CZ-CZ 4.29Å; G91-F109 WeakPolarHBondContact O-CE2 3.24Å; G91-F109 WeakPolarHBondContact O-CZ 3.27Å; F94-F109 AromaticContact CD1-CD2 3.65Å; F94-F109 HydrophobicContact CD1-CD2 3.65Å; F94-F109 AromaticContact CD1-CE2 3.97Å; F94-F109 HydrophobicContact CD1-CE2 3.97Å; F94-F109 HydrophobicContact CE1-CD2 4.1Å; K95-F109 HydrophobicContact CB-CE1 4.37Å; K95-F109 HydrophobicContact CB-CE2 4Å; K95-F109 HydrophobicContact CB-CZ 3.87Å; K95-F109 HydrophobicContact CD-CD1 4.36Å; K95-F109 HydrophobicContact CD-CE1 3.79Å; K95-F109 HydrophobicContact CD-CZ 4.07Å; K95-F109 HydrophobicContact CG-CE1 4.41Å; K95-F109 HydrophobicContact CG-CZ 4.4Å; F107-F109 HydrophobicContact CD1-CB 3.95Å; F107-F109 HydrophobicContact CD1-CD2 4.37Å; F107-F109 HydrophobicContact CE1-CB 4.37Å; F107-F109 HydrophobicContact CE1-CD2 4.25Å; F107-F109 PolarHBondContact O-N 3.13Å; F109-K111 VanDerWaalsContact C-N 3.31Å; F109-K111 PolarHBondContact O-N 2.88Å; F109-V112 PolarHBondContact O-N 3.12Å; F109-D113 HydrophobicContact CE1-CB 4.25Å; F109-D113 WeakPolarHBondContact O-CB 3.08Å; F109-D113 PolarHBondContact O-N 3.04Å
110	D	80.4	Confident	80.7	Confident	110 Å²	110	75.3 Å²	75.3	59%	0.588	42%	0.423	S	S	*	.	H	α-helix	trans	-64.3	-35.2	-178.1	-55.9	-32.5	0	0	0	112.6	P108 L114	P108-D110 PolarHBondContact O-N 2.99Å; D110-L114 VanDerWaalsContact O-CB 3.27Å; D110-L114 WeakPolarHBondContact O-CB 3.43Å; D110-L114 PolarHBondContact O-N 2.9Å
111	K	84.7	Confident	81.5	Confident	155 Å²	155	73.6 Å²	73.6	67%	0.674	42%	0.416	S	S	*	.	H	α-helix	trans	-69.3	-43	176.2	-64.2	-173.5	-178.7	178.4	0	111	P108 F109 L114 T115	P108-K111 HydrophobicContact CB-CB 4.25Å; P108-K111 HydrophobicContact CB-CD 4.11Å; P108-K111 HydrophobicContact CB-CG 4.23Å; P108-K111 PolarHBondContact O-N 2.98Å; F109-K111 VanDerWaalsContact C-N 3.31Å; F109-K111 PolarHBondContact O-N 2.88Å; K111-L114 PolarHBondContact O-N 3.48Å; K111-T115 PolarHBondContact O-N 3.22Å; K111-T115 PolarHBondContact O-OG1 3.24Å; K111-T115 VanDerWaalsContact O-OG1 3.08Å
112	V	86.1	Confident	82.3	Confident	73 Å²	73	73.7 Å²	73.7	44%	0.442	41%	0.412	S	S	.	.	H	α-helix	trans	-66.1	-42.7	178.4	176.9	0	0	0	0	110.8	F107 P108 F109 T115 F116	F107-V112 HydrophobicContact CE1-CB 4.21Å; F107-V112 HydrophobicContact CE1-CG2 3.91Å; F107-V112 HydrophobicContact CZ-CB 4.31Å; F107-V112 HydrophobicContact CZ-CG1 4.41Å; F107-V112 HydrophobicContact CZ-CG2 3.7Å; P108-V112 PolarHBondContact O-N 3.46Å; F109-V112 PolarHBondContact O-N 3.12Å; V112-T115 PolarHBondContact O-N 3Å; V112-F116 PolarHBondContact O-N 3.46Å
113	D	87	Confident	83.5	Confident	13 Å²	13	73.1 Å²	73.1	7%	0.07	40%	0.399	C	S	.	.	H	α-helix	trans	-62.5	-43.6	175.7	-171.5	69.8	0	0	0	111.7	K50 F109 F116 N117	K50-D113 WeakPolarHBondContact CE-OD1 3.41Å; K50-D113 IonicContact NZ-OD1 3.83Å; K50-D113 PolarHBondContact NZ-OD1 3.43Å; K50-D113 IonicContact NZ-OD2 3.06Å; F109-D113 HydrophobicContact CE1-CB 4.25Å; F109-D113 WeakPolarHBondContact O-CB 3.08Å; F109-D113 PolarHBondContact O-N 3.04Å; D113-F116 PolarHBondContact O-N 3.39Å; D113-N117 VanDerWaalsContact O-CG 3.26Å; D113-N117 PolarHBondContact O-N 3.1Å; D113-N117 PolarHBondContact O-ND2 2.87Å; D113-N117 PolarHBondContact OD2-ND2 3.39Å
114	L	87	Confident	84.8	Confident	59 Å²	59	65 Å²	65	31%	0.309	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-47.9	175.4	179.5	63.5	0	0	0	111.7	D110 K111 F116 N117 I118 C181 N184	D110-L114 VanDerWaalsContact O-CB 3.27Å; D110-L114 WeakPolarHBondContact O-CB 3.43Å; D110-L114 PolarHBondContact O-N 2.9Å; K111-L114 PolarHBondContact O-N 3.48Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 3.47Å; L114-N117 PolarHBondContact O-N 2.72Å; L114-I118 HydrophobicContact CD1-CD1 4.3Å; L114-I118 HydrophobicContact CD1-CG1 4.5Å; L114-I118 HydrophobicContact CG-CD1 4.1Å; L114-I118 WeakPolarHBondContact O-CG1 3.43Å; L114-I118 PolarHBondContact O-N 3.37Å; L114-C181 HydrophobicContact CD1-CB 4.47Å; L114-N184 HydrophobicContact CD1-CB 4.2Å
115	T	89.6	Confident	86.3	Confident	72 Å²	72	62.5 Å²	62.5	44%	0.442	36%	0.356	S	S	.	.	H	α-helix	trans	-58.1	-45.2	177	-63.2	0	0	0	0	111.3	K111 V112 I118 F119	K111-T115 PolarHBondContact O-N 3.22Å; K111-T115 PolarHBondContact O-OG1 3.24Å; K111-T115 VanDerWaalsContact O-OG1 3.08Å; V112-T115 PolarHBondContact O-N 3Å; T115-I118 PolarHBondContact O-N 3.24Å; T115-F119 HydrophobicContact CG2-CD2 3.73Å; T115-F119 HydrophobicContact CG2-CE2 3.42Å; T115-F119 VanDerWaalsContact CG2-CE2 3.42Å; T115-F119 WeakPolarHBondContact O-CD2 3.35Å; T115-F119 PolarHBondContact O-N 3.3Å; T115-F119 VanDerWaalsContact O-N 3.08Å
116	F	90.8	Very high	87.9	Confident	39 Å²	39	62.9 Å²	62.9	17%	0.171	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-44.6	175.9	174.2	-103.6	0	0	0	112.4	V87 T88 V112 D113 L114 I118 F119 A120	V87-F116 HydrophobicContact CB-CD2 4.1Å; V87-F116 HydrophobicContact CB-CE2 3.42Å; V87-F116 VanDerWaalsContact CB-CE2 3.42Å; V87-F116 HydrophobicContact CB-CZ 3.72Å; V87-F116 HydrophobicContact CG1-CD1 4.41Å; V87-F116 HydrophobicContact CG1-CD2 3.36Å; V87-F116 HydrophobicContact CG1-CE1 4.31Å; V87-F116 HydrophobicContact CG1-CE2 3.24Å; V87-F116 HydrophobicContact CG1-CG 3.96Å; V87-F116 HydrophobicContact CG1-CZ 3.73Å; V87-F116 HydrophobicContact CG2-CE2 4.08Å; T88-F116 WeakPolarHBondContact OG1-CE1 3.33Å; V112-F116 PolarHBondContact O-N 3.46Å; D113-F116 PolarHBondContact O-N 3.39Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 3.47Å; F116-I118 VanDerWaalsContact C-N 3.3Å; F116-I118 PolarHBondContact O-N 3.2Å; F116-F119 PolarHBondContact O-N 2.96Å; F116-A120 WeakPolarHBondContact O-CB 3.37Å; F116-A120 PolarHBondContact O-N 2.75Å
117	N	90.5	Very high	89.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-38.9	178.1	-70.6	-43	0	0	0	111.9	D113 L114 A120 I121 H177 C181	D113-N117 VanDerWaalsContact O-CG 3.26Å; D113-N117 PolarHBondContact O-N 3.1Å; D113-N117 PolarHBondContact O-ND2 2.87Å; D113-N117 PolarHBondContact OD2-ND2 3.39Å; L114-N117 PolarHBondContact O-N 2.72Å; N117-A120 PolarHBondContact O-N 2.96Å; N117-I121 VanDerWaalsContact O-CG1 3.3Å; N117-I121 WeakPolarHBondContact O-CG1 3.41Å; N117-I121 PolarHBondContact O-N 2.93Å; N117-H177 PolarHBondContact OD1-ND1 2.97Å; N117-C181 VanDerWaalsContact CB-SG 3.57Å
118	I	92	Very high	90.8	Very high	81 Å²	81	58 Å²	58	42%	0.415	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-47.5	175.2	-67.5	166.3	0	0	0	110.7	L114 T115 F116 A120 I121 I122	L114-I118 HydrophobicContact CD1-CD1 4.3Å; L114-I118 HydrophobicContact CD1-CG1 4.5Å; L114-I118 HydrophobicContact CG-CD1 4.1Å; L114-I118 WeakPolarHBondContact O-CG1 3.43Å; L114-I118 PolarHBondContact O-N 3.37Å; T115-I118 PolarHBondContact O-N 3.24Å; F116-I118 VanDerWaalsContact C-N 3.3Å; F116-I118 PolarHBondContact O-N 3.2Å; I118-A120 VanDerWaalsContact C-N 3.32Å; I118-A120 PolarHBondContact O-N 3.42Å; I118-I121 PolarHBondContact O-N 3.39Å; I118-I122 HydrophobicContact CG2-CD1 4.22Å; I118-I122 WeakPolarHBondContact O-CG1 3.39Å; I118-I122 PolarHBondContact O-N 2.86Å; I118-I122 VanDerWaalsContact O-N 3.14Å
119	F	94.3	Very high	91.6	Very high	130 Å²	130	56.5 Å²	56.5	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-61.1	-42.4	176.8	-78.3	-60.8	0	0	0	112.1	T115 F116 I121 I122 C123	T115-F119 HydrophobicContact CG2-CD2 3.73Å; T115-F119 HydrophobicContact CG2-CE2 3.42Å; T115-F119 VanDerWaalsContact CG2-CE2 3.42Å; T115-F119 WeakPolarHBondContact O-CD2 3.35Å; T115-F119 PolarHBondContact O-N 3.3Å; T115-F119 VanDerWaalsContact O-N 3.08Å; F116-F119 PolarHBondContact O-N 2.96Å; F119-I121 PolarHBondContact O-N 3.46Å; F119-I122 PolarHBondContact O-N 2.73Å; F119-C123 PolarHBondContact O-N 3.45Å; F119-C123 PolarHBondContact O-SG 3.19Å; F119-C123 VanDerWaalsContact O-SG 3.38Å
120	A	93.8	Very high	92.2	Very high	7 Å²	7	57.8 Å²	57.8	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-42.7	176.7	0	0	0	0	0	111.8	F116 N117 I118 I122 C123 F124 H177	F116-A120 WeakPolarHBondContact O-CB 3.37Å; F116-A120 PolarHBondContact O-N 2.75Å; N117-A120 PolarHBondContact O-N 2.96Å; I118-A120 VanDerWaalsContact C-N 3.32Å; I118-A120 PolarHBondContact O-N 3.42Å; A120-I122 VanDerWaalsContact C-N 3.31Å; A120-I122 PolarHBondContact O-N 3.36Å; A120-C123 PolarHBondContact O-N 3.19Å; A120-F124 HydrophobicContact CB-CD2 4.34Å; A120-F124 WeakPolarHBondContact O-CB 3.2Å; A120-F124 VanDerWaalsContact O-CD2 3.25Å; A120-F124 WeakPolarHBondContact O-CD2 3.37Å; A120-F124 PolarHBondContact O-N 2.98Å; A120-H177 WeakPolarHBondContact CB-CE1 3.45Å; A120-H177 WeakPolarHBondContact CB-NE2 3.44Å
121	I	94.5	Very high	92.9	Very high	46 Å²	46	52.6 Å²	52.6	24%	0.236	28%	0.282	C	S	.	.	H	α-helix	trans	-56.2	-46.3	173.9	-70.9	166.6	0	0	0	111	N117 I118 F119 S125 L174 H177 C181	N117-I121 VanDerWaalsContact O-CG1 3.3Å; N117-I121 WeakPolarHBondContact O-CG1 3.41Å; N117-I121 PolarHBondContact O-N 2.93Å; I118-I121 PolarHBondContact O-N 3.39Å; F119-I121 PolarHBondContact O-N 3.46Å; I121-S125 VanDerWaalsContact O-CB 3.25Å; I121-S125 WeakPolarHBondContact O-CB 3.48Å; I121-S125 PolarHBondContact O-N 2.89Å; I121-S125 PolarHBondContact O-OG 3.42Å; I121-L174 HydrophobicContact CG2-CD2 4.4Å; I121-L174 WeakPolarHBondContact O-CD2 3.4Å; I121-H177 HydrophobicContact CD1-CB 3.97Å; I121-H177 HydrophobicContact CG1-CB 3.45Å; I121-H177 VanDerWaalsContact CG1-CB 3.45Å; I121-C181 HydrophobicContact CD1-CB 4.4Å; I121-C181 VanDerWaalsContact CD1-SG 3.6Å
122	I	95.8	Very high	93.4	Very high	90 Å²	90	47.2 Å²	47.2	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-51.2	-179.3	-65	166.2	0	0	0	110.2	I118 F119 A120 F124 S125 I126	I118-I122 HydrophobicContact CG2-CD1 4.22Å; I118-I122 WeakPolarHBondContact O-CG1 3.39Å; I118-I122 PolarHBondContact O-N 2.86Å; I118-I122 VanDerWaalsContact O-N 3.14Å; F119-I122 PolarHBondContact O-N 2.73Å; A120-I122 VanDerWaalsContact C-N 3.31Å; A120-I122 PolarHBondContact O-N 3.36Å; I122-F124 PolarHBondContact O-N 3.4Å; I122-S125 PolarHBondContact O-N 3.4Å; I122-I126 HydrophobicContact CG2-CD1 4.41Å; I122-I126 WeakPolarHBondContact O-CG1 3.34Å; I122-I126 PolarHBondContact O-N 2.98Å; I122-I126 VanDerWaalsContact O-N 3.16Å
123	C	96.6	Very high	93.8	Very high	44 Å²	44	49.1 Å²	49.1	30%	0.297	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-44.8	-178.6	-65.9	0	0	0	0	112.3	V80 F119 A120 S125 I126 A127	V80-C123 HydrophobicContact CG1-CB 3.67Å; V80-C123 HydrophobicContact CG2-CB 4.17Å; F119-C123 PolarHBondContact O-N 3.45Å; F119-C123 PolarHBondContact O-SG 3.19Å; F119-C123 VanDerWaalsContact O-SG 3.38Å; A120-C123 PolarHBondContact O-N 3.19Å; C123-S125 VanDerWaalsContact C-N 3.32Å; C123-S125 PolarHBondContact O-N 3.25Å; C123-I126 PolarHBondContact O-N 2.87Å; C123-A127 PolarHBondContact O-N 3.41Å
124	F	96.2	Very high	94	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-71.6	-25	177.7	-79.2	-70.1	0	0	0	113.1	L60 V80 C84 A120 I122 A127 F128 I170 I173 L174	L60-F124 HydrophobicContact CD2-CE1 4.03Å; V80-F124 HydrophobicContact CG1-CD1 4.32Å; V80-F124 HydrophobicContact CG1-CD2 4.38Å; V80-F124 HydrophobicContact CG1-CE1 4.15Å; V80-F124 HydrophobicContact CG1-CE2 4.2Å; V80-F124 HydrophobicContact CG1-CG 4.44Å; V80-F124 HydrophobicContact CG1-CZ 4.08Å; C84-F124 HydrophobicContact CB-CE2 3.84Å; C84-F124 HydrophobicContact CB-CZ 3.99Å; A120-F124 HydrophobicContact CB-CD2 4.34Å; A120-F124 WeakPolarHBondContact O-CB 3.2Å; A120-F124 VanDerWaalsContact O-CD2 3.25Å; A120-F124 WeakPolarHBondContact O-CD2 3.37Å; A120-F124 PolarHBondContact O-N 2.98Å; I122-F124 PolarHBondContact O-N 3.4Å; F124-A127 PolarHBondContact O-N 3.2Å; F124-F128 VanDerWaalsContact O-CB 3.27Å; F124-F128 WeakPolarHBondContact O-CB 3.23Å; F124-F128 PolarHBondContact O-N 3.47Å; F124-I170 HydrophobicContact CB-CG2 4.45Å; F124-I170 HydrophobicContact CD1-CG2 4.28Å; F124-I170 WeakPolarHBondContact O-CG2 3.46Å; F124-I173 HydrophobicContact CD1-CG2 4.19Å; F124-I173 HydrophobicContact CD2-CG2 3.75Å; F124-I173 HydrophobicContact CE1-CD1 4.03Å; F124-I173 HydrophobicContact CE1-CG2 4.11Å; F124-I173 HydrophobicContact CE2-CG2 3.66Å; F124-I173 HydrophobicContact CG-CG2 4.03Å; F124-I173 HydrophobicContact CZ-CD1 4.25Å; F124-I173 HydrophobicContact CZ-CG2 3.85Å; F124-L174 HydrophobicContact CB-CD2 3.57Å; F124-L174 HydrophobicContact CB-CG 3.85Å
125	S	97.1	Very high	94.2	Very high	55 Å²	55	46.7 Å²	46.7	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-67.9	-39.6	172.2	-61.8	0	0	0	0	111.1	I121 I122 C123 F128 G129	I121-S125 VanDerWaalsContact O-CB 3.25Å; I121-S125 WeakPolarHBondContact O-CB 3.48Å; I121-S125 PolarHBondContact O-N 2.89Å; I121-S125 PolarHBondContact O-OG 3.42Å; I122-S125 PolarHBondContact O-N 3.4Å; C123-S125 VanDerWaalsContact C-N 3.32Å; C123-S125 PolarHBondContact O-N 3.25Å; S125-F128 PolarHBondContact O-N 3.08Å; S125-G129 PolarHBondContact O-N 2.79Å
126	I	96.9	Very high	94.4	Very high	92 Å²	92	47.9 Å²	47.9	47%	0.472	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-47.1	172.8	-62.9	167.1	0	0	0	109.9	F76 I122 C123 F128 G129 L130	F76-I126 HydrophobicContact CE1-CB 4.31Å; F76-I126 HydrophobicContact CE1-CG2 3.84Å; F76-I126 HydrophobicContact CZ-CG2 4.16Å; I122-I126 HydrophobicContact CG2-CD1 4.41Å; I122-I126 WeakPolarHBondContact O-CG1 3.34Å; I122-I126 PolarHBondContact O-N 2.98Å; I122-I126 VanDerWaalsContact O-N 3.16Å; C123-I126 PolarHBondContact O-N 2.87Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 3.33Å; I126-G129 PolarHBondContact O-N 3.44Å; I126-L130 HydrophobicContact CG2-CD1 4.21Å; I126-L130 WeakPolarHBondContact O-CG 3.16Å; I126-L130 PolarHBondContact O-N 3.44Å
127	A	95.7	Very high	94.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.1	-39.8	175.9	0	0	0	0	0	112.4	I77 C123 F124 L130 A131 I170	I77-A127 HydrophobicContact CG1-CB 3.99Å; I77-A127 HydrophobicContact CG2-CB 4.49Å; C123-A127 PolarHBondContact O-N 3.41Å; F124-A127 PolarHBondContact O-N 3.2Å; A127-L130 PolarHBondContact O-N 3.38Å; A127-A131 WeakPolarHBondContact O-CB 3.42Å; A127-A131 PolarHBondContact O-N 2.97Å; A127-I170 HydrophobicContact CB-CD1 4.2Å
128	F	96.6	Very high	94.3	Very high	62 Å²	62	48.6 Å²	48.6	27%	0.272	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-46	175.8	-177.2	-110.1	0	0	0	111.6	F124 S125 I126 L130 A131 C132 T167 I170 I171 L174	F124-F128 VanDerWaalsContact O-CB 3.27Å; F124-F128 WeakPolarHBondContact O-CB 3.23Å; F124-F128 PolarHBondContact O-N 3.47Å; S125-F128 PolarHBondContact O-N 3.08Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 3.33Å; F128-L130 VanDerWaalsContact C-N 3.28Å; F128-L130 PolarHBondContact O-N 3.47Å; F128-A131 PolarHBondContact O-N 3.07Å; F128-C132 WeakPolarHBondContact CZ-SG 3.47Å; F128-C132 WeakPolarHBondContact O-CB 3.12Å; F128-C132 PolarHBondContact O-N 3.41Å; F128-C132 PolarHBondContact O-SG 3.04Å; F128-C132 VanDerWaalsContact O-SG 3.41Å; F128-T167 HydrophobicContact CD2-CG2 4.27Å; F128-T167 HydrophobicContact CE2-CG2 3.76Å; F128-I170 HydrophobicContact CB-CG2 3.65Å; F128-I170 HydrophobicContact CD2-CB 4.5Å; F128-I170 HydrophobicContact CD2-CG2 4.1Å; F128-I170 HydrophobicContact CG-CG2 4.36Å; F128-I171 HydrophobicContact CD2-CB 4.33Å; F128-I171 HydrophobicContact CE2-CB 3.95Å; F128-I171 HydrophobicContact CE2-CD1 4.33Å; F128-I171 HydrophobicContact CZ-CD1 4.27Å; F128-L174 HydrophobicContact CB-CD1 3.93Å; F128-L174 HydrophobicContact CG-CD1 4.22Å
129	G	96.6	Very high	94.1	Very high	39 Å²	39	50.4 Å²	50.4	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-57.1	-42.6	174.8	0	0	0	0	0	112.2	S125 I126 Y133	S125-G129 PolarHBondContact O-N 2.79Å; I126-G129 PolarHBondContact O-N 3.44Å; G129-Y133 WeakPolarHBondContact O-CB 3.25Å; G129-Y133 PolarHBondContact O-N 2.93Å
130	L	94.9	Very high	93.8	Very high	45 Å²	45	47 Å²	47	24%	0.236	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-45.4	176	-68	168.2	0	0	0	112.3	W71 A73 F76 I126 A127 F128 Y133 D134	W71-L130 HydrophobicContact CH2-CB 4.08Å; W71-L130 HydrophobicContact CH2-CD2 4.01Å; W71-L130 HydrophobicContact CZ2-CD2 4.4Å; W71-L130 HydrophobicContact CZ3-CB 4.38Å; A73-L130 HydrophobicContact CB-CD1 4.09Å; A73-L130 HydrophobicContact CB-CD2 4.13Å; F76-L130 HydrophobicContact CD1-CD1 3.78Å; F76-L130 HydrophobicContact CE1-CD1 4.22Å; I126-L130 HydrophobicContact CG2-CD1 4.21Å; I126-L130 WeakPolarHBondContact O-CG 3.16Å; I126-L130 PolarHBondContact O-N 3.44Å; A127-L130 PolarHBondContact O-N 3.38Å; F128-L130 VanDerWaalsContact C-N 3.28Å; F128-L130 PolarHBondContact O-N 3.47Å; L130-Y133 PolarHBondContact O-N 3.29Å; L130-D134 WeakPolarHBondContact O-CB 3.45Å; L130-D134 PolarHBondContact O-N 2.9Å
131	A	94.2	Very high	93.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-40	178.4	0	0	0	0	0	112.2	A127 F128 D134 C135 V166 I170	A127-A131 WeakPolarHBondContact O-CB 3.42Å; A127-A131 PolarHBondContact O-N 2.97Å; F128-A131 PolarHBondContact O-N 3.07Å; A131-D134 PolarHBondContact O-N 3.41Å; A131-C135 WeakPolarHBondContact O-CB 3.38Å; A131-C135 PolarHBondContact O-N 2.87Å; A131-V166 HydrophobicContact CB-CG1 4.26Å; A131-I170 HydrophobicContact CB-CD1 3.94Å
132	C	95.2	Very high	92.3	Very high	42 Å²	42	54.9 Å²	54.9	28%	0.284	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-43	174	-76	0	0	0	0	112.1	F128 D134 C135 V136	F128-C132 WeakPolarHBondContact CZ-SG 3.47Å; F128-C132 WeakPolarHBondContact O-CB 3.12Å; F128-C132 PolarHBondContact O-N 3.41Å; F128-C132 PolarHBondContact O-SG 3.04Å; F128-C132 VanDerWaalsContact O-SG 3.41Å; C132-D134 VanDerWaalsContact C-N 3.31Å; C132-D134 PolarHBondContact O-N 3.23Å; C132-C135 WeakPolarHBondContact O-CB 3.49Å; C132-C135 PolarHBondContact O-N 2.65Å; C132-V136 WeakPolarHBondContact O-CG2 3.3Å; C132-V136 PolarHBondContact O-N 3.37Å
133	Y	94.1	Very high	91.1	Very high	114 Å²	114	57 Å²	57	45%	0.447	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-44	176	175.4	-111.7	0	0	0	111.6	W71 G129 L130 V136 M137 H145	W71-Y133 HydrophobicContact CH2-CD1 4.15Å; W71-Y133 HydrophobicContact CZ2-CD1 4.12Å; W71-Y133 HydrophobicContact CZ2-CE1 4.37Å; G129-Y133 WeakPolarHBondContact O-CB 3.25Å; G129-Y133 PolarHBondContact O-N 2.93Å; L130-Y133 PolarHBondContact O-N 3.29Å; Y133-V136 PolarHBondContact O-N 3.14Å; Y133-M137 HydrophobicContact CD2-CE 4.3Å; Y133-M137 HydrophobicContact CE1-CG 4.34Å; Y133-M137 HydrophobicContact CE2-CE 3.35Å; Y133-M137 HydrophobicContact CE2-CG 4.16Å; Y133-M137 WeakPolarHBondContact O-CG 3.44Å; Y133-M137 PolarHBondContact O-N 3.12Å; Y133-M137 WeakPolarHBondContact OH-CE 3.37Å; Y133-H145 AromaticContact CE1-CE1 3.49Å; Y133-H145 VanDerWaalsContact CE1-CE1 3.49Å; Y133-H145 WeakPolarHBondContact CE1-CE1 3.41Å
134	D	91.6	Very high	90.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-43.8	177	-174.7	38	0	0	0	112.2	W71 Y74 L130 A131 C132 V136 M137 I138 H145 H146 I163	W71-D134 HydrophobicContact CE3-CB 4.43Å; W71-D134 HydrophobicContact CH2-CB 4.2Å; W71-D134 HydrophobicContact CZ3-CB 3.76Å; Y74-D134 WeakPolarHBondContact CE1-OD2 3.47Å; Y74-D134 VanDerWaalsContact CZ-OD2 3.25Å; Y74-D134 PolarHBondContact OH-OD1 3.02Å; Y74-D134 PolarHBondContact OH-OD2 3.25Å; L130-D134 WeakPolarHBondContact O-CB 3.45Å; L130-D134 PolarHBondContact O-N 2.9Å; A131-D134 PolarHBondContact O-N 3.41Å; C132-D134 VanDerWaalsContact C-N 3.31Å; C132-D134 PolarHBondContact O-N 3.23Å; D134-V136 VanDerWaalsContact C-N 3.35Å; D134-V136 PolarHBondContact O-N 3Å; D134-M137 PolarHBondContact O-N 3.42Å; D134-I138 WeakPolarHBondContact O-CB 3.49Å; D134-I138 VanDerWaalsContact O-CG1 3.29Å; D134-I138 WeakPolarHBondContact O-CG1 3.49Å; D134-I138 PolarHBondContact O-N 3.36Å; D134-I138 WeakPolarHBondContact OD1-CD1 3.38Å; D134-H145 IonicContact OD1-CD2 3.81Å; D134-H145 PolarHBondContact OD1-CD2 2.94Å; D134-H145 IonicContact OD1-NE2 2.8Å; D134-H145 PolarHBondContact OD1-NE2 3.21Å; D134-H146 IonicContact OD1-CD2 3.2Å; D134-H146 IonicContact OD1-CE1 2.82Å; D134-H146 PolarHBondContact OD1-CE1 3.01Å; D134-H146 IonicContact OD1-NE2 3.82Å; D134-H146 PolarHBondContact OD1-NE2 2.68Å; D134-I163 HydrophobicContact CB-CG2 4.37Å; D134-I163 WeakPolarHBondContact OD2-CD1 3.14Å; D134-I163 WeakPolarHBondContact OD2-CG1 3.28Å; D134-I163 VanDerWaalsContact OD2-CG2 3.29Å; D134-I163 WeakPolarHBondContact OD2-CG2 3.44Å
135	C	92.1	Very high	89.4	Confident	20 Å²	20	63.2 Å²	63.2	14%	0.135	34%	0.342	C	S	.	.	H	α-helix	trans	-51.1	-53.4	168.7	-85.5	0	0	0	0	111.1	A131 C132 M137 I138 F139 T167	A131-C135 WeakPolarHBondContact O-CB 3.38Å; A131-C135 PolarHBondContact O-N 2.87Å; C132-C135 WeakPolarHBondContact O-CB 3.49Å; C132-C135 PolarHBondContact O-N 2.65Å; C135-M137 VanDerWaalsContact C-N 3.29Å; C135-M137 PolarHBondContact O-N 3.26Å; C135-I138 PolarHBondContact O-N 2.85Å; C135-F139 HydrophobicContact CB-CD2 4.34Å; C135-F139 WeakPolarHBondContact O-CB 3.25Å; C135-F139 WeakPolarHBondContact O-CD2 3.43Å; C135-F139 PolarHBondContact O-N 3.34Å; C135-T167 PolarHBondContact SG-OG1 3.5Å; C135-T167 VanDerWaalsContact SG-OG1 3.41Å
136	V	93.3	Very high	88.6	Confident	98 Å²	98	61.2 Å²	61.2	59%	0.594	33%	0.327	S	S	*	.	H	α-helix	trans	-58.6	-41.3	-179.2	171.2	0	0	0	0	111.6	C132 Y133 D134 G140	C132-V136 WeakPolarHBondContact O-CG2 3.3Å; C132-V136 PolarHBondContact O-N 3.37Å; Y133-V136 PolarHBondContact O-N 3.14Å; D134-V136 VanDerWaalsContact C-N 3.35Å; D134-V136 PolarHBondContact O-N 3Å; V136-G140 PolarHBondContact O-N 2.85Å
137	M	90.4	Very high	87.6	Confident	45 Å²	45	62.4 Å²	62.4	22%	0.222	33%	0.334	C	S	.	.	H	α-helix	trans	-70.2	-39.2	179.8	-72.4	-64	169.6	0	0	113.2	Y133 D134 C135 E141 N142 H145	Y133-M137 HydrophobicContact CD2-CE 4.3Å; Y133-M137 HydrophobicContact CE1-CG 4.34Å; Y133-M137 HydrophobicContact CE2-CE 3.35Å; Y133-M137 HydrophobicContact CE2-CG 4.16Å; Y133-M137 WeakPolarHBondContact O-CG 3.44Å; Y133-M137 PolarHBondContact O-N 3.12Å; Y133-M137 WeakPolarHBondContact OH-CE 3.37Å; D134-M137 PolarHBondContact O-N 3.42Å; C135-M137 VanDerWaalsContact C-N 3.29Å; C135-M137 PolarHBondContact O-N 3.26Å; M137-E141 PolarHBondContact O-N 3.31Å; M137-N142 PolarHBondContact O-N 2.82Å; M137-N142 VanDerWaalsContact O-N 3.09Å; M137-N142 HydrophobicContact SD-CB 4.29Å; M137-H145 HydrophobicContact CB-CB 4.04Å; M137-H145 WeakPolarHBondContact CB-CD2 3.4Å; M137-H145 VanDerWaalsContact CB-CG 3.48Å
138	I	88.3	Confident	86.4	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-68	-47.7	176.4	-68	171.4	0	0	0	110.4	D134 C135 G140 E141 Y156 R160 I163	D134-I138 WeakPolarHBondContact O-CB 3.49Å; D134-I138 VanDerWaalsContact O-CG1 3.29Å; D134-I138 WeakPolarHBondContact O-CG1 3.49Å; D134-I138 PolarHBondContact O-N 3.36Å; D134-I138 WeakPolarHBondContact OD1-CD1 3.38Å; C135-I138 PolarHBondContact O-N 2.85Å; I138-G140 VanDerWaalsContact C-N 3.31Å; I138-G140 PolarHBondContact O-N 3.14Å; I138-E141 PolarHBondContact O-N 2.79Å; I138-E141 VanDerWaalsContact O-N 3.07Å; I138-Y156 HydrophobicContact CG2-CE1 4.5Å; I138-Y156 PolarHBondContact O-OH 3.21Å; I138-R160 HydrophobicContact CG2-CB 3.86Å; I138-R160 HydrophobicContact CG2-CG 3.68Å; I138-I163 HydrophobicContact CD1-CB 4.2Å; I138-I163 HydrophobicContact CD1-CG1 3.92Å; I138-I163 HydrophobicContact CD1-CG2 4.23Å
139	F	88.8	Confident	85.2	Confident	120 Å²	120	67.8 Å²	67.8	53%	0.526	36%	0.363	S	S	.	.	H	α-helix	trans	-72.4	-23.9	179.2	-75.3	-73.6	0	0	0	113.2	C135 E141 R160 V164	C135-F139 HydrophobicContact CB-CD2 4.34Å; C135-F139 WeakPolarHBondContact O-CB 3.25Å; C135-F139 WeakPolarHBondContact O-CD2 3.43Å; C135-F139 PolarHBondContact O-N 3.34Å; F139-E141 PolarHBondContact O-N 3.15Å; F139-R160 HydrophobicContact CE1-CG 4.08Å; F139-R160 HydrophobicContact CE2-CG 4.31Å; F139-R160 HydrophobicContact CZ-CG 3.81Å; F139-V164 HydrophobicContact CE2-CG2 3.81Å; F139-V164 HydrophobicContact CZ-CG2 3.81Å
140	G	87.2	Confident	83.9	Confident	57 Å²	57	67.3 Å²	67.3	59%	0.588	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	5.3	168.3	0	0	0	0	0	114.2	V136 I138 N142	V136-G140 PolarHBondContact O-N 2.85Å; I138-G140 VanDerWaalsContact C-N 3.31Å; I138-G140 PolarHBondContact O-N 3.14Å; G140-N142 PolarHBondContact O-N 3.31Å; G140-N142 VanDerWaalsContact O-N 3.14Å
141	E	78.1	Confident	83	Confident	151 Å²	151	72.3 Å²	72.3	71%	0.706	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	27.9	-179.1	-57.4	-169.4	164.3	0	0	114.2	M137 I138 F139 K143	M137-E141 PolarHBondContact O-N 3.31Å; I138-E141 PolarHBondContact O-N 2.79Å; I138-E141 VanDerWaalsContact O-N 3.07Å; F139-E141 PolarHBondContact O-N 3.15Å; E141-K143 PolarHBondContact O-N 2.89Å
142	N	78.6	Confident	82.5	Confident	68 Å²	68	75 Å²	75	36%	0.364	40%	0.404	S	S	.	.			trans	-74.8	93.9	176.3	-175.5	0.9	0	0	0	110.6	M137 G140 N144 H145	M137-N142 PolarHBondContact O-N 2.82Å; M137-N142 VanDerWaalsContact O-N 3.09Å; M137-N142 HydrophobicContact SD-CB 4.29Å; G140-N142 PolarHBondContact O-N 3.31Å; G140-N142 VanDerWaalsContact O-N 3.14Å; N142-N144 PolarHBondContact O-N 3.42Å; N142-N144 PolarHBondContact OD1-N 3.49Å; N142-N144 VanDerWaalsContact OD1-N 3.11Å; N142-H145 HydrophobicContact CB-CB 4.45Å; N142-H145 WeakPolarHBondContact O-CB 3.24Å; N142-H145 PolarHBondContact O-N 3.48Å
143	K	70	Confident	81.9	Confident	134 Å²	134	79 Å²	79	58%	0.583	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.8	-178.5	-60.1	-175.8	-176.1	178	0	114.3	E141 Q149	E141-K143 PolarHBondContact O-N 2.89Å; K143-Q149 WeakPolarHBondContact O-CG 3.36Å; K143-Q149 PolarHBondContact O-NE2 3.38Å; K143-Q149 PolarHBondContact O-OE1 3.45Å
144	N	76.3	Confident	81.5	Confident	148 Å²	148	77 Å²	77	79%	0.791	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	11.5	179.3	-62.3	-31.4	0	0	0	112.8	N142	N142-N144 PolarHBondContact O-N 3.42Å; N142-N144 PolarHBondContact OD1-N 3.49Å; N142-N144 VanDerWaalsContact OD1-N 3.11Å
145	H	80.7	Confident	81.2	Confident	28 Å²	28	78.8 Å²	78.8	13%	0.13	44%	0.444	C	S	.	.	S	Bend	trans	-71.9	-36.4	-175.7	178.5	45.5	0	0	0	113.8	Y133 D134 M137 N142	Y133-H145 AromaticContact CE1-CE1 3.49Å; Y133-H145 VanDerWaalsContact CE1-CE1 3.49Å; Y133-H145 WeakPolarHBondContact CE1-CE1 3.41Å; D134-H145 IonicContact OD1-CD2 3.81Å; D134-H145 PolarHBondContact OD1-CD2 2.94Å; D134-H145 IonicContact OD1-NE2 2.8Å; D134-H145 PolarHBondContact OD1-NE2 3.21Å; M137-H145 HydrophobicContact CB-CB 4.04Å; M137-H145 WeakPolarHBondContact CB-CD2 3.4Å; M137-H145 VanDerWaalsContact CB-CG 3.48Å; N142-H145 HydrophobicContact CB-CB 4.45Å; N142-H145 WeakPolarHBondContact O-CB 3.24Å; N142-H145 PolarHBondContact O-N 3.48Å
146	H	81.8	Confident	80.8	Confident	14 Å²	14	79.7 Å²	79.7	7%	0.065	44%	0.444	C	S	.	.	S	Bend	trans	-98.9	148.9	-179.2	-63.8	157.2	0	0	0	111.5	L70 Y74 D134 N148 W159	L70-H146 HydrophobicContact CB-CB 4.46Å; Y74-H146 PolarHBondContact OH-CE1 3.46Å; Y74-H146 PolarHBondContact OH-NE2 3.44Å; D134-H146 IonicContact OD1-CD2 3.2Å; D134-H146 IonicContact OD1-CE1 2.82Å; D134-H146 PolarHBondContact OD1-CE1 3.01Å; D134-H146 IonicContact OD1-NE2 3.82Å; D134-H146 PolarHBondContact OD1-NE2 2.68Å; H146-N148 WeakPolarHBondContact CB-O 3.46Å; H146-N148 PolarHBondContact O-N 2.8Å; H146-W159 AromaticContact CE1-CD1 3.92Å; H146-W159 AromaticContact CE1-NE1 3.57Å
147	D	75.1	Confident	80.5	Confident	116 Å²	116	78.9 Å²	78.9	62%	0.62	43%	0.434	S	S	*	.	S	Bend	trans	-65	-33	-179.7	-69.7	-27.7	0	0	0	111.2	L70	L70-D147 PolarHBondContact O-N 3.27Å
148	N	71.1	Confident	80.4	Confident	95 Å²	95	80.3 Å²	80.3	51%	0.508	44%	0.443	S	S	.	.	S	Bend	trans	-129.4	139.2	173.6	-65.7	-57.6	0	0	0	108.5	H69 L70 H146	H69-N148 PolarHBondContact O-ND2 2.91Å; L70-N148 HydrophobicContact CD2-CB 4.28Å; L70-N148 WeakPolarHBondContact CD2-O 3.4Å; H146-N148 WeakPolarHBondContact CB-O 3.46Å; H146-N148 PolarHBondContact O-N 2.8Å
149	Q	70.1	Confident	80.4	Confident	81 Å²	81	80.4 Å²	80.4	38%	0.379	44%	0.443	S	S	.	.			trans	-104.3	149	177	-71.1	-135.7	-58.8	0	0	112	K143 T151	K143-Q149 WeakPolarHBondContact O-CG 3.36Å; K143-Q149 PolarHBondContact O-NE2 3.38Å; K143-Q149 PolarHBondContact O-OE1 3.45Å; Q149-T151 PolarHBondContact O-N 2.97Å
150	P	70.5	Confident	80.4	Confident	28 Å²	28	78.2 Å²	78.2	18%	0.182	43%	0.431	C	S	.	.			trans	-56.7	129.8	166.1	-20.2	32.1	0	0	0	110.2	S152 A155 Y156 W159	P150-S152 PolarHBondContact O-N 3.22Å; P150-A155 HydrophobicContact CB-CB 3.63Å; P150-Y156 HydrophobicContact CG-CD2 4.35Å; P150-W159 HydrophobicContact CG-CB 4.41Å
151	T	75.8	Confident	80.6	Confident	150 Å²	150	80.2 Å²	80.2	92%	0.92	43%	0.428	S	S	*	.	S	Bend	trans	-71.3	-13.5	-173.1	52.2	0	0	0	0	114.2	Q149	Q149-T151 PolarHBondContact O-N 2.97Å
152	S	82.8	Confident	81.3	Confident	58 Å²	58	76.6 Å²	76.6	41%	0.406	41%	0.408	S	S	.	.	S	Bend	trans	-132.8	153.5	-178.5	68.9	0	0	0	0	111.3	P150 A154 A155 Y156	P150-S152 PolarHBondContact O-N 3.22Å; S152-A154 VanDerWaalsContact C-N 3.27Å; S152-A154 PolarHBondContact O-N 3.39Å; S152-A155 PolarHBondContact O-N 3.35Å; S152-A155 WeakPolarHBondContact OG-CB 3.43Å; S152-A155 PolarHBondContact OG-N 2.96Å; S152-Y156 PolarHBondContact O-N 3.11Å
153	L	83.3	Confident	81.9	Confident	127 Å²	127	73.5 Å²	73.5	67%	0.665	39%	0.391	S	S	*	.	H	α-helix	trans	-57.4	-41.9	175.9	-177.5	64.5	0	0	0	111.7	A155 Y156 E157	L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.5Å; L153-Y156 WeakPolarHBondContact O-CB 3.29Å; L153-Y156 PolarHBondContact O-N 3.32Å; L153-Y156 VanDerWaalsContact O-N 3.14Å; L153-E157 WeakPolarHBondContact O-CG 3.47Å; L153-E157 PolarHBondContact O-N 3.04Å
154	A	85.9	Confident	83	Confident	70 Å²	70	69.8 Å²	69.8	58%	0.579	38%	0.38	S	S	*	.	H	α-helix	trans	-60.9	-41.7	177.9	0	0	0	0	0	112.2	S152 Y156 E157 D158	S152-A154 VanDerWaalsContact C-N 3.27Å; S152-A154 PolarHBondContact O-N 3.39Å; A154-Y156 VanDerWaalsContact C-N 3.32Å; A154-Y156 PolarHBondContact O-N 3.41Å; A154-E157 PolarHBondContact O-N 3.17Å; A154-D158 WeakPolarHBondContact O-CB 3.45Å; A154-D158 PolarHBondContact O-N 3.45Å
155	A	84.4	Confident	83.9	Confident	38 Å²	38	63.9 Å²	63.9	31%	0.314	35%	0.354	S	S	.	.	H	α-helix	trans	-68.5	-32.8	176.6	0	0	0	0	0	112.1	P150 S152 L153 W159	P150-A155 HydrophobicContact CB-CB 3.63Å; S152-A155 PolarHBondContact O-N 3.35Å; S152-A155 WeakPolarHBondContact OG-CB 3.43Å; S152-A155 PolarHBondContact OG-N 2.96Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.5Å; A155-W159 WeakPolarHBondContact O-CB 3.45Å; A155-W159 PolarHBondContact O-N 3.41Å
156	Y	84.2	Confident	84.6	Confident	39 Å²	39	62.6 Å²	62.6	15%	0.153	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-43.3	173.4	-177.9	-97.5	0	0	0	112.5	I138 P150 S152 L153 A154 W159 R160	I138-Y156 HydrophobicContact CG2-CE1 4.5Å; I138-Y156 PolarHBondContact O-OH 3.21Å; P150-Y156 HydrophobicContact CG-CD2 4.35Å; S152-Y156 PolarHBondContact O-N 3.11Å; L153-Y156 WeakPolarHBondContact O-CB 3.29Å; L153-Y156 PolarHBondContact O-N 3.32Å; L153-Y156 VanDerWaalsContact O-N 3.14Å; A154-Y156 VanDerWaalsContact C-N 3.32Å; A154-Y156 PolarHBondContact O-N 3.41Å; Y156-W159 PolarHBondContact O-N 3Å; Y156-R160 WeakPolarHBondContact O-CB 3.44Å; Y156-R160 PolarHBondContact O-N 2.94Å
157	E	87.3	Confident	85.2	Confident	82 Å²	82	62.9 Å²	62.9	38%	0.383	35%	0.351	S	S	.	.	H	α-helix	trans	-65.7	-41	176	-70.6	-177.2	162.8	0	0	112.5	L153 A154 W159 R160 N161	L153-E157 WeakPolarHBondContact O-CG 3.47Å; L153-E157 PolarHBondContact O-N 3.04Å; A154-E157 PolarHBondContact O-N 3.17Å; E157-W159 VanDerWaalsContact C-N 3.34Å; E157-R160 PolarHBondContact O-N 2.82Å; E157-N161 VanDerWaalsContact O-CG 3.27Å; E157-N161 PolarHBondContact O-N 2.79Å; E157-N161 PolarHBondContact O-ND2 3.48Å
158	D	88.8	Confident	86.2	Confident	74 Å²	74	61.2 Å²	61.2	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-46.7	172.7	-174.9	56.1	0	0	0	110.7	A154 R160 N161 R162	A154-D158 WeakPolarHBondContact O-CB 3.45Å; A154-D158 PolarHBondContact O-N 3.45Å; D158-R160 PolarHBondContact O-N 3.35Å; D158-N161 PolarHBondContact O-N 3.38Å; D158-R162 WeakPolarHBondContact O-CG 3.38Å; D158-R162 PolarHBondContact O-N 3.35Å; D158-R162 IonicContact OD1-NE 3.46Å; D158-R162 IonicContact OD2-CZ 3.89Å; D158-R162 IonicContact OD2-NE 3.39Å; D158-R162 PolarHBondContact OD2-NE 2.91Å; D158-R162 IonicContact OD2-NH2 2.82Å; D158-R162 PolarHBondContact OD2-NH2 3.41Å
159	W	87.8	Confident	87.4	Confident	11 Å²	11	57.8 Å²	57.8	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-46.9	177.3	-168.9	-111.4	0	0	0	112.3	L70 Y74 H146 P150 A155 Y156 E157 N161 R162 I163	L70-W159 HydrophobicContact CD1-CD2 3.66Å; L70-W159 HydrophobicContact CD1-CE3 4.01Å; L70-W159 HydrophobicContact CD1-CG 4.21Å; L70-W159 HydrophobicContact CD1-CH2 4.25Å; L70-W159 HydrophobicContact CD1-CZ2 3.82Å; L70-W159 HydrophobicContact CD1-CZ3 4.3Å; Y74-W159 AromaticContact CD2-CZ2 3.94Å; Y74-W159 HydrophobicContact CD2-CZ2 3.94Å; Y74-W159 HydrophobicContact CE1-CZ2 4.03Å; Y74-W159 AromaticContact CE2-CE2 3.94Å; Y74-W159 HydrophobicContact CE2-CH2 4.34Å; Y74-W159 AromaticContact CE2-CZ2 3.32Å; Y74-W159 HydrophobicContact CE2-CZ2 3.32Å; Y74-W159 AromaticContact CZ-CE2 3.9Å; Y74-W159 AromaticContact CZ-CZ2 3.38Å; Y74-W159 AromaticContact CZ-NE1 3.8Å; Y74-W159 WeakPolarHBondContact OH-CZ2 3.49Å; Y74-W159 PolarHBondContact OH-NE1 3.32Å; H146-W159 AromaticContact CE1-CD1 3.92Å; H146-W159 AromaticContact CE1-NE1 3.57Å; P150-W159 HydrophobicContact CG-CB 4.41Å; A155-W159 WeakPolarHBondContact O-CB 3.45Å; A155-W159 PolarHBondContact O-N 3.41Å; Y156-W159 PolarHBondContact O-N 3Å; E157-W159 VanDerWaalsContact C-N 3.34Å; W159-N161 VanDerWaalsContact C-N 3.29Å; W159-N161 PolarHBondContact O-N 3.16Å; W159-R162 HydrophobicContact CE3-CB 4.47Å; W159-R162 WeakPolarHBondContact O-CB 3.47Å; W159-R162 PolarHBondContact O-N 3.25Å; W159-R162 VanDerWaalsContact O-N 3.11Å; W159-I163 HydrophobicContact CD2-CG1 4.42Å; W159-I163 HydrophobicContact CH2-CD1 4.16Å; W159-I163 HydrophobicContact CZ2-CD1 3.47Å; W159-I163 VanDerWaalsContact CZ2-CD1 3.47Å; W159-I163 HydrophobicContact CZ2-CG1 4.08Å; W159-I163 WeakPolarHBondContact O-CG1 3.49Å; W159-I163 PolarHBondContact O-N 3.41Å
160	R	88.5	Confident	88.7	Confident	74 Å²	74	53.9 Å²	53.9	28%	0.279	31%	0.308	S	S	.	.	H	α-helix	trans	-54.4	-46	175.7	-178.9	-178.6	71.3	-162.9	-4.4	111.7	I138 F139 Y156 E157 D158 R162 I163 V164	I138-R160 HydrophobicContact CG2-CB 3.86Å; I138-R160 HydrophobicContact CG2-CG 3.68Å; F139-R160 HydrophobicContact CE1-CG 4.08Å; F139-R160 HydrophobicContact CE2-CG 4.31Å; F139-R160 HydrophobicContact CZ-CG 3.81Å; Y156-R160 WeakPolarHBondContact O-CB 3.44Å; Y156-R160 PolarHBondContact O-N 2.94Å; E157-R160 PolarHBondContact O-N 2.82Å; D158-R160 PolarHBondContact O-N 3.35Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R160-R162 PolarHBondContact O-N 3.5Å; R160-I163 PolarHBondContact O-N 2.85Å; R160-V164 WeakPolarHBondContact O-CG2 3.27Å; R160-V164 PolarHBondContact O-N 3.24Å
161	N	91.8	Very high	89.9	Confident	99 Å²	99	56.4 Å²	56.4	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-39.2	178.9	-67.6	-19.2	0	0	0	111.9	E157 D158 W159 V164 G165	E157-N161 VanDerWaalsContact O-CG 3.27Å; E157-N161 PolarHBondContact O-N 2.79Å; E157-N161 PolarHBondContact O-ND2 3.48Å; D158-N161 PolarHBondContact O-N 3.38Å; W159-N161 VanDerWaalsContact C-N 3.29Å; W159-N161 PolarHBondContact O-N 3.16Å; N161-V164 PolarHBondContact O-N 2.79Å; N161-G165 PolarHBondContact O-N 3.06Å
162	R	91.8	Very high	90.8	Very high	75 Å²	75	51.6 Å²	51.6	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-43.6	175.2	-69.9	175	-171.6	-139.2	6.2	111.9	L63 D158 W159 R160 V164 G165 V166	L63-R162 HydrophobicContact CD2-CG 4.45Å; D158-R162 WeakPolarHBondContact O-CG 3.38Å; D158-R162 PolarHBondContact O-N 3.35Å; D158-R162 IonicContact OD1-NE 3.46Å; D158-R162 IonicContact OD2-CZ 3.89Å; D158-R162 IonicContact OD2-NE 3.39Å; D158-R162 PolarHBondContact OD2-NE 2.91Å; D158-R162 IonicContact OD2-NH2 2.82Å; D158-R162 PolarHBondContact OD2-NH2 3.41Å; W159-R162 HydrophobicContact CE3-CB 4.47Å; W159-R162 WeakPolarHBondContact O-CB 3.47Å; W159-R162 PolarHBondContact O-N 3.25Å; W159-R162 VanDerWaalsContact O-N 3.11Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R160-R162 PolarHBondContact O-N 3.5Å; R162-V164 VanDerWaalsContact C-N 3.33Å; R162-V164 PolarHBondContact O-N 3.05Å; R162-G165 CarbonylContact O-C 3.54Å; R162-G165 WeakPolarHBondContact O-CA 3.35Å; R162-G165 PolarHBondContact O-N 3.42Å; R162-G165 VanDerWaalsContact O-N 3.07Å; R162-V166 VanDerWaalsContact O-CG2 3.29Å; R162-V166 WeakPolarHBondContact O-CG2 3.47Å; R162-V166 PolarHBondContact O-N 3.11Å
163	I	91.4	Very high	91.4	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-36.2	180	-65.2	-50.1	0	0	0	112.4	Y74 D134 I138 W159 R160 G165 V166 T167	Y74-I163 HydrophobicContact CD1-CD1 4.47Å; Y74-I163 HydrophobicContact CE1-CD1 3.49Å; Y74-I163 VanDerWaalsContact CE1-CD1 3.49Å; Y74-I163 WeakPolarHBondContact OH-CD1 3.36Å; D134-I163 HydrophobicContact CB-CG2 4.37Å; D134-I163 WeakPolarHBondContact OD2-CD1 3.14Å; D134-I163 WeakPolarHBondContact OD2-CG1 3.28Å; D134-I163 VanDerWaalsContact OD2-CG2 3.29Å; D134-I163 WeakPolarHBondContact OD2-CG2 3.44Å; I138-I163 HydrophobicContact CD1-CB 4.2Å; I138-I163 HydrophobicContact CD1-CG1 3.92Å; I138-I163 HydrophobicContact CD1-CG2 4.23Å; W159-I163 HydrophobicContact CD2-CG1 4.42Å; W159-I163 HydrophobicContact CH2-CD1 4.16Å; W159-I163 HydrophobicContact CZ2-CD1 3.47Å; W159-I163 VanDerWaalsContact CZ2-CD1 3.47Å; W159-I163 HydrophobicContact CZ2-CG1 4.08Å; W159-I163 WeakPolarHBondContact O-CG1 3.49Å; W159-I163 PolarHBondContact O-N 3.41Å; R160-I163 PolarHBondContact O-N 2.85Å; I163-G165 VanDerWaalsContact C-N 3.35Å; I163-V166 WeakPolarHBondContact O-CB 3.37Å; I163-V166 PolarHBondContact O-N 3.24Å; I163-T167 WeakPolarHBondContact O-CB 3.38Å; I163-T167 PolarHBondContact O-N 3.41Å; I163-T167 PolarHBondContact O-OG1 2.97Å
164	V	94.5	Very high	91.9	Very high	56 Å²	56	44 Å²	44	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-47.4	169.4	175.1	0	0	0	0	110.2	F139 R160 N161 R162 V166 T167 V168	F139-V164 HydrophobicContact CE2-CG2 3.81Å; F139-V164 HydrophobicContact CZ-CG2 3.81Å; R160-V164 WeakPolarHBondContact O-CG2 3.27Å; R160-V164 PolarHBondContact O-N 3.24Å; N161-V164 PolarHBondContact O-N 2.79Å; R162-V164 VanDerWaalsContact C-N 3.33Å; R162-V164 PolarHBondContact O-N 3.05Å; V164-V166 PolarHBondContact O-N 3.18Å; V164-T167 WeakPolarHBondContact O-CB 3.18Å; V164-T167 PolarHBondContact O-N 2.95Å; V164-V168 WeakPolarHBondContact O-CG2 3.34Å; V164-V168 PolarHBondContact O-N 2.99Å
165	G	95	Very high	92.2	Very high	25 Å²	25	43.4 Å²	43.4	26%	0.258	24%	0.236	S	C	.	.	H	α-helix	trans	-58.2	-45	176.4	0	0	0	0	0	113.2	N161 R162 I163 T167 V168 I169	N161-G165 PolarHBondContact O-N 3.06Å; R162-G165 CarbonylContact O-C 3.54Å; R162-G165 WeakPolarHBondContact O-CA 3.35Å; R162-G165 PolarHBondContact O-N 3.42Å; R162-G165 VanDerWaalsContact O-N 3.07Å; I163-G165 VanDerWaalsContact C-N 3.35Å; G165-T167 PolarHBondContact O-N 3.22Å; G165-V168 PolarHBondContact O-N 3.39Å; G165-I169 VanDerWaalsContact O-CG1 3.29Å; G165-I169 WeakPolarHBondContact O-CG1 3.29Å; G165-I169 PolarHBondContact O-N 3.48Å
166	V	94.4	Very high	92.5	Very high	1 Å²	1	44 Å²	44	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-55.9	-49.3	173.9	161.6	0	0	0	0	111	L60 L63 I64 A131 R162 I163 V164 V168 I169 I170	L60-V166 HydrophobicContact CD1-CB 4.12Å; L60-V166 HydrophobicContact CD1-CG1 3.83Å; L60-V166 HydrophobicContact CD1-CG2 4.04Å; L63-V166 HydrophobicContact CB-CG2 3.97Å; L63-V166 HydrophobicContact CD1-CG2 4.32Å; I64-V166 HydrophobicContact CD1-CB 4.41Å; I64-V166 HydrophobicContact CD1-CG1 3.73Å; I64-V166 HydrophobicContact CD1-CG2 3.77Å; I64-V166 HydrophobicContact CG1-CB 4.5Å; I64-V166 HydrophobicContact CG1-CG1 4.28Å; I64-V166 HydrophobicContact CG1-CG2 3.42Å; I64-V166 VanDerWaalsContact CG1-CG2 3.42Å; A131-V166 HydrophobicContact CB-CG1 4.26Å; R162-V166 VanDerWaalsContact O-CG2 3.29Å; R162-V166 WeakPolarHBondContact O-CG2 3.47Å; R162-V166 PolarHBondContact O-N 3.11Å; I163-V166 WeakPolarHBondContact O-CB 3.37Å; I163-V166 PolarHBondContact O-N 3.24Å; V164-V166 PolarHBondContact O-N 3.18Å; V166-V168 VanDerWaalsContact C-N 3.33Å; V166-V168 PolarHBondContact O-N 3.42Å; V166-I169 PolarHBondContact O-N 3.33Å; V166-I170 HydrophobicContact CG1-CD1 3.78Å; V166-I170 VanDerWaalsContact O-CG1 3.3Å; V166-I170 WeakPolarHBondContact O-CG1 3.37Å; V166-I170 PolarHBondContact O-N 3.32Å
167	T	95	Very high	92.8	Very high	19 Å²	19	42.1 Å²	42.1	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-44.9	179.8	-55.1	0	0	0	0	111.1	F128 C135 I163 V164 G165 I170 I171	F128-T167 HydrophobicContact CD2-CG2 4.27Å; F128-T167 HydrophobicContact CE2-CG2 3.76Å; C135-T167 PolarHBondContact SG-OG1 3.5Å; C135-T167 VanDerWaalsContact SG-OG1 3.41Å; I163-T167 WeakPolarHBondContact O-CB 3.38Å; I163-T167 PolarHBondContact O-N 3.41Å; I163-T167 PolarHBondContact O-OG1 2.97Å; V164-T167 WeakPolarHBondContact O-CB 3.18Å; V164-T167 PolarHBondContact O-N 2.95Å; G165-T167 PolarHBondContact O-N 3.22Å; T167-I170 PolarHBondContact O-N 3.41Å; T167-I171 WeakPolarHBondContact O-CG2 3.44Å; T167-I171 PolarHBondContact O-N 2.48Å; T167-I171 VanDerWaalsContact O-N 3.12Å
168	V	96.4	Very high	92.9	Very high	81 Å²	81	40.7 Å²	40.7	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-65.1	-38.7	178	172.9	0	0	0	0	112	V164 G165 V166 I171 T172	V164-V168 WeakPolarHBondContact O-CG2 3.34Å; V164-V168 PolarHBondContact O-N 2.99Å; G165-V168 PolarHBondContact O-N 3.39Å; V166-V168 VanDerWaalsContact C-N 3.33Å; V166-V168 PolarHBondContact O-N 3.42Å; V168-I171 WeakPolarHBondContact O-CG2 3.41Å; V168-T172 WeakPolarHBondContact O-CB 3.45Å; V168-T172 PolarHBondContact O-N 3.06Å; V168-T172 VanDerWaalsContact O-N 3.1Å; V168-T172 PolarHBondContact O-OG1 2.9Å
169	I	96.1	Very high	92.9	Very high	23 Å²	23	41.2 Å²	41.2	12%	0.118	23%	0.229	C	C	.	.	H	α-helix	trans	-69.3	-42.5	178	-70.7	164.8	0	0	0	110.5	L56 V59 L60 L63 G165 V166 I171 T172 I173	L56-I169 HydrophobicContact CB-CG2 4.31Å; L56-I169 HydrophobicContact CD2-CG2 4.36Å; V59-I169 HydrophobicContact CG1-CD1 3.74Å; L60-I169 HydrophobicContact CB-CG2 4.01Å; L60-I169 HydrophobicContact CD1-CB 4.43Å; L60-I169 HydrophobicContact CD1-CG2 4.23Å; L60-I169 HydrophobicContact CD2-CG2 4.41Å; L60-I169 HydrophobicContact CG-CG2 4.47Å; L63-I169 HydrophobicContact CD1-CD1 3.44Å; L63-I169 VanDerWaalsContact CD1-CD1 3.44Å; G165-I169 VanDerWaalsContact O-CG1 3.29Å; G165-I169 WeakPolarHBondContact O-CG1 3.29Å; G165-I169 PolarHBondContact O-N 3.48Å; V166-I169 PolarHBondContact O-N 3.33Å; I169-I171 PolarHBondContact O-N 3.04Å; I169-T172 WeakPolarHBondContact O-CB 3.49Å; I169-T172 PolarHBondContact O-N 3.14Å; I169-T172 VanDerWaalsContact O-N 3.13Å; I169-I173 HydrophobicContact CG2-CD1 3.82Å; I169-I173 HydrophobicContact CG2-CG1 4.36Å; I169-I173 WeakPolarHBondContact O-CG1 3.45Å; I169-I173 PolarHBondContact O-N 2.97Å
170	I	96.1	Very high	92.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-45.9	178.7	-68.2	166.7	0	0	0	111	L60 I77 F124 A127 F128 A131 V166 T167 T172 I173 L174	L60-I170 HydrophobicContact CD1-CD1 4.45Å; L60-I170 HydrophobicContact CD1-CG1 4.07Å; L60-I170 HydrophobicContact CD2-CG1 3.79Å; I77-I170 HydrophobicContact CD1-CD1 4.5Å; I77-I170 HydrophobicContact CG2-CD1 4.19Å; F124-I170 HydrophobicContact CB-CG2 4.45Å; F124-I170 HydrophobicContact CD1-CG2 4.28Å; F124-I170 WeakPolarHBondContact O-CG2 3.46Å; A127-I170 HydrophobicContact CB-CD1 4.2Å; F128-I170 HydrophobicContact CB-CG2 3.65Å; F128-I170 HydrophobicContact CD2-CB 4.5Å; F128-I170 HydrophobicContact CD2-CG2 4.1Å; F128-I170 HydrophobicContact CG-CG2 4.36Å; A131-I170 HydrophobicContact CB-CD1 3.94Å; V166-I170 HydrophobicContact CG1-CD1 3.78Å; V166-I170 VanDerWaalsContact O-CG1 3.3Å; V166-I170 WeakPolarHBondContact O-CG1 3.37Å; V166-I170 PolarHBondContact O-N 3.32Å; T167-I170 PolarHBondContact O-N 3.41Å; I170-T172 PolarHBondContact O-N 3.31Å; I170-I173 PolarHBondContact O-N 2.9Å; I170-L174 HydrophobicContact CG2-CD1 4.18Å; I170-L174 WeakPolarHBondContact O-CG 3.29Å; I170-L174 PolarHBondContact O-N 2.99Å
171	I	95.6	Very high	92.8	Very high	80 Å²	80	38.7 Å²	38.7	41%	0.41	22%	0.223	S	C	.	.	H	α-helix	trans	-64.1	-33.4	177.2	-169	167.3	0	0	0	111.8	F128 T167 V168 I169 L174 S175	F128-I171 HydrophobicContact CD2-CB 4.33Å; F128-I171 HydrophobicContact CE2-CB 3.95Å; F128-I171 HydrophobicContact CE2-CD1 4.33Å; F128-I171 HydrophobicContact CZ-CD1 4.27Å; T167-I171 WeakPolarHBondContact O-CG2 3.44Å; T167-I171 PolarHBondContact O-N 2.48Å; T167-I171 VanDerWaalsContact O-N 3.12Å; V168-I171 WeakPolarHBondContact O-CG2 3.41Å; I169-I171 PolarHBondContact O-N 3.04Å; I171-L174 PolarHBondContact O-N 3.37Å; I171-S175 WeakPolarHBondContact O-CB 3.36Å; I171-S175 PolarHBondContact O-N 3.19Å; I171-S175 PolarHBondContact O-OG 3.24Å
172	T	95.6	Very high	92.5	Very high	50 Å²	50	40.3 Å²	40.3	31%	0.307	23%	0.225	S	C	.	.	H	α-helix	trans	-65.4	-46.5	175	-59.8	0	0	0	0	110.8	L56 V168 I169 I170 S175 F176	L56-T172 HydrophobicContact CD1-CG2 3.86Å; V168-T172 WeakPolarHBondContact O-CB 3.45Å; V168-T172 PolarHBondContact O-N 3.06Å; V168-T172 VanDerWaalsContact O-N 3.1Å; V168-T172 PolarHBondContact O-OG1 2.9Å; I169-T172 WeakPolarHBondContact O-CB 3.49Å; I169-T172 PolarHBondContact O-N 3.14Å; I169-T172 VanDerWaalsContact O-N 3.13Å; I170-T172 PolarHBondContact O-N 3.31Å; T172-S175 WeakPolarHBondContact O-CB 3.47Å; T172-S175 PolarHBondContact O-N 3.02Å; T172-F176 HydrophobicContact CG2-CD2 3.92Å; T172-F176 HydrophobicContact CG2-CE2 3.52Å; T172-F176 WeakPolarHBondContact O-CD2 3.14Å; T172-F176 PolarHBondContact O-N 2.97Å
173	I	94.9	Very high	92	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-47.4	175.4	-68.5	167.3	0	0	0	110.9	L56 L60 F124 I169 I170 S175 F176 H177	L56-I173 HydrophobicContact CB-CD1 4.04Å; L56-I173 HydrophobicContact CB-CG1 3.83Å; L56-I173 HydrophobicContact CD1-CG1 4.09Å; L60-I173 HydrophobicContact CD2-CD1 3.94Å; F124-I173 HydrophobicContact CD1-CG2 4.19Å; F124-I173 HydrophobicContact CD2-CG2 3.75Å; F124-I173 HydrophobicContact CE1-CD1 4.03Å; F124-I173 HydrophobicContact CE1-CG2 4.11Å; F124-I173 HydrophobicContact CE2-CG2 3.66Å; F124-I173 HydrophobicContact CG-CG2 4.03Å; F124-I173 HydrophobicContact CZ-CD1 4.25Å; F124-I173 HydrophobicContact CZ-CG2 3.85Å; I169-I173 HydrophobicContact CG2-CD1 3.82Å; I169-I173 HydrophobicContact CG2-CG1 4.36Å; I169-I173 WeakPolarHBondContact O-CG1 3.45Å; I169-I173 PolarHBondContact O-N 2.97Å; I170-I173 PolarHBondContact O-N 2.9Å; I173-S175 VanDerWaalsContact C-N 3.3Å; I173-S175 PolarHBondContact O-N 3.24Å; I173-F176 WeakPolarHBondContact O-CB 3.38Å; I173-F176 PolarHBondContact O-N 3.32Å; I173-F176 VanDerWaalsContact O-N 3.12Å; I173-H177 PolarHBondContact O-CD2 3.35Å; I173-H177 VanDerWaalsContact O-CD2 3.22Å; I173-H177 PolarHBondContact O-N 2.96Å
174	L	94.6	Very high	91.4	Very high	24 Å²	24	44 Å²	44	13%	0.126	25%	0.25	C	C	.	.	H	α-helix	trans	-55.8	-45.5	175.5	-79.3	171	0	0	0	111.8	I121 F124 F128 I170 I171 F176 H177 A178	I121-L174 HydrophobicContact CG2-CD2 4.4Å; I121-L174 WeakPolarHBondContact O-CD2 3.4Å; F124-L174 HydrophobicContact CB-CD2 3.57Å; F124-L174 HydrophobicContact CB-CG 3.85Å; F128-L174 HydrophobicContact CB-CD1 3.93Å; F128-L174 HydrophobicContact CG-CD1 4.22Å; I170-L174 HydrophobicContact CG2-CD1 4.18Å; I170-L174 WeakPolarHBondContact O-CG 3.29Å; I170-L174 PolarHBondContact O-N 2.99Å; I171-L174 PolarHBondContact O-N 3.37Å; L174-F176 VanDerWaalsContact C-N 3.3Å; L174-F176 PolarHBondContact O-N 2.87Å; L174-H177 PolarHBondContact O-N 3.28Å; L174-A178 WeakPolarHBondContact O-CB 3.38Å; L174-A178 PolarHBondContact O-N 3.48Å
175	S	92.4	Very high	90.5	Very high	57 Å²	57	45 Å²	45	40%	0.399	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-42.9	177.6	-55.8	0	0	0	0	111.2	I171 T172 I173 A178 I179	I171-S175 WeakPolarHBondContact O-CB 3.36Å; I171-S175 PolarHBondContact O-N 3.19Å; I171-S175 PolarHBondContact O-OG 3.24Å; T172-S175 WeakPolarHBondContact O-CB 3.47Å; T172-S175 PolarHBondContact O-N 3.02Å; I173-S175 VanDerWaalsContact C-N 3.3Å; I173-S175 PolarHBondContact O-N 3.24Å; S175-A178 PolarHBondContact O-N 3.39Å; S175-I179 WeakPolarHBondContact O-CB 3.49Å; S175-I179 WeakPolarHBondContact O-CD1 3.32Å; S175-I179 VanDerWaalsContact O-CG1 3.25Å; S175-I179 WeakPolarHBondContact O-CG1 3.38Å; S175-I179 PolarHBondContact O-N 3.42Å
176	F	90.9	Very high	89.6	Confident	50 Å²	50	48 Å²	48	22%	0.219	27%	0.269	C	S	.	.	H	α-helix	trans	-64.5	-39.8	176.3	-78.2	-60.7	0	0	0	113.4	L49 V52 L56 T172 I173 L174 R180	L49-F176 HydrophobicContact CD2-CD1 3.76Å; L49-F176 HydrophobicContact CD2-CE1 3.7Å; V52-F176 HydrophobicContact CG1-CE2 3.87Å; V52-F176 HydrophobicContact CG1-CZ 3.9Å; L56-F176 HydrophobicContact CD1-CD2 3.83Å; L56-F176 HydrophobicContact CD1-CE2 3.67Å; T172-F176 HydrophobicContact CG2-CD2 3.92Å; T172-F176 HydrophobicContact CG2-CE2 3.52Å; T172-F176 WeakPolarHBondContact O-CD2 3.14Å; T172-F176 PolarHBondContact O-N 2.97Å; I173-F176 WeakPolarHBondContact O-CB 3.38Å; I173-F176 PolarHBondContact O-N 3.32Å; I173-F176 VanDerWaalsContact O-N 3.12Å; L174-F176 VanDerWaalsContact C-N 3.3Å; L174-F176 PolarHBondContact O-N 2.87Å; F176-R180 WeakPolarHBondContact O-CG 3.05Å; F176-R180 PolarHBondContact O-N 2.94Å; F176-R180 VanDerWaalsContact O-N 3.13Å; F176-R180 PolarHBondContact O-NE 3.35Å
177	H	90.3	Very high	87.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-42.2	174	-73.5	-78.4	0	0	0	112.3	E53 N117 A120 I121 I173 L174 I179 R180 C181	E53-H177 IonicContact OE1-CE1 3.1Å; E53-H177 PolarHBondContact OE1-CE1 3.19Å; E53-H177 IonicContact OE1-ND1 3.44Å; E53-H177 IonicContact OE1-NE2 2.8Å; E53-H177 PolarHBondContact OE1-NE2 2.87Å; E53-H177 VanDerWaalsContact OE1-NE2 3.1Å; N117-H177 PolarHBondContact OD1-ND1 2.97Å; A120-H177 WeakPolarHBondContact CB-CE1 3.45Å; A120-H177 WeakPolarHBondContact CB-NE2 3.44Å; I121-H177 HydrophobicContact CD1-CB 3.97Å; I121-H177 HydrophobicContact CG1-CB 3.45Å; I121-H177 VanDerWaalsContact CG1-CB 3.45Å; I173-H177 PolarHBondContact O-CD2 3.35Å; I173-H177 VanDerWaalsContact O-CD2 3.22Å; I173-H177 PolarHBondContact O-N 2.96Å; L174-H177 PolarHBondContact O-N 3.28Å; H177-I179 PolarHBondContact O-N 3.37Å; H177-R180 PolarHBondContact CE1-NH2 3.44Å; H177-R180 PolarHBondContact ND1-NH2 2.74Å; H177-R180 PolarHBondContact NE2-NH2 3.39Å; H177-R180 PolarHBondContact O-N 2.91Å; H177-R180 VanDerWaalsContact O-N 3.16Å; H177-C181 PolarHBondContact O-N 3.46Å; H177-C181 PolarHBondContact O-SG 2.9Å
178	A	89.3	Confident	86.1	Confident	52 Å²	52	58.2 Å²	58.2	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-60.1	-45.5	178.2	0	0	0	0	0	111.4	L174 S175 R180 C181 F182	L174-A178 WeakPolarHBondContact O-CB 3.38Å; L174-A178 PolarHBondContact O-N 3.48Å; S175-A178 PolarHBondContact O-N 3.39Å; A178-R180 VanDerWaalsContact C-N 3.32Å; A178-R180 PolarHBondContact O-N 3.34Å; A178-C181 PolarHBondContact O-N 2.99Å; A178-F182 WeakPolarHBondContact O-CB 3.49Å; A178-F182 PolarHBondContact O-N 3.5Å
179	I	88.8	Confident	83.3	Confident	86 Å²	86	61.4 Å²	61.4	44%	0.441	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-43.1	174.9	-68.8	164.8	0	0	0	110.7	S175 H177 F182 L183	S175-I179 WeakPolarHBondContact O-CB 3.49Å; S175-I179 WeakPolarHBondContact O-CD1 3.32Å; S175-I179 VanDerWaalsContact O-CG1 3.25Å; S175-I179 WeakPolarHBondContact O-CG1 3.38Å; S175-I179 PolarHBondContact O-N 3.42Å; H177-I179 PolarHBondContact O-N 3.37Å; I179-F182 WeakPolarHBondContact O-CB 3.35Å; I179-F182 PolarHBondContact O-N 3.33Å; I179-L183 HydrophobicContact CG2-CD1 3.89Å; I179-L183 HydrophobicContact CG2-CG 4.27Å; I179-L183 WeakPolarHBondContact O-CB 3.47Å; I179-L183 VanDerWaalsContact O-CG 3.27Å; I179-L183 WeakPolarHBondContact O-CG 3.42Å; I179-L183 PolarHBondContact O-N 2.98Å
180	R	86.7	Confident	80.5	Confident	8 Å²	8	65.9 Å²	65.9	3%	0.03	37%	0.366	C	S	.	.	H	α-helix	trans	-67.1	-42.5	178.6	-75.5	-178.7	-68	175	1.7	113.2	L49 K50 E53 F176 H177 A178 F182 L183 N184	L49-R180 HydrophobicContact CD1-CG 4.45Å; K50-R180 VanDerWaalsContact CD-NH1 3.3Å; E53-R180 IonicContact OE1-CZ 3.67Å; E53-R180 IonicContact OE1-NH1 3.63Å; E53-R180 IonicContact OE1-NH2 2.67Å; E53-R180 PolarHBondContact OE1-NH2 3.11Å; E53-R180 IonicContact OE2-CZ 3.26Å; E53-R180 VanDerWaalsContact OE2-CZ 3.26Å; E53-R180 IonicContact OE2-NH1 2.64Å; E53-R180 PolarHBondContact OE2-NH1 2.97Å; E53-R180 IonicContact OE2-NH2 2.74Å; E53-R180 PolarHBondContact OE2-NH2 3.11Å; F176-R180 WeakPolarHBondContact O-CG 3.05Å; F176-R180 PolarHBondContact O-N 2.94Å; F176-R180 VanDerWaalsContact O-N 3.13Å; F176-R180 PolarHBondContact O-NE 3.35Å; H177-R180 PolarHBondContact CE1-NH2 3.44Å; H177-R180 PolarHBondContact ND1-NH2 2.74Å; H177-R180 PolarHBondContact NE2-NH2 3.39Å; H177-R180 PolarHBondContact O-N 2.91Å; H177-R180 VanDerWaalsContact O-N 3.16Å; A178-R180 VanDerWaalsContact C-N 3.32Å; A178-R180 PolarHBondContact O-N 3.34Å; R180-F182 VanDerWaalsContact C-N 3.28Å; R180-F182 PolarHBondContact O-N 3.36Å; R180-L183 PolarHBondContact O-N 3.23Å; R180-N184 WeakPolarHBondContact O-CB 3.37Å; R180-N184 PolarHBondContact O-N 3.38Å
181	C	86.7	Confident	77.7	Confident	23 Å²	23	73 Å²	73	16%	0.155	41%	0.409	C	S	.	.	H	α-helix	trans	-59.5	-42.9	172.9	-73.6	0	0	0	0	111	L114 N117 I121 H177 A178 N184 S185	L114-C181 HydrophobicContact CD1-CB 4.47Å; N117-C181 VanDerWaalsContact CB-SG 3.57Å; I121-C181 HydrophobicContact CD1-CB 4.4Å; I121-C181 VanDerWaalsContact CD1-SG 3.6Å; H177-C181 PolarHBondContact O-N 3.46Å; H177-C181 PolarHBondContact O-SG 2.9Å; A178-C181 PolarHBondContact O-N 2.99Å; C181-N184 PolarHBondContact O-N 3.3Å; C181-S185 WeakPolarHBondContact O-CB 3.29Å; C181-S185 PolarHBondContact O-N 3.07Å
182	F	85.3	Confident	74.6	Confident	134 Å²	134	80.4 Å²	80.4	59%	0.588	44%	0.442	S	S	*	.	H	α-helix	trans	-62.2	-50	176	-178.2	-99.1	0	0	0	111.8	A178 I179 R180 N184 S185 I186	A178-F182 WeakPolarHBondContact O-CB 3.49Å; A178-F182 PolarHBondContact O-N 3.5Å; I179-F182 WeakPolarHBondContact O-CB 3.35Å; I179-F182 PolarHBondContact O-N 3.33Å; R180-F182 VanDerWaalsContact C-N 3.28Å; R180-F182 PolarHBondContact O-N 3.36Å; F182-N184 VanDerWaalsContact C-N 3.31Å; F182-N184 PolarHBondContact O-N 2.77Å; F182-S185 WeakPolarHBondContact O-CB 3.44Å; F182-S185 PolarHBondContact O-N 3.46Å; F182-S185 PolarHBondContact O-OG 3.09Å; F182-I186 HydrophobicContact CD1-CD1 4.35Å; F182-I186 HydrophobicContact CE1-CD1 3.96Å; F182-I186 HydrophobicContact CE1-CG1 4.38Å; F182-I186 PolarHBondContact O-N 3.11Å
183	L	82.4	Confident	73.6	Confident	88 Å²	88	81.9 Å²	81.9	46%	0.461	45%	0.449	S	S	.	.	H	α-helix	trans	-60.3	-38.8	178.3	-70.6	173.8	0	0	0	112.6	I179 R180 S185 I186	I179-L183 HydrophobicContact CG2-CD1 3.89Å; I179-L183 HydrophobicContact CG2-CG 4.27Å; I179-L183 WeakPolarHBondContact O-CB 3.47Å; I179-L183 VanDerWaalsContact O-CG 3.27Å; I179-L183 WeakPolarHBondContact O-CG 3.42Å; I179-L183 PolarHBondContact O-N 2.98Å; R180-L183 PolarHBondContact O-N 3.23Å; L183-S185 VanDerWaalsContact C-N 3.27Å; L183-S185 PolarHBondContact O-N 2.86Å; L183-I186 HydrophobicContact CD2-CD1 4.27Å; L183-I186 PolarHBondContact O-N 3.17Å
184	N	79.1	Confident	72.5	Confident	65 Å²	65	86.2 Å²	86.2	35%	0.348	47%	0.472	S	S	.	.	H	α-helix	trans	-71.4	-21.2	175.5	-74.7	-12.4	0	0	0	113.1	L114 R180 C181 F182	L114-N184 HydrophobicContact CD1-CB 4.2Å; R180-N184 WeakPolarHBondContact O-CB 3.37Å; R180-N184 PolarHBondContact O-N 3.38Å; C181-N184 PolarHBondContact O-N 3.3Å; F182-N184 VanDerWaalsContact C-N 3.31Å; F182-N184 PolarHBondContact O-N 2.77Å
185	S	75.9	Confident	71.3	Confident	78 Å²	78	89.6 Å²	89.6	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-84.8	-16.6	178.6	74.1	0	0	0	0	113.8	C181 F182 L183 P187	C181-S185 WeakPolarHBondContact O-CB 3.29Å; C181-S185 PolarHBondContact O-N 3.07Å; F182-S185 WeakPolarHBondContact O-CB 3.44Å; F182-S185 PolarHBondContact O-N 3.46Å; F182-S185 PolarHBondContact O-OG 3.09Å; L183-S185 VanDerWaalsContact C-N 3.27Å; L183-S185 PolarHBondContact O-N 2.86Å; S185-P187 WeakPolarHBondContact O-CD 3.45Å; S185-P187 VanDerWaalsContact O-N 3.15Å
186	I	74.3	Confident	70	Confident	89 Å²	89	91.5 Å²	91.5	46%	0.456	50%	0.497	S	S	.	.	S	Bend	trans	-67.8	112.8	175.2	-60.7	171.3	0	0	0	107	F182 L183 T188	F182-I186 HydrophobicContact CD1-CD1 4.35Å; F182-I186 HydrophobicContact CE1-CD1 3.96Å; F182-I186 HydrophobicContact CE1-CG1 4.38Å; F182-I186 PolarHBondContact O-N 3.11Å; L183-I186 HydrophobicContact CD2-CD1 4.27Å; L183-I186 PolarHBondContact O-N 3.17Å; I186-T188 PolarHBondContact O-N 3.28Å
187	P	57.7	Low	68.7	Low	87 Å²	87	94.1 Å²	94.1	57%	0.565	51%	0.514	S	S	*	.			trans	-63.2	129.1	173.1	26.9	-31.4	0	0	0	107.4	S185 H189	S185-P187 WeakPolarHBondContact O-CD 3.45Å; S185-P187 VanDerWaalsContact O-N 3.15Å; P187-H189 PolarHBondContact O-N 2.93Å
188	T	58.5	Low	67.3	Low	146 Å²	146	100.4 Å²	100.4	90%	0.896	55%	0.548	S	S	*	.			trans	-69.6	64.2	164.1	54.8	0	0	0	0	108.4	I186 N190	I186-T188 PolarHBondContact O-N 3.28Å; T188-N190 PolarHBondContact O-N 3.14Å
189	H	37.8	Very low	65.7	Low	148 Å²	148	103.9 Å²	103.9	69%	0.685	56%	0.557	S	S	*	*			trans	-72.6	119.1	163.3	-97.3	-71.7	0	0	0	106.4	P187	P187-H189 PolarHBondContact O-N 2.93Å
190	N	37.3	Very low	63.9	Low	117 Å²	117	105.2 Å²	105.2	63%	0.626	57%	0.565	S	S	*	*			trans	77.4	77.9	162.8	-45.7	-21.5	0	0	0	115.8	T188	T188-N190 PolarHBondContact O-N 3.14Å
191	V	36.8	Very low	62	Low	149 Å²	149	113.3 Å²	113.3	90%	0.903	61%	0.61	S	S	*	*			trans	-118.6	102.6	130.7	-173.5	0	0	0	0	105.6
192	H	32.3	Very low	59.8	Low	236 Å²	236	121.5 Å²	121.5	100%	1.093	65%	0.651	S	S	*	*			trans	-57.8	0	176.8	-79.6	-77.1	0	0	0	112.4

Retrieved 192 of 192 residues in 59.4 ms (Link to these results)

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