A0A087YRC7_POEFO Loading...

5-hydroxytryptamine receptor 1B

AlphaFold DB , UniProt , Accession A0A087YRC7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 383 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	R	31.4	Very low	29.7	Very low	290 Å²	290	142.2 Å²	142.2	100%	1.094	83%	0.828	S	S	*	*				0	80.7	0	-168.4	178.9	-168.1	164.6	3.1	105.4
2	E	28.9	Very low	31.3	Very low	198 Å²	198	134.3 Å²	134.3	93%	0.925	78%	0.779	S	S	*	*			trans	-109	120.2	176.2	-76.5	177.8	152	0	0	105.9
3	E	30.6	Very low	31.9	Very low	184 Å²	184	128 Å²	128	86%	0.86	74%	0.735	S	S	*	*			trans	-81.2	124.2	179.6	-70.2	-172.4	155.7	0	0	109.2	G5	E3-G5 PolarHBondContact O-N 3.05Å
4	G	27.1	Very low	32	Very low	80 Å²	80	122.1 Å²	122.1	83%	0.825	72%	0.716	S	S	*	*			trans	-75	118.3	173.6	0	0	0	0	0	111	G6	G4-G6 PolarHBondContact O-N 3.46Å
5	G	25.1	Very low	32.1	Very low	82 Å²	82	118.2 Å²	118.2	85%	0.845	71%	0.712	S	S	*	*			trans	-75.2	101.8	166.8	0	0	0	0	0	110.1	E3 M7	E3-G5 PolarHBondContact O-N 3.05Å; G5-M7 PolarHBondContact O-N 3.27Å
6	G	24.8	Very low	32.6	Very low	74 Å²	74	117 Å²	117	76%	0.763	70%	0.7	S	S	*	*			trans	-66.7	118.1	167.4	0	0	0	0	0	110.1	G4 E8	G4-G6 PolarHBondContact O-N 3.46Å; G6-E8 PolarHBondContact O-N 3.32Å
7	M	26.2	Very low	32.9	Very low	192 Å²	192	118.4 Å²	118.4	95%	0.946	70%	0.702	S	S	*	*			trans	-74.4	101.6	173.3	-163.2	93.6	158.6	0	0	108.3	G5 S9	G5-M7 PolarHBondContact O-N 3.27Å; M7-S9 PolarHBondContact O-N 3.35Å
8	E	29.6	Very low	32.8	Very low	186 Å²	186	119.1 Å²	119.1	87%	0.869	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65	125.7	170.9	-76.4	-173	132.4	0	0	110.1	G6	G6-E8 PolarHBondContact O-N 3.32Å
9	S	31.4	Very low	33.1	Very low	101 Å²	101	123.2 Å²	123.2	71%	0.706	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-75.9	120.5	176.9	-155.5	0	0	0	0	109.8	M7	M7-S9 PolarHBondContact O-N 3.35Å
10	P	34.7	Very low	33.4	Very low	104 Å²	104	121.8 Å²	121.8	68%	0.675	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-73.7	140.7	179.2	24.1	-23.1	0	0	0	110.6	I12	P10-I12 VanDerWaalsContact O-CG1 3.22Å; P10-I12 WeakPolarHBondContact O-CG1 3.14Å; P10-I12 PolarHBondContact O-N 3.33Å
11	A	36.8	Very low	33.3	Very low	73 Å²	73	122 Å²	122	60%	0.603	71%	0.711	S	S	*	*			trans	-60.1	98.4	-179.9	0	0	0	0	0	112	Y13 G14	A11-Y13 VanDerWaalsContact C-N 3.25Å; A11-Y13 PolarHBondContact O-N 3.01Å; A11-G14 PolarHBondContact O-N 3.28Å
12	I	49.3	Very low	33.7	Very low	47 Å²	47	115.8 Å²	115.8	24%	0.241	70%	0.7	C	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-21.2	-170.1	-62.6	-157.6	0	0	0	114.1	P10 P339	P10-I12 VanDerWaalsContact O-CG1 3.22Å; P10-I12 WeakPolarHBondContact O-CG1 3.14Å; P10-I12 PolarHBondContact O-N 3.33Å; I12-P339 HydrophobicContact CD1-CB 4.06Å; I12-P339 HydrophobicContact CD1-CG 4.4Å
13	Y	38.7	Very low	34	Very low	53 Å²	53	113.8 Å²	113.8	21%	0.208	70%	0.696	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-12.2	-177.5	-74.1	-80.3	0	0	0	115.4	A11 G15 L44 D343	A11-Y13 VanDerWaalsContact C-N 3.25Å; A11-Y13 PolarHBondContact O-N 3.01Å; Y13-G15 PolarHBondContact O-N 2.93Å; Y13-L44 HydrophobicContact CD2-CD2 4.25Å; Y13-L44 HydrophobicContact CE1-CD2 4.3Å; Y13-L44 HydrophobicContact CE2-CD2 4Å; Y13-L44 HydrophobicContact CG-CD2 4.5Å; Y13-D343 WeakPolarHBondContact OH-CB 3.43Å; Y13-D343 PolarHBondContact OH-OD2 2.65Å
14	G	33.6	Very low	34.3	Very low	45 Å²	45	109.9 Å²	109.9	46%	0.464	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	-26.9	177.7	0	0	0	0	0	113.5	A11	A11-G14 PolarHBondContact O-N 3.28Å
15	G	33.6	Very low	35	Very low	64 Å²	64	113.4 Å²	113.4	66%	0.66	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-19.8	-177.6	0	0	0	0	0	115.4	Y13	Y13-G15 PolarHBondContact O-N 2.93Å
16	L	40.3	Very low	35.5	Very low	99 Å²	99	116.3 Å²	116.3	52%	0.518	69%	0.69	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.5	-17.7	-174.6	-95.1	150.2	0	0	0	114
17	L	37.9	Very low	36.3	Very low	140 Å²	140	118.8 Å²	118.8	73%	0.733	70%	0.696	S	S	*	*	S	Bend	trans	-103	-7.8	179.7	-70.4	172.5	0	0	0	114.2	F19	L17-F19 PolarHBondContact O-N 3.37Å
18	N	30.9	Very low	36.7	Very low	131 Å²	131	112.6 Å²	112.6	70%	0.701	68%	0.681	S	S	*	*			trans	-100.1	66	176.3	-84.9	1.6	0	0	0	111
19	F	37.7	Very low	37.1	Very low	197 Å²	197	108.4 Å²	108.4	86%	0.864	67%	0.672	S	S	*	*			trans	-99.9	106.7	157.4	-168.9	-99.3	0	0	0	108.4	L17	L17-F19 PolarHBondContact O-N 3.37Å
20	S	39.6	Very low	37.6	Very low	96 Å²	96	107.4 Å²	107.4	67%	0.671	68%	0.678	S	S	*	*	S	Bend	trans	97	83	176.7	-43.2	0	0	0	0	115.7
21	T	32.1	Very low	38	Very low	125 Å²	125	106.3 Å²	106.3	77%	0.767	68%	0.678	S	S	*	*			trans	-155.7	111.4	131.2	28	0	0	0	0	108	D23	T21-D23 PolarHBondContact O-N 3.46Å
22	N	38.7	Very low	38.3	Very low	161 Å²	161	110.3 Å²	110.3	86%	0.861	68%	0.684	S	S	*	*			trans	-62.1	121.2	153.3	-92.2	-9.2	0	0	0	106
23	D	35.2	Very low	38.1	Very low	155 Å²	155	118.3 Å²	118.3	83%	0.829	71%	0.711	S	S	*	*			trans	-159.4	137.2	140.2	-104.3	-26.4	0	0	0	112.6	T21	T21-D23 PolarHBondContact O-N 3.46Å
24	S	37.3	Very low	38.3	Very low	102 Å²	102	126.1 Å²	126.1	71%	0.713	74%	0.74	S	S	*	*			trans	-63.6	145.4	178.5	26.9	0	0	0	0	113.9
25	D	42.1	Very low	39	Very low	154 Å²	154	126.5 Å²	126.5	82%	0.824	74%	0.744	S	S	*	*			trans	14.1	123.4	158.6	-69.2	-30	0	0	0	119.5
26	T	34.5	Very low	40	Very low	143 Å²	143	127.1 Å²	127.1	88%	0.877	74%	0.738	S	S	*	*				-164.6	137	123	10.6	0	0	0	0	112.7
27	S	42.7	Very low	41.1	Very low	126 Å²	126	124.4 Å²	124.4	88%	0.881	73%	0.728	S	S	*	*			trans	-61.9	122.3	173.6	37.2	0	0	0	0	113.2
28	G	34.3	Very low	43	Very low	62 Å²	62	123.3 Å²	123.3	64%	0.639	72%	0.722	S	S	*	*			trans	-162.6	111.8	173.8	0	0	0	0	0	113.2
29	S	37.3	Very low	45.6	Very low	98 Å²	98	120.2 Å²	120.2	69%	0.685	72%	0.715	S	S	*	*			trans	27	120.5	156.5	51.1	0	0	0	0	121.2	A31	S29-A31 PolarHBondContact O-N 3.31Å
30	G	43.4	Very low	48	Very low	80 Å²	80	112.6 Å²	112.6	83%	0.825	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	26.3	176.6	0	0	0	0	0	118.5
31	A	42	Very low	50.3	Low	81 Å²	81	111.7 Å²	111.7	67%	0.669	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-24	172	0	0	0	0	0	113.1	S29	S29-A31 PolarHBondContact O-N 3.31Å
32	E	42.3	Very low	53.2	Low	157 Å²	157	108 Å²	108	73%	0.734	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-14.9	-177.1	-69.8	-172.6	148.8	0	0	114.7	R34 S36	E32-R34 VanDerWaalsContact C-N 3.32Å; E32-R34 PolarHBondContact O-N 3.43Å; E32-S36 PolarHBondContact O-OG 3.22Å
33	R	45.3	Very low	55.8	Low	216 Å²	216	103 Å²	103	82%	0.815	63%	0.633	S	S	*	*	H	α-helix	trans	-73.5	-17.2	177.7	-80	-173.1	-172.2	-165.7	1.7	114.6	S36 S37	R33-S36 WeakPolarHBondContact CA-OG 3.36Å; R33-S36 PolarHBondContact O-OG 3.45Å; R33-S37 PolarHBondContact O-OG 2.98Å
34	R	44.2	Very low	58.6	Low	216 Å²	216	97.4 Å²	97.4	82%	0.815	60%	0.603	S	S	*	*	H	α-helix	trans	-88	-26.3	-177.7	-142.4	170.5	-170.6	175	2.5	113.1	E32 S37	E32-R34 VanDerWaalsContact C-N 3.32Å; E32-R34 PolarHBondContact O-N 3.43Å; R34-S37 PolarHBondContact O-OG 3.4Å
35	G	47.1	Very low	61.4	Low	53 Å²	53	94.5 Å²	94.5	55%	0.546	59%	0.585	S	S	.	*	H	α-helix	trans	-80	-28.8	174.8	0	0	0	0	0	113.9
36	S	54.9	Low	63.9	Low	77 Å²	77	91.4 Å²	91.4	54%	0.538	57%	0.572	S	S	.	*	H	α-helix	trans	-78.3	-20.8	-177.4	33.3	0	0	0	0	114.2	E32 R33 P40	E32-S36 PolarHBondContact O-OG 3.22Å; R33-S36 WeakPolarHBondContact CA-OG 3.36Å; R33-S36 PolarHBondContact O-OG 3.45Å; S36-P40 WeakPolarHBondContact O-CD 3.17Å; S36-P40 WeakPolarHBondContact O-CG 3.38Å
37	S	63.1	Low	66.9	Low	43 Å²	43	88.1 Å²	88.1	30%	0.301	55%	0.551	S	S	.	*	H	α-helix	trans	-87.8	-26.5	175.8	45.3	0	0	0	0	113.8	R33 R34 P40 Q41	R33-S37 PolarHBondContact O-OG 2.98Å; R34-S37 PolarHBondContact O-OG 3.4Å; S37-P40 WeakPolarHBondContact O-CD 3.47Å; S37-P40 WeakPolarHBondContact O-CG 3.38Å; S37-Q41 VanDerWaalsContact O-CG 3.29Å; S37-Q41 WeakPolarHBondContact O-CG 3.41Å; S37-Q41 PolarHBondContact O-N 3.31Å; S37-Q41 PolarHBondContact O-OE1 2.82Å
38	L	79.2	Confident	69.5	Low	117 Å²	117	82.5 Å²	82.5	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-74.9	-37.9	-178.2	-167.8	67.2	0	0	0	112.7	Q41 A42	L38-Q41 PolarHBondContact O-N 3.45Å; L38-A42 WeakPolarHBondContact O-CB 3.38Å; L38-A42 PolarHBondContact O-N 3.19Å
39	A	85.5	Confident	72.5	Confident	65 Å²	65	81 Å²	81	54%	0.537	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-50.3	178.3	0	0	0	0	0	113.9	A42 A43	A39-A42 PolarHBondContact O-N 3.05Å; A39-A43 WeakPolarHBondContact O-CB 3.45Å; A39-A43 PolarHBondContact O-N 3.46Å
40	P	87.9	Confident	75.4	Confident	38 Å²	38	81.8 Å²	81.8	25%	0.247	49%	0.492	C	S	.	.	H	α-helix	trans	-67.4	-35.3	177.2	25.4	-33.9	0	0	0	112.5	S36 S37 A43 L44	S36-P40 WeakPolarHBondContact O-CD 3.17Å; S36-P40 WeakPolarHBondContact O-CG 3.38Å; S37-P40 WeakPolarHBondContact O-CD 3.47Å; S37-P40 WeakPolarHBondContact O-CG 3.38Å; P40-A43 PolarHBondContact O-N 3.36Å; P40-L44 WeakPolarHBondContact O-CB 3.48Å; P40-L44 PolarHBondContact O-N 2.76Å
41	Q	88.4	Confident	77.9	Confident	76 Å²	76	79.9 Å²	79.9	36%	0.355	46%	0.462	S	S	.	.	H	α-helix	trans	-65.3	-43.6	174.4	-74.8	177.6	-23.3	0	0	112.1	S37 L38 L44 A45	S37-Q41 VanDerWaalsContact O-CG 3.29Å; S37-Q41 WeakPolarHBondContact O-CG 3.41Å; S37-Q41 PolarHBondContact O-N 3.31Å; S37-Q41 PolarHBondContact O-OE1 2.82Å; L38-Q41 PolarHBondContact O-N 3.45Å; Q41-L44 PolarHBondContact O-N 3.22Å; Q41-A45 WeakPolarHBondContact O-CB 3.43Å; Q41-A45 PolarHBondContact O-N 3.46Å
42	A	92.3	Very high	80.6	Confident	48 Å²	48	76.6 Å²	76.6	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-64.5	-42.9	175	0	0	0	0	0	111.4	L38 A39 L44 A45 V46	L38-A42 WeakPolarHBondContact O-CB 3.38Å; L38-A42 PolarHBondContact O-N 3.19Å; A39-A42 PolarHBondContact O-N 3.05Å; A42-L44 VanDerWaalsContact C-N 3.34Å; A42-L44 PolarHBondContact O-N 3.1Å; A42-A45 PolarHBondContact O-N 2.87Å; A42-V46 WeakPolarHBondContact O-CB 3.38Å; A42-V46 VanDerWaalsContact O-CG2 3.26Å; A42-V46 WeakPolarHBondContact O-CG2 3.33Å; A42-V46 PolarHBondContact O-N 2.96Å
43	A	93.8	Very high	83.2	Confident	55 Å²	55	72.6 Å²	72.6	46%	0.455	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-41.8	175.6	0	0	0	0	0	111.9	A39 P40 T47	A39-A43 WeakPolarHBondContact O-CB 3.45Å; A39-A43 PolarHBondContact O-N 3.46Å; P40-A43 PolarHBondContact O-N 3.36Å; A43-T47 WeakPolarHBondContact O-CB 3.42Å; A43-T47 PolarHBondContact O-N 2.71Å; A43-T47 PolarHBondContact O-OG1 3.29Å
44	L	93.1	Very high	85.7	Confident	39 Å²	39	64.2 Å²	64.2	20%	0.204	40%	0.4	C	S	.	.	H	α-helix	trans	-62.3	-50.6	174.2	-178	62.7	0	0	0	110.8	Y13 P40 Q41 A42 V46 T47 L48 T102 V103	Y13-L44 HydrophobicContact CD2-CD2 4.25Å; Y13-L44 HydrophobicContact CE1-CD2 4.3Å; Y13-L44 HydrophobicContact CE2-CD2 4Å; Y13-L44 HydrophobicContact CG-CD2 4.5Å; P40-L44 WeakPolarHBondContact O-CB 3.48Å; P40-L44 PolarHBondContact O-N 2.76Å; Q41-L44 PolarHBondContact O-N 3.22Å; A42-L44 VanDerWaalsContact C-N 3.34Å; A42-L44 PolarHBondContact O-N 3.1Å; L44-V46 VanDerWaalsContact C-N 3.32Å; L44-V46 PolarHBondContact O-N 2.94Å; L44-T47 PolarHBondContact O-N 2.89Å; L44-T47 VanDerWaalsContact O-N 3.1Å; L44-L48 HydrophobicContact CD1-CD1 4.01Å; L44-L48 HydrophobicContact CD1-CD2 4.35Å; L44-L48 HydrophobicContact CD1-CG 4.02Å; L44-L48 HydrophobicContact CG-CD1 3.97Å; L44-L48 HydrophobicContact CG-CG 4.31Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.48Å; L44-L48 PolarHBondContact O-N 3.33Å; L44-T102 HydrophobicContact CD2-CG2 4.24Å; L44-V103 HydrophobicContact CD2-CG2 4.48Å; L44-V103 HydrophobicContact CG-CG2 4.41Å
45	A	95.3	Very high	88.3	Confident	40 Å²	40	54 Å²	54	33%	0.331	36%	0.361	S	S	.	.	H	α-helix	trans	-56.9	-44.9	178.2	0	0	0	0	0	112.2	Q41 A42 G49 V103	Q41-A45 WeakPolarHBondContact O-CB 3.43Å; Q41-A45 PolarHBondContact O-N 3.46Å; A42-A45 PolarHBondContact O-N 2.87Å; A45-G49 PolarHBondContact O-N 3.06Å; A45-V103 HydrophobicContact CB-CG1 4.31Å; A45-V103 HydrophobicContact CB-CG2 3.78Å
46	V	96.3	Very high	90.7	Very high	90 Å²	90	53.3 Å²	53.3	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-45.5	175.6	169.5	0	0	0	0	110.7	A42 L44 G49 L50	A42-V46 WeakPolarHBondContact O-CB 3.38Å; A42-V46 VanDerWaalsContact O-CG2 3.26Å; A42-V46 WeakPolarHBondContact O-CG2 3.33Å; A42-V46 PolarHBondContact O-N 2.96Å; L44-V46 VanDerWaalsContact C-N 3.32Å; L44-V46 PolarHBondContact O-N 2.94Å; V46-G49 PolarHBondContact O-N 3.43Å; V46-L50 HydrophobicContact CG1-CD1 3.95Å; V46-L50 HydrophobicContact CG1-CG 4.34Å; V46-L50 WeakPolarHBondContact O-CB 3.33Å; V46-L50 VanDerWaalsContact O-CG 3.25Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 2.95Å
47	T	96.3	Very high	92.7	Very high	73 Å²	73	55.7 Å²	55.7	45%	0.448	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-49.9	-179.9	-58.8	0	0	0	0	111.4	A43 L44 G49 L50 I51	A43-T47 WeakPolarHBondContact O-CB 3.42Å; A43-T47 PolarHBondContact O-N 2.71Å; A43-T47 PolarHBondContact O-OG1 3.29Å; L44-T47 PolarHBondContact O-N 2.89Å; L44-T47 VanDerWaalsContact O-N 3.1Å; T47-G49 VanDerWaalsContact C-N 3.33Å; T47-G49 PolarHBondContact O-N 2.96Å; T47-L50 PolarHBondContact O-N 3.3Å; T47-I51 HydrophobicContact CG2-CD1 4.09Å; T47-I51 WeakPolarHBondContact O-CG1 3.27Å; T47-I51 PolarHBondContact O-N 3.39Å
48	L	96.9	Very high	94.2	Very high	9 Å²	9	54.8 Å²	54.8	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-64.3	-38.6	178.5	-62	-177.3	0	0	0	111.7	L44 I51 T52 A99 T102 V103 W347	L44-L48 HydrophobicContact CD1-CD1 4.01Å; L44-L48 HydrophobicContact CD1-CD2 4.35Å; L44-L48 HydrophobicContact CD1-CG 4.02Å; L44-L48 HydrophobicContact CG-CD1 3.97Å; L44-L48 HydrophobicContact CG-CG 4.31Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.48Å; L44-L48 PolarHBondContact O-N 3.33Å; L48-I51 PolarHBondContact O-N 3.32Å; L48-T52 WeakPolarHBondContact O-CB 3.42Å; L48-T52 PolarHBondContact O-N 3.49Å; L48-T52 PolarHBondContact O-OG1 3.13Å; L48-A99 HydrophobicContact CB-CB 3.99Å; L48-A99 HydrophobicContact CD1-CB 4.23Å; L48-T102 HydrophobicContact CD1-CG2 4.01Å; L48-V103 HydrophobicContact CD1-CG2 4.48Å; L48-W347 HydrophobicContact CB-CH2 3.82Å; L48-W347 HydrophobicContact CB-CZ2 3.99Å; L48-W347 HydrophobicContact CB-CZ3 4.27Å; L48-W347 HydrophobicContact CD1-CH2 4.36Å; L48-W347 HydrophobicContact CD1-CZ2 3.67Å; L48-W347 HydrophobicContact CD2-CD2 3.48Å; L48-W347 VanDerWaalsContact CD2-CD2 3.48Å; L48-W347 HydrophobicContact CD2-CE3 3.67Å; L48-W347 HydrophobicContact CD2-CG 4.04Å; L48-W347 HydrophobicContact CD2-CH2 3.98Å; L48-W347 HydrophobicContact CD2-CZ2 3.82Å; L48-W347 HydrophobicContact CD2-CZ3 3.89Å; L48-W347 HydrophobicContact CG-CH2 4.25Å; L48-W347 HydrophobicContact CG-CZ2 4.01Å
49	G	97.6	Very high	95.1	Very high	29 Å²	29	49.2 Å²	49.2	30%	0.299	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-43.7	173.4	0	0	0	0	0	112.6	A45 V46 T47 T52 C53	A45-G49 PolarHBondContact O-N 3.06Å; V46-G49 PolarHBondContact O-N 3.43Å; T47-G49 VanDerWaalsContact C-N 3.33Å; T47-G49 PolarHBondContact O-N 2.96Å; G49-T52 PolarHBondContact O-N 2.97Å; G49-C53 WeakPolarHBondContact O-CB 3.39Å; G49-C53 PolarHBondContact O-N 3.07Å; G49-C53 PolarHBondContact O-SG 2.84Å; G49-C53 VanDerWaalsContact O-SG 3.34Å
50	L	97.8	Very high	95.6	Very high	116 Å²	116	48 Å²	48	61%	0.607	31%	0.307	S	S	*	.	H	α-helix	trans	-63.9	-43.7	176.1	-73.5	173.2	0	0	0	112	V46 T47 T52 C53 A54	V46-L50 HydrophobicContact CG1-CD1 3.95Å; V46-L50 HydrophobicContact CG1-CG 4.34Å; V46-L50 WeakPolarHBondContact O-CB 3.33Å; V46-L50 VanDerWaalsContact O-CG 3.25Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 2.95Å; T47-L50 PolarHBondContact O-N 3.3Å; L50-T52 VanDerWaalsContact C-N 3.31Å; L50-T52 PolarHBondContact O-N 2.95Å; L50-C53 PolarHBondContact O-N 3.37Å; L50-A54 VanDerWaalsContact O-CB 3.3Å; L50-A54 WeakPolarHBondContact O-CB 3.17Å; L50-A54 PolarHBondContact O-N 3.04Å
51	I	97.4	Very high	95.9	Very high	39 Å²	39	47.6 Å²	47.6	20%	0.2	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-44.5	175.5	-67	166.9	0	0	0	110.1	T47 L48 A54 T55 M95 W347 L351 L354	T47-I51 HydrophobicContact CG2-CD1 4.09Å; T47-I51 WeakPolarHBondContact O-CG1 3.27Å; T47-I51 PolarHBondContact O-N 3.39Å; L48-I51 PolarHBondContact O-N 3.32Å; I51-A54 PolarHBondContact O-N 3.18Å; I51-T55 WeakPolarHBondContact O-CB 3.43Å; I51-T55 PolarHBondContact O-N 2.93Å; I51-T55 PolarHBondContact O-OG1 3.35Å; I51-M95 HydrophobicContact CG2-CE 3.78Å; I51-W347 HydrophobicContact CG2-CZ3 4.49Å; I51-L351 HydrophobicContact CD1-CD2 4.41Å; I51-L351 HydrophobicContact CG2-CD2 3.7Å; I51-L354 HydrophobicContact CG2-CD2 4.41Å
52	T	98.1	Very high	96.2	Very high	12 Å²	12	44 Å²	44	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-49.5	177.9	-57.1	0	0	0	0	111.6	L48 G49 L50 A54 T55 T56 S91 M95 P96	L48-T52 WeakPolarHBondContact O-CB 3.42Å; L48-T52 PolarHBondContact O-N 3.49Å; L48-T52 PolarHBondContact O-OG1 3.13Å; G49-T52 PolarHBondContact O-N 2.97Å; L50-T52 VanDerWaalsContact C-N 3.31Å; L50-T52 PolarHBondContact O-N 2.95Å; T52-A54 PolarHBondContact O-N 3.17Å; T52-T55 WeakPolarHBondContact O-CB 3.48Å; T52-T55 PolarHBondContact O-N 3.02Å; T52-T56 PolarHBondContact O-N 3.16Å; T52-T56 PolarHBondContact O-OG1 2.92Å; T52-T56 VanDerWaalsContact O-OG1 3.11Å; T52-S91 WeakPolarHBondContact CG2-O 3.37Å; T52-M95 HydrophobicContact CG2-CB 3.89Å; T52-P96 HydrophobicContact CG2-CG 4.04Å
53	C	98	Very high	96.3	Very high	73 Å²	73	44 Å²	44	49%	0.493	28%	0.277	S	S	.	.	H	α-helix	trans	-60.6	-44.5	176.8	-73.9	0	0	0	0	112.3	G49 L50 T55 T56 L57	G49-C53 WeakPolarHBondContact O-CB 3.39Å; G49-C53 PolarHBondContact O-N 3.07Å; G49-C53 PolarHBondContact O-SG 2.84Å; G49-C53 VanDerWaalsContact O-SG 3.34Å; L50-C53 PolarHBondContact O-N 3.37Å; C53-T55 VanDerWaalsContact C-N 3.29Å; C53-T55 PolarHBondContact O-N 3.2Å; C53-T56 PolarHBondContact O-N 2.98Å; C53-L57 WeakPolarHBondContact O-CB 3.43Å; C53-L57 VanDerWaalsContact O-CG 3.27Å; C53-L57 WeakPolarHBondContact O-CG 3.36Å; C53-L57 PolarHBondContact O-N 3.22Å
54	A	97.3	Very high	96.3	Very high	41 Å²	41	43 Å²	43	34%	0.339	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-40.4	176.7	0	0	0	0	0	111.5	L50 I51 T52 S58 L354	L50-A54 VanDerWaalsContact O-CB 3.3Å; L50-A54 WeakPolarHBondContact O-CB 3.17Å; L50-A54 PolarHBondContact O-N 3.04Å; I51-A54 PolarHBondContact O-N 3.18Å; T52-A54 PolarHBondContact O-N 3.17Å; A54-S58 VanDerWaalsContact O-CB 3.22Å; A54-S58 WeakPolarHBondContact O-CB 3.24Å; A54-S58 PolarHBondContact O-N 3.01Å; A54-S58 PolarHBondContact O-OG 3.32Å; A54-L354 HydrophobicContact CB-CD1 3.89Å; A54-L354 HydrophobicContact CB-CD2 4.47Å
55	T	97.8	Very high	96.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.4	-46.2	177.5	-52.4	0	0	0	0	111	I51 T52 C53 S58 N59 M95	I51-T55 WeakPolarHBondContact O-CB 3.43Å; I51-T55 PolarHBondContact O-N 2.93Å; I51-T55 PolarHBondContact O-OG1 3.35Å; T52-T55 WeakPolarHBondContact O-CB 3.48Å; T52-T55 PolarHBondContact O-N 3.02Å; C53-T55 VanDerWaalsContact C-N 3.29Å; C53-T55 PolarHBondContact O-N 3.2Å; T55-S58 PolarHBondContact O-OG 3.47Å; T55-S58 VanDerWaalsContact O-OG 3.12Å; T55-N59 WeakPolarHBondContact O-CB 3.24Å; T55-N59 PolarHBondContact O-N 3.39Å; T55-N59 VanDerWaalsContact O-N 3.13Å; T55-N59 PolarHBondContact O-ND2 2.94Å; T55-M95 HydrophobicContact CG2-SD 4.12Å
56	T	98.1	Very high	96.1	Very high	39 Å²	39	40 Å²	40	24%	0.239	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-51.3	176.7	-59.6	0	0	0	0	111.6	T52 C53 S58 A60 L88 S91	T52-T56 PolarHBondContact O-N 3.16Å; T52-T56 PolarHBondContact O-OG1 2.92Å; T52-T56 VanDerWaalsContact O-OG1 3.11Å; C53-T56 PolarHBondContact O-N 2.98Å; T56-S58 PolarHBondContact O-N 2.59Å; T56-A60 WeakPolarHBondContact O-CB 3.32Å; T56-A60 PolarHBondContact O-N 3.16Å; T56-L88 HydrophobicContact CG2-CD1 3.72Å; T56-S91 WeakPolarHBondContact CA-OG 3.3Å; T56-S91 PolarHBondContact N-OG 2.88Å; T56-S91 VanDerWaalsContact OG1-CB 3.31Å; T56-S91 WeakPolarHBondContact OG1-CB 3.46Å; T56-S91 PolarHBondContact OG1-OG 3.24Å
57	L	96.4	Very high	96	Very high	127 Å²	127	44.7 Å²	44.7	67%	0.665	26%	0.257	S	S	*	.	H	α-helix	trans	-65.3	-41.8	-176.3	-69.5	172.5	0	0	0	112.3	C53 F61	C53-L57 WeakPolarHBondContact O-CB 3.43Å; C53-L57 VanDerWaalsContact O-CG 3.27Å; C53-L57 WeakPolarHBondContact O-CG 3.36Å; C53-L57 PolarHBondContact O-N 3.22Å; L57-F61 VanDerWaalsContact O-CB 3.29Å; L57-F61 WeakPolarHBondContact O-CB 3.29Å; L57-F61 PolarHBondContact O-N 2.97Å
58	S	95.4	Very high	95.7	Very high	24 Å²	24	48.5 Å²	48.5	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-42.5	-178.2	59.9	0	0	0	0	112.5	A54 T55 T56 F61 V62	A54-S58 VanDerWaalsContact O-CB 3.22Å; A54-S58 WeakPolarHBondContact O-CB 3.24Å; A54-S58 PolarHBondContact O-N 3.01Å; A54-S58 PolarHBondContact O-OG 3.32Å; T55-S58 PolarHBondContact O-OG 3.47Å; T55-S58 VanDerWaalsContact O-OG 3.12Å; T56-S58 PolarHBondContact O-N 2.59Å; S58-F61 WeakPolarHBondContact O-CB 3.2Å; S58-F61 PolarHBondContact O-N 3.35Å; S58-V62 WeakPolarHBondContact O-CG2 3.37Å; S58-V62 PolarHBondContact O-N 2.96Å; S58-V62 VanDerWaalsContact O-N 3.12Å
59	N	96.9	Very high	95.3	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.7	-41.4	175.8	-77.3	-67.8	0	0	0	112.3	T55 F61 V62 I63 A84 D87 L88 S353 P357	T55-N59 WeakPolarHBondContact O-CB 3.24Å; T55-N59 PolarHBondContact O-N 3.39Å; T55-N59 VanDerWaalsContact O-N 3.13Å; T55-N59 PolarHBondContact O-ND2 2.94Å; N59-F61 VanDerWaalsContact C-N 3.27Å; N59-F61 PolarHBondContact O-N 3.34Å; N59-V62 PolarHBondContact O-N 2.78Å; N59-V62 VanDerWaalsContact O-N 3.17Å; N59-I63 WeakPolarHBondContact O-CG1 3.32Å; N59-I63 PolarHBondContact O-N 2.8Å; N59-A84 WeakPolarHBondContact CB-O 3.42Å; N59-A84 WeakPolarHBondContact OD1-CA 3.27Å; N59-D87 WeakPolarHBondContact OD1-CB 3.41Å; N59-L88 HydrophobicContact CB-CB 4.03Å; N59-L88 HydrophobicContact CB-CD1 4.49Å; N59-S353 PolarHBondContact ND2-O 3Å; N59-P357 HydrophobicContact CB-CG 4.4Å; N59-P357 VanDerWaalsContact CG-CG 3.48Å; N59-P357 WeakPolarHBondContact OD1-CG 3.45Å
60	A	96.4	Very high	94.8	Very high	40 Å²	40	58.6 Å²	58.6	33%	0.331	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-40	173	0	0	0	0	0	111.8	T56 I63 A64	T56-A60 WeakPolarHBondContact O-CB 3.32Å; T56-A60 PolarHBondContact O-N 3.16Å; A60-I63 PolarHBondContact O-N 2.58Å; A60-A64 VanDerWaalsContact O-CB 3.23Å; A60-A64 WeakPolarHBondContact O-CB 3.29Å; A60-A64 PolarHBondContact O-N 3.41Å
61	F	94.1	Very high	94.3	Very high	30 Å²	30	61.6 Å²	61.6	13%	0.132	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-43.6	174.7	169.5	-100.3	0	0	0	112.6	L57 S58 N59 A64 T65 T361 A370 F371 L374	L57-F61 VanDerWaalsContact O-CB 3.29Å; L57-F61 WeakPolarHBondContact O-CB 3.29Å; L57-F61 PolarHBondContact O-N 2.97Å; S58-F61 WeakPolarHBondContact O-CB 3.2Å; S58-F61 PolarHBondContact O-N 3.35Å; N59-F61 VanDerWaalsContact C-N 3.27Å; N59-F61 PolarHBondContact O-N 3.34Å; F61-A64 PolarHBondContact O-N 3.46Å; F61-T65 WeakPolarHBondContact CE2-OG1 3.28Å; F61-T65 WeakPolarHBondContact CZ-OG1 3.17Å; F61-T65 VanDerWaalsContact O-CB 3.27Å; F61-T65 WeakPolarHBondContact O-CB 3.33Å; F61-T65 PolarHBondContact O-N 3.29Å; F61-T65 PolarHBondContact O-OG1 3.3Å; F61-T361 HydrophobicContact CD1-CG2 4.41Å; F61-T361 HydrophobicContact CE1-CG2 3.9Å; F61-A370 HydrophobicContact CZ-CB 4.47Å; F61-F371 HydrophobicContact CE1-CB 4.16Å; F61-F371 AromaticContact CE1-CD2 3.97Å; F61-F371 HydrophobicContact CE1-CD2 3.97Å; F61-F371 HydrophobicContact CE2-CD2 4.36Å; F61-F371 HydrophobicContact CZ-CB 3.72Å; F61-F371 AromaticContact CZ-CD2 3.88Å; F61-F371 HydrophobicContact CZ-CD2 3.88Å; F61-F371 HydrophobicContact CZ-CG 4.32Å; F61-L374 HydrophobicContact CD2-CD2 3.43Å; F61-L374 VanDerWaalsContact CD2-CD2 3.43Å; F61-L374 HydrophobicContact CE2-CB 4.32Å; F61-L374 HydrophobicContact CE2-CD2 3.48Å; F61-L374 VanDerWaalsContact CE2-CD2 3.48Å
62	V	94.5	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-49.6	176.8	171	0	0	0	0	110.6	S58 N59 A64 T65 I66 I80 A84 P357 F367	S58-V62 WeakPolarHBondContact O-CG2 3.37Å; S58-V62 PolarHBondContact O-N 2.96Å; S58-V62 VanDerWaalsContact O-N 3.12Å; N59-V62 PolarHBondContact O-N 2.78Å; N59-V62 VanDerWaalsContact O-N 3.17Å; V62-A64 PolarHBondContact O-N 3.02Å; V62-T65 PolarHBondContact O-N 2.82Å; V62-I66 HydrophobicContact CG1-CD1 3.95Å; V62-I66 WeakPolarHBondContact O-CG1 3.35Å; V62-I66 PolarHBondContact O-N 2.94Å; V62-I66 VanDerWaalsContact O-N 3.09Å; V62-I80 HydrophobicContact CG1-CG2 4.19Å; V62-A84 HydrophobicContact CB-CB 4.12Å; V62-A84 HydrophobicContact CG1-CB 3.82Å; V62-P357 HydrophobicContact CG2-CB 3.84Å; V62-P357 HydrophobicContact CG2-CG 4.29Å; V62-F367 HydrophobicContact CG1-CE1 4.06Å; V62-F367 HydrophobicContact CG1-CZ 4.44Å
63	I	95.8	Very high	93.7	Very high	48 Å²	48	62.4 Å²	62.4	25%	0.246	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-49.2	179.2	-63.3	167.1	0	0	0	110.5	N59 A60 T65 I66 Y67 A84 L85 L88	N59-I63 WeakPolarHBondContact O-CG1 3.32Å; N59-I63 PolarHBondContact O-N 2.8Å; A60-I63 PolarHBondContact O-N 2.58Å; I63-T65 VanDerWaalsContact C-N 3.33Å; I63-T65 PolarHBondContact O-N 3.31Å; I63-I66 PolarHBondContact O-N 2.94Å; I63-Y67 WeakPolarHBondContact O-CB 3.29Å; I63-Y67 PolarHBondContact O-N 3.4Å; I63-A84 HydrophobicContact CD1-CB 4.32Å; I63-A84 HydrophobicContact CG1-CB 3.82Å; I63-L85 HydrophobicContact CD1-CB 4.22Å; I63-L88 HydrophobicContact CD1-CD2 3.91Å
64	A	93.4	Very high	93.4	Very high	35 Å²	35	61.4 Å²	61.4	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-41.7	179.8	0	0	0	0	0	112.1	A60 F61 V62 Y67 Q68	A60-A64 VanDerWaalsContact O-CB 3.23Å; A60-A64 WeakPolarHBondContact O-CB 3.29Å; A60-A64 PolarHBondContact O-N 3.41Å; F61-A64 PolarHBondContact O-N 3.46Å; V62-A64 PolarHBondContact O-N 3.02Å; A64-Y67 PolarHBondContact O-N 2.89Å; A64-Q68 WeakPolarHBondContact O-CB 3.25Å; A64-Q68 VanDerWaalsContact O-CG 3.23Å; A64-Q68 WeakPolarHBondContact O-CG 3.26Å; A64-Q68 PolarHBondContact O-N 3.45Å
65	T	91.4	Very high	93.2	Very high	11 Å²	11	60.5 Å²	60.5	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-45	178.5	-64.6	0	0	0	0	111.6	F61 V62 I63 S69 L72 F367 A370	F61-T65 WeakPolarHBondContact CE2-OG1 3.28Å; F61-T65 WeakPolarHBondContact CZ-OG1 3.17Å; F61-T65 VanDerWaalsContact O-CB 3.27Å; F61-T65 WeakPolarHBondContact O-CB 3.33Å; F61-T65 PolarHBondContact O-N 3.29Å; F61-T65 PolarHBondContact O-OG1 3.3Å; V62-T65 PolarHBondContact O-N 2.82Å; I63-T65 VanDerWaalsContact C-N 3.33Å; I63-T65 PolarHBondContact O-N 3.31Å; T65-S69 VanDerWaalsContact O-CB 3.25Å; T65-S69 WeakPolarHBondContact O-CB 3.09Å; T65-S69 PolarHBondContact O-N 3.42Å; T65-S69 VanDerWaalsContact O-N 3.08Å; T65-L72 HydrophobicContact CG2-CD1 3.71Å; T65-F367 HydrophobicContact CG2-CD1 3.71Å; T65-F367 HydrophobicContact CG2-CE1 3.84Å; T65-A370 HydrophobicContact CG2-CB 3.52Å
66	I	93	Very high	92.9	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-65.4	-44	177.5	-64.6	165.9	0	0	0	110.1	V62 I63 H73 N77 I80 A81 F367	V62-I66 HydrophobicContact CG1-CD1 3.95Å; V62-I66 WeakPolarHBondContact O-CG1 3.35Å; V62-I66 PolarHBondContact O-N 2.94Å; V62-I66 VanDerWaalsContact O-N 3.09Å; I63-I66 PolarHBondContact O-N 2.94Å; I66-H73 PolarHBondContact O-CD2 3.48Å; I66-H73 PolarHBondContact O-NE2 3.23Å; I66-N77 HydrophobicContact CG2-CB 4.31Å; I66-I80 HydrophobicContact CD1-CG2 4.31Å; I66-A81 HydrophobicContact CD1-CB 3.81Å; I66-A81 HydrophobicContact CG2-CB 4.47Å; I66-F367 HydrophobicContact CD1-CE1 4.35Å; I66-F367 HydrophobicContact CD1-CZ 3.87Å; I66-F367 HydrophobicContact CG1-CE1 3.93Å; I66-F367 HydrophobicContact CG1-CZ 3.58Å
67	Y	93.1	Very high	92.7	Very high	189 Å²	189	60.3 Å²	60.3	74%	0.741	30%	0.297	S	S	*	.	H	α-helix	trans	-65.6	-44.7	-178.2	-173.7	-105.2	0	0	0	112.5	I63 A64 H73	I63-Y67 WeakPolarHBondContact O-CB 3.29Å; I63-Y67 PolarHBondContact O-N 3.4Å; A64-Y67 PolarHBondContact O-N 2.89Å; Y67-H73 PolarHBondContact O-NE2 3Å
68	Q	90.3	Very high	92.6	Very high	153 Å²	153	57.7 Å²	57.7	72%	0.715	28%	0.281	S	S	*	.	H	α-helix	trans	-74	-34.4	-177.2	-68.3	173.1	37.1	0	0	113	A64 R70	A64-Q68 WeakPolarHBondContact O-CB 3.25Å; A64-Q68 VanDerWaalsContact O-CG 3.23Å; A64-Q68 WeakPolarHBondContact O-CG 3.26Å; A64-Q68 PolarHBondContact O-N 3.45Å; Q68-R70 PolarHBondContact O-N 3.29Å
69	S	88.1	Confident	92.6	Very high	40 Å²	40	56.7 Å²	56.7	28%	0.28	27%	0.273	S	S	.	.			trans	-90.8	102.2	-177	-172.9	0	0	0	0	111.4	T65 K71 L72 H73	T65-S69 VanDerWaalsContact O-CB 3.25Å; T65-S69 WeakPolarHBondContact O-CB 3.09Å; T65-S69 PolarHBondContact O-N 3.42Å; T65-S69 VanDerWaalsContact O-N 3.08Å; S69-K71 PolarHBondContact O-N 3.47Å; S69-L72 WeakPolarHBondContact O-CA 3.27Å; S69-L72 WeakPolarHBondContact O-CB 3.35Å; S69-L72 PolarHBondContact O-N 2.82Å; S69-H73 PolarHBondContact O-CD2 2.86Å
70	R	87.9	Confident	92.5	Very high	209 Å²	209	57.9 Å²	57.9	79%	0.789	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-51.4	-31.7	171.9	-71	-80	-172.8	-178.4	2.2	113	Q68 L72 H73	Q68-R70 PolarHBondContact O-N 3.29Å; R70-L72 PolarHBondContact O-N 3.4Å; R70-H73 WeakPolarHBondContact O-CB 3.35Å; R70-H73 PolarHBondContact O-N 3.35Å
71	K	87.6	Confident	92.5	Very high	180 Å²	180	56.9 Å²	56.9	78%	0.783	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-63.6	-26	177.1	-63.4	-175.2	-179.9	-176.9	0	112.7	S69	S69-K71 PolarHBondContact O-N 3.47Å
72	L	88	Confident	92.7	Very high	4 Å²	4	56 Å²	56	2%	0.021	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-92.8	0.8	180	-64	179.4	0	0	0	113	T65 S69 R70 T74 N77 D366 F367	T65-L72 HydrophobicContact CG2-CD1 3.71Å; S69-L72 WeakPolarHBondContact O-CA 3.27Å; S69-L72 WeakPolarHBondContact O-CB 3.35Å; S69-L72 PolarHBondContact O-N 2.82Å; R70-L72 PolarHBondContact O-N 3.4Å; L72-T74 PolarHBondContact O-N 3.4Å; L72-N77 WeakPolarHBondContact CA-ND2 3.42Å; L72-N77 WeakPolarHBondContact O-CB 3.29Å; L72-N77 PolarHBondContact O-ND2 3Å; L72-D366 HydrophobicContact CD2-CB 3.8Å; L72-F367 HydrophobicContact CD1-CE2 4.45Å; L72-F367 HydrophobicContact CD1-CZ 4.33Å
73	H	93.4	Very high	92.8	Very high	64 Å²	64	56 Å²	56	30%	0.296	27%	0.268	S	S	.	.			trans	-75.7	70.7	177.6	-65.7	176.4	0	0	0	111.3	I66 Y67 S69 R70 F78	I66-H73 PolarHBondContact O-CD2 3.48Å; I66-H73 PolarHBondContact O-NE2 3.23Å; Y67-H73 PolarHBondContact O-NE2 3Å; S69-H73 PolarHBondContact O-CD2 2.86Å; R70-H73 WeakPolarHBondContact O-CB 3.35Å; R70-H73 PolarHBondContact O-N 3.35Å; H73-F78 HydrophobicContact CB-CZ 4.35Å
74	T	92.3	Very high	92.8	Very high	51 Å²	51	53.7 Å²	53.7	31%	0.313	26%	0.257	S	S	.	.	S	Bend	trans	-119.8	150.4	176	71.5	0	0	0	0	110.1	L72 A76 N77 F78	L72-T74 PolarHBondContact O-N 3.4Å; T74-A76 PolarHBondContact O-N 2.92Å; T74-A76 VanDerWaalsContact O-N 3.15Å; T74-N77 PolarHBondContact O-N 3.43Å; T74-N77 VanDerWaalsContact OG1-CG 3.3Å; T74-N77 PolarHBondContact OG1-N 2.87Å; T74-N77 PolarHBondContact OG1-ND2 3.26Å; T74-N77 VanDerWaalsContact OG1-ND2 3.17Å; T74-F78 PolarHBondContact O-N 3.41Å; T74-F78 VanDerWaalsContact O-N 3.1Å
75	P	93.3	Very high	93	Very high	23 Å²	23	55.6 Å²	55.6	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-54.8	-36.2	179.7	-28.4	36.4	0	0	0	113.6	N77 F78 L79 R153 A158	P75-N77 PolarHBondContact O-N 2.88Å; P75-F78 PolarHBondContact O-N 2.88Å; P75-L79 PolarHBondContact O-N 2.92Å; P75-R153 HydrophobicContact CB-CG 4.02Å; P75-R153 HydrophobicContact CG-CG 4.19Å; P75-A158 HydrophobicContact CB-CB 3.98Å
76	A	91.5	Very high	93.4	Very high	17 Å²	17	55 Å²	55	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-39.2	176.6	0	0	0	0	0	112.5	T74 F78 L79 I80	T74-A76 PolarHBondContact O-N 2.92Å; T74-A76 VanDerWaalsContact O-N 3.15Å; A76-F78 VanDerWaalsContact C-N 3.34Å; A76-L79 WeakPolarHBondContact O-CB 3.5Å; A76-L79 PolarHBondContact O-N 3.11Å; A76-I80 PolarHBondContact O-N 2.9Å
77	N	93.2	Very high	93.6	Very high	17 Å²	17	54.9 Å²	54.9	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-73.9	-25.7	177.7	-67.1	-19.3	0	0	0	112.1	I66 L72 T74 P75 L79 I80 A81	I66-N77 HydrophobicContact CG2-CB 4.31Å; L72-N77 WeakPolarHBondContact CA-ND2 3.42Å; L72-N77 WeakPolarHBondContact O-CB 3.29Å; L72-N77 PolarHBondContact O-ND2 3Å; T74-N77 PolarHBondContact O-N 3.43Å; T74-N77 VanDerWaalsContact OG1-CG 3.3Å; T74-N77 PolarHBondContact OG1-N 2.87Å; T74-N77 PolarHBondContact OG1-ND2 3.26Å; T74-N77 VanDerWaalsContact OG1-ND2 3.17Å; P75-N77 PolarHBondContact O-N 2.88Å; N77-L79 VanDerWaalsContact C-N 3.32Å; N77-I80 PolarHBondContact O-N 3.32Å; N77-A81 WeakPolarHBondContact O-CB 3.38Å; N77-A81 PolarHBondContact O-N 3.47Å
78	F	95.1	Very high	93.8	Very high	73 Å²	73	47 Å²	47	32%	0.32	23%	0.228	S	C	.	.	H	α-helix	trans	-66.2	-34.9	170.2	-63.8	-35.4	0	0	0	112.5	H73 T74 P75 A76 A81 S82 A155	H73-F78 HydrophobicContact CB-CZ 4.35Å; T74-F78 PolarHBondContact O-N 3.41Å; T74-F78 VanDerWaalsContact O-N 3.1Å; P75-F78 PolarHBondContact O-N 2.88Å; A76-F78 VanDerWaalsContact C-N 3.34Å; F78-A81 PolarHBondContact O-N 3.1Å; F78-S82 PolarHBondContact O-N 3.48Å; F78-A155 HydrophobicContact CD2-CB 4.27Å; F78-A155 HydrophobicContact CE2-CB 3.93Å
79	L	95.7	Very high	94.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-43.2	171.8	-56.7	179.5	0	0	0	111.2	P75 A76 N77 A81 S82 L83 V134 I135 D138 A158 I162	P75-L79 PolarHBondContact O-N 2.92Å; A76-L79 WeakPolarHBondContact O-CB 3.5Å; A76-L79 PolarHBondContact O-N 3.11Å; N77-L79 VanDerWaalsContact C-N 3.32Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-S82 PolarHBondContact O-N 3.44Å; L79-L83 PolarHBondContact O-N 3.48Å; L79-V134 HydrophobicContact CD1-CG1 3.85Å; L79-V134 HydrophobicContact CD2-CG1 3.56Å; L79-V134 HydrophobicContact CG-CG1 4.22Å; L79-I135 HydrophobicContact CB-CD1 4.45Å; L79-I135 HydrophobicContact CB-CG1 3.71Å; L79-I135 HydrophobicContact CD1-CG1 4.36Å; L79-D138 HydrophobicContact CD1-CB 3.74Å; L79-A158 HydrophobicContact CD2-CB 4.09Å; L79-I162 HydrophobicContact CD2-CD1 3.95Å; L79-I162 HydrophobicContact CD2-CG1 3.73Å
80	I	94.6	Very high	94.7	Very high	25 Å²	25	40.3 Å²	40.3	13%	0.128	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-41	174.9	-63	171.5	0	0	0	111	V62 I66 A76 N77 S82 L83 A84 I135 Y360	V62-I80 HydrophobicContact CG1-CG2 4.19Å; I66-I80 HydrophobicContact CD1-CG2 4.31Å; A76-I80 PolarHBondContact O-N 2.9Å; N77-I80 PolarHBondContact O-N 3.32Å; I80-S82 VanDerWaalsContact C-N 3.34Å; I80-S82 PolarHBondContact O-N 3.49Å; I80-L83 PolarHBondContact O-N 3.38Å; I80-A84 WeakPolarHBondContact O-CB 3.48Å; I80-A84 PolarHBondContact O-N 2.9Å; I80-I135 HydrophobicContact CG1-CD1 4.42Å; I80-Y360 HydrophobicContact CG1-CE1 4.4Å; I80-Y360 HydrophobicContact CG2-CD1 4.22Å; I80-Y360 HydrophobicContact CG2-CD2 3.89Å; I80-Y360 HydrophobicContact CG2-CE1 4.17Å; I80-Y360 HydrophobicContact CG2-CE2 3.83Å; I80-Y360 HydrophobicContact CG2-CG 4.13Å
81	A	96.1	Very high	95.2	Very high	19 Å²	19	30.4 Å²	30.4	16%	0.157	16%	0.156	C	C	.	.	H	α-helix	trans	-63.1	-40	177.1	0	0	0	0	0	112	I66 N77 F78 L79 A84 L85	I66-A81 HydrophobicContact CD1-CB 3.81Å; I66-A81 HydrophobicContact CG2-CB 4.47Å; N77-A81 WeakPolarHBondContact O-CB 3.38Å; N77-A81 PolarHBondContact O-N 3.47Å; F78-A81 PolarHBondContact O-N 3.1Å; L79-A81 VanDerWaalsContact C-N 3.35Å; A81-A84 PolarHBondContact O-N 3.49Å; A81-L85 WeakPolarHBondContact O-CB 3.38Å; A81-L85 PolarHBondContact O-N 2.92Å
82	S	97.7	Very high	95.6	Very high	11 Å²	11	26.1 Å²	26.1	8%	0.077	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-36.6	176.6	-166.1	0	0	0	0	112.4	F78 L79 I80 L85 T86 H131 I162	F78-S82 PolarHBondContact O-N 3.48Å; L79-S82 PolarHBondContact O-N 3.44Å; I80-S82 VanDerWaalsContact C-N 3.34Å; I80-S82 PolarHBondContact O-N 3.49Å; S82-L85 WeakPolarHBondContact O-CB 3.48Å; S82-L85 PolarHBondContact O-N 2.98Å; S82-T86 PolarHBondContact O-N 2.94Å; S82-T86 PolarHBondContact O-OG1 3.44Å; S82-H131 WeakPolarHBondContact CB-NE2 3.38Å; S82-H131 PolarHBondContact OG-CD2 3.43Å; S82-H131 PolarHBondContact OG-NE2 3.04Å; S82-I162 WeakPolarHBondContact OG-CG2 3.26Å
83	L	96.6	Very high	96.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-47.1	171.3	179.2	50.6	0	0	0	111.4	L79 I80 L85 T86 D87 S128 H131 L132 I135 Y360	L79-L83 PolarHBondContact O-N 3.48Å; I80-L83 PolarHBondContact O-N 3.38Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 3.4Å; L83-T86 WeakPolarHBondContact O-CA 3.17Å; L83-T86 VanDerWaalsContact O-CB 3.31Å; L83-T86 WeakPolarHBondContact O-CB 3.39Å; L83-T86 PolarHBondContact O-N 2.97Å; L83-D87 PolarHBondContact O-N 2.93Å; L83-S128 WeakPolarHBondContact CD1-OG 3.45Å; L83-H131 HydrophobicContact CB-CB 4.05Å; L83-H131 HydrophobicContact CD1-CB 4.09Å; L83-H131 HydrophobicContact CG-CB 4.48Å; L83-L132 HydrophobicContact CD2-CD2 3.49Å; L83-L132 VanDerWaalsContact CD2-CD2 3.49Å; L83-L132 HydrophobicContact CD2-CG 4.07Å; L83-I135 HydrophobicContact CB-CD1 4.44Å; L83-I135 HydrophobicContact CD2-CD1 3.74Å; L83-Y360 WeakPolarHBondContact CD2-OH 3.32Å
84	A	97.2	Very high	96.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-34.9	175.1	0	0	0	0	0	112.5	N59 V62 I63 I80 A81 L88	N59-A84 WeakPolarHBondContact CB-O 3.42Å; N59-A84 WeakPolarHBondContact OD1-CA 3.27Å; V62-A84 HydrophobicContact CB-CB 4.12Å; V62-A84 HydrophobicContact CG1-CB 3.82Å; I63-A84 HydrophobicContact CD1-CB 4.32Å; I63-A84 HydrophobicContact CG1-CB 3.82Å; I80-A84 WeakPolarHBondContact O-CB 3.48Å; I80-A84 PolarHBondContact O-N 2.9Å; A81-A84 PolarHBondContact O-N 3.49Å; A84-L88 VanDerWaalsContact O-CB 3.23Å; A84-L88 WeakPolarHBondContact O-CB 3.35Å; A84-L88 PolarHBondContact O-N 2.89Å
85	L	98.1	Very high	96.5	Very high	75 Å²	75	23.9 Å²	23.9	39%	0.393	13%	0.129	S	C	.	.	H	α-helix	trans	-64.2	-42.3	172.2	176.6	63.7	0	0	0	111.2	I63 A81 S82 L83 L88 L89	I63-L85 HydrophobicContact CD1-CB 4.22Å; A81-L85 WeakPolarHBondContact O-CB 3.38Å; A81-L85 PolarHBondContact O-N 2.92Å; S82-L85 WeakPolarHBondContact O-CB 3.48Å; S82-L85 PolarHBondContact O-N 2.98Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 3.4Å; L85-L88 WeakPolarHBondContact O-CB 3.42Å; L85-L88 PolarHBondContact O-N 3.47Å; L85-L89 HydrophobicContact CG-CD1 4.43Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.15Å; L85-L89 PolarHBondContact O-N 3.33Å
86	T	97.9	Very high	96.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-47.5	176.9	-52.6	0	0	0	0	110.9	S82 L83 L88 L89 V90 C124 A127 W166	S82-T86 PolarHBondContact O-N 2.94Å; S82-T86 PolarHBondContact O-OG1 3.44Å; L83-T86 WeakPolarHBondContact O-CA 3.17Å; L83-T86 VanDerWaalsContact O-CB 3.31Å; L83-T86 WeakPolarHBondContact O-CB 3.39Å; L83-T86 PolarHBondContact O-N 2.97Å; T86-L88 VanDerWaalsContact C-N 3.31Å; T86-L88 PolarHBondContact O-N 3.3Å; T86-L89 WeakPolarHBondContact O-CB 3.5Å; T86-L89 PolarHBondContact O-N 2.96Å; T86-L89 VanDerWaalsContact O-N 3.12Å; T86-V90 PolarHBondContact O-N 3.22Å; T86-C124 HydrophobicContact CG2-CB 4.28Å; T86-C124 WeakPolarHBondContact CG2-O 3.28Å; T86-A127 HydrophobicContact CG2-CB 3.69Å; T86-W166 HydrophobicContact CG2-CH2 4.14Å; T86-W166 HydrophobicContact CG2-CZ2 4.41Å; T86-W166 VanDerWaalsContact OG1-CZ2 3.3Å; T86-W166 WeakPolarHBondContact OG1-CZ2 3.4Å
87	D	97.8	Very high	96.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.7	-32	179	-68.2	-15.8	0	0	0	112.1	N59 L83 V90 S91 S128 S353 N356	N59-D87 WeakPolarHBondContact OD1-CB 3.41Å; L83-D87 PolarHBondContact O-N 2.93Å; D87-V90 WeakPolarHBondContact O-CB 3.45Å; D87-V90 PolarHBondContact O-N 2.98Å; D87-S91 PolarHBondContact O-N 3.25Å; D87-S128 PolarHBondContact OD1-OG 3.03Å; D87-S353 PolarHBondContact OD1-OG 3.46Å; D87-N356 PolarHBondContact OD2-ND2 3.34Å
88	L	98.1	Very high	97	Very high	25 Å²	25	26.1 Å²	26.1	13%	0.131	14%	0.14	C	C	.	.	H	α-helix	trans	-67.3	-38.2	170.7	-177.4	64.9	0	0	0	112.1	T56 N59 I63 A84 L85 T86 V90 S91 I92	T56-L88 HydrophobicContact CG2-CD1 3.72Å; N59-L88 HydrophobicContact CB-CB 4.03Å; N59-L88 HydrophobicContact CB-CD1 4.49Å; I63-L88 HydrophobicContact CD1-CD2 3.91Å; A84-L88 VanDerWaalsContact O-CB 3.23Å; A84-L88 WeakPolarHBondContact O-CB 3.35Å; A84-L88 PolarHBondContact O-N 2.89Å; L85-L88 WeakPolarHBondContact O-CB 3.42Å; L85-L88 PolarHBondContact O-N 3.47Å; T86-L88 VanDerWaalsContact C-N 3.31Å; T86-L88 PolarHBondContact O-N 3.3Å; L88-V90 VanDerWaalsContact C-N 3.33Å; L88-S91 PolarHBondContact O-N 2.96Å; L88-S91 PolarHBondContact O-OG 3.19Å; L88-S91 VanDerWaalsContact O-OG 3.05Å; L88-I92 HydrophobicContact CD1-CD1 3.91Å; L88-I92 HydrophobicContact CD1-CG1 4.4Å; L88-I92 HydrophobicContact CD2-CD1 4.48Å; L88-I92 HydrophobicContact CG-CD1 3.81Å; L88-I92 VanDerWaalsContact O-CG1 3.31Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.22Å; L88-I92 VanDerWaalsContact O-N 3.08Å
89	L	98.1	Very high	97.1	Very high	50 Å²	50	23.2 Å²	23.2	26%	0.262	13%	0.13	S	C	.	.	H	α-helix	trans	-65.9	-37.2	174.6	-70.2	169.7	0	0	0	111.2	L85 T86 S91 I92 L93 W166	L85-L89 HydrophobicContact CG-CD1 4.43Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.15Å; L85-L89 PolarHBondContact O-N 3.33Å; T86-L89 WeakPolarHBondContact O-CB 3.5Å; T86-L89 PolarHBondContact O-N 2.96Å; T86-L89 VanDerWaalsContact O-N 3.12Å; L89-S91 VanDerWaalsContact C-N 3.34Å; L89-S91 PolarHBondContact O-N 3.4Å; L89-I92 PolarHBondContact O-N 2.66Å; L89-L93 HydrophobicContact CB-CD1 4.4Å; L89-L93 HydrophobicContact CD2-CD1 3.99Å; L89-L93 VanDerWaalsContact O-CB 3.31Å; L89-L93 WeakPolarHBondContact O-CB 3.35Å; L89-L93 PolarHBondContact O-N 3.07Å; L89-W166 HydrophobicContact CD1-CH2 3.69Å; L89-W166 HydrophobicContact CD1-CZ2 4.22Å
90	V	98	Very high	97	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	15%	0.147	C	C	.	.	I	π-helix	trans	-57.4	-47.3	171	175.4	0	0	0	0	110.5	T86 D87 L88 I92 V94 M95 C124 Y350	T86-V90 PolarHBondContact O-N 3.22Å; D87-V90 WeakPolarHBondContact O-CB 3.45Å; D87-V90 PolarHBondContact O-N 2.98Å; L88-V90 VanDerWaalsContact C-N 3.33Å; V90-I92 VanDerWaalsContact C-N 3.3Å; V90-I92 PolarHBondContact O-N 3.45Å; V90-V94 HydrophobicContact CG1-CB 4.27Å; V90-V94 WeakPolarHBondContact O-CA 3.41Å; V90-V94 VanDerWaalsContact O-CB 3.29Å; V90-V94 WeakPolarHBondContact O-CB 3.3Å; V90-V94 PolarHBondContact O-N 2.87Å; V90-M95 HydrophobicContact CG1-CG 3.91Å; V90-M95 HydrophobicContact CG1-SD 4.13Å; V90-M95 PolarHBondContact O-N 2.82Å; V90-C124 HydrophobicContact CG2-CB 3.49Å; V90-C124 VanDerWaalsContact CG2-CB 3.49Å; V90-Y350 HydrophobicContact CG1-CD1 4.09Å
91	S	98.1	Very high	97	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.007	15%	0.147	C	C	.	.	I	π-helix	trans	-73	-19	-177.1	74	0	0	0	0	114.9	T52 T56 D87 L88 L89 M95 P96	T52-S91 WeakPolarHBondContact CG2-O 3.37Å; T56-S91 WeakPolarHBondContact CA-OG 3.3Å; T56-S91 PolarHBondContact N-OG 2.88Å; T56-S91 VanDerWaalsContact OG1-CB 3.31Å; T56-S91 WeakPolarHBondContact OG1-CB 3.46Å; T56-S91 PolarHBondContact OG1-OG 3.24Å; D87-S91 PolarHBondContact O-N 3.25Å; L88-S91 PolarHBondContact O-N 2.96Å; L88-S91 PolarHBondContact O-OG 3.19Å; L88-S91 VanDerWaalsContact O-OG 3.05Å; L89-S91 VanDerWaalsContact C-N 3.34Å; L89-S91 PolarHBondContact O-N 3.4Å; S91-M95 VanDerWaalsContact CA-SD 3.59Å; S91-P96 VanDerWaalsContact O-CD 3.27Å; S91-P96 WeakPolarHBondContact O-CD 3.47Å; S91-P96 WeakPolarHBondContact O-CG 3.45Å
92	I	97.9	Very high	96.8	Very high	91 Å²	91	25.9 Å²	25.9	47%	0.467	14%	0.14	S	C	.	.	I	π-helix	trans	-95.7	-45.4	178.6	-65.9	171.4	0	0	0	111.6	L88 L89 V90 P96	L88-I92 HydrophobicContact CD1-CD1 3.91Å; L88-I92 HydrophobicContact CD1-CG1 4.4Å; L88-I92 HydrophobicContact CD2-CD1 4.48Å; L88-I92 HydrophobicContact CG-CD1 3.81Å; L88-I92 VanDerWaalsContact O-CG1 3.31Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.22Å; L88-I92 VanDerWaalsContact O-N 3.08Å; L89-I92 PolarHBondContact O-N 2.66Å; V90-I92 VanDerWaalsContact C-N 3.3Å; V90-I92 PolarHBondContact O-N 3.45Å; I92-P96 WeakPolarHBondContact O-CG 3.33Å
93	L	96.7	Very high	96.5	Very high	72 Å²	72	26.8 Å²	26.8	38%	0.377	15%	0.145	S	C	.	.	I	π-helix	trans	-95.6	-28.9	-171.1	-56.8	179.3	0	0	0	113.1	L89 I97	L89-L93 HydrophobicContact CB-CD1 4.4Å; L89-L93 HydrophobicContact CD2-CD1 3.99Å; L89-L93 VanDerWaalsContact O-CB 3.31Å; L89-L93 WeakPolarHBondContact O-CB 3.35Å; L89-L93 PolarHBondContact O-N 3.07Å; L93-I97 WeakPolarHBondContact O-CD1 3.35Å
94	V	97.6	Very high	96.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	I	π-helix	trans	-108.3	-56.7	-169	-177.4	0	0	0	0	111.3	V90 I97 S98 W117 D121 Y350	V90-V94 HydrophobicContact CG1-CB 4.27Å; V90-V94 WeakPolarHBondContact O-CA 3.41Å; V90-V94 VanDerWaalsContact O-CB 3.29Å; V90-V94 WeakPolarHBondContact O-CB 3.3Å; V90-V94 PolarHBondContact O-N 2.87Å; V94-I97 PolarHBondContact O-N 2.85Å; V94-S98 WeakPolarHBondContact O-CB 3.5Å; V94-S98 PolarHBondContact O-N 3.37Å; V94-W117 PolarHBondContact O-NE1 2.84Å; V94-D121 HydrophobicContact CG1-CB 3.79Å; V94-D121 HydrophobicContact CG2-CB 4.09Å; V94-Y350 HydrophobicContact CG1-CE1 3.82Å; V94-Y350 HydrophobicContact CG1-CE2 4.37Å; V94-Y350 WeakPolarHBondContact CG1-OH 3.44Å
95	M	97.7	Very high	95.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-39.9	-171.9	-64.8	173.1	72.9	0	0	114.4	I51 T52 T55 V90 S91 S98 A99 W347 Y350	I51-M95 HydrophobicContact CG2-CE 3.78Å; T52-M95 HydrophobicContact CG2-CB 3.89Å; T55-M95 HydrophobicContact CG2-SD 4.12Å; V90-M95 HydrophobicContact CG1-CG 3.91Å; V90-M95 HydrophobicContact CG1-SD 4.13Å; V90-M95 PolarHBondContact O-N 2.82Å; S91-M95 VanDerWaalsContact CA-SD 3.59Å; M95-S98 PolarHBondContact O-N 2.86Å; M95-A99 VanDerWaalsContact O-CB 3.32Å; M95-A99 WeakPolarHBondContact O-CB 3.37Å; M95-A99 PolarHBondContact O-N 3.32Å; M95-W347 HydrophobicContact CB-CH2 4.22Å; M95-W347 HydrophobicContact CB-CZ3 4.47Å; M95-W347 HydrophobicContact CE-CE3 4.4Å; M95-W347 HydrophobicContact CE-CH2 4.42Å; M95-W347 HydrophobicContact CE-CZ3 3.61Å; M95-Y350 HydrophobicContact CG-CD2 4.2Å; M95-Y350 HydrophobicContact CG-CG 4.23Å
96	P	97.4	Very high	95.4	Very high	58 Å²	58	34.4 Å²	34.4	38%	0.377	19%	0.186	S	C	.	.	H	α-helix	trans	-65.4	-41.6	178.8	-21.3	33.7	0	0	0	112.3	T52 S91 I92 A99 L100	T52-P96 HydrophobicContact CG2-CG 4.04Å; S91-P96 VanDerWaalsContact O-CD 3.27Å; S91-P96 WeakPolarHBondContact O-CD 3.47Å; S91-P96 WeakPolarHBondContact O-CG 3.45Å; I92-P96 WeakPolarHBondContact O-CG 3.33Å; P96-A99 PolarHBondContact O-N 3.4Å; P96-L100 PolarHBondContact O-N 3.35Å
97	I	96.3	Very high	95	Very high	41 Å²	41	35 Å²	35	21%	0.21	19%	0.188	C	C	.	.	H	α-helix	trans	-68	-41.9	177.1	-59.3	-179.5	0	0	0	109.8	L93 V94 A99 L100 Y101 W107 L109 W117	L93-I97 WeakPolarHBondContact O-CD1 3.35Å; V94-I97 PolarHBondContact O-N 2.85Å; I97-A99 VanDerWaalsContact C-N 3.31Å; I97-A99 PolarHBondContact O-N 2.84Å; I97-L100 WeakPolarHBondContact O-CB 3.34Å; I97-L100 PolarHBondContact O-N 3.41Å; I97-Y101 PolarHBondContact O-N 3.31Å; I97-W107 HydrophobicContact CG2-CH2 3.6Å; I97-W107 HydrophobicContact CG2-CZ3 3.76Å; I97-L109 HydrophobicContact CG2-CD1 3.9Å; I97-W117 HydrophobicContact CB-CG 4.2Å; I97-W117 HydrophobicContact CD1-CB 4.31Å; I97-W117 HydrophobicContact CD1-CG 4.44Å; I97-W117 HydrophobicContact CG2-CB 4.19Å; I97-W117 HydrophobicContact CG2-CD2 4.07Å; I97-W117 HydrophobicContact CG2-CG 3.67Å
98	S	95.3	Very high	94.6	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-39.2	174.6	-165.4	0	0	0	0	111.8	V94 M95 Y101 T102 Y350	V94-S98 WeakPolarHBondContact O-CB 3.5Å; V94-S98 PolarHBondContact O-N 3.37Å; M95-S98 PolarHBondContact O-N 2.86Å; S98-Y101 PolarHBondContact O-N 3.23Å; S98-T102 WeakPolarHBondContact O-CB 3.27Å; S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 2.96Å; S98-Y350 WeakPolarHBondContact OG-CE2 3.49Å
99	A	96.2	Very high	94.2	Very high	13 Å²	13	40.7 Å²	40.7	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-43	177.7	0	0	0	0	0	111	L48 M95 P96 I97 Y101 T102 V103 W347	L48-A99 HydrophobicContact CB-CB 3.99Å; L48-A99 HydrophobicContact CD1-CB 4.23Å; M95-A99 VanDerWaalsContact O-CB 3.32Å; M95-A99 WeakPolarHBondContact O-CB 3.37Å; M95-A99 PolarHBondContact O-N 3.32Å; P96-A99 PolarHBondContact O-N 3.4Å; I97-A99 VanDerWaalsContact C-N 3.31Å; I97-A99 PolarHBondContact O-N 2.84Å; A99-Y101 PolarHBondContact O-N 3.24Å; A99-T102 PolarHBondContact O-N 2.88Å; A99-V103 WeakPolarHBondContact O-CB 3.37Å; A99-V103 VanDerWaalsContact O-CG2 3.23Å; A99-V103 WeakPolarHBondContact O-CG2 3.43Å; A99-V103 PolarHBondContact O-N 3.32Å; A99-W347 HydrophobicContact CB-CH2 3.94Å; A99-W347 HydrophobicContact CB-CZ2 3.77Å
100	L	94.7	Very high	93.8	Very high	69 Å²	69	39.9 Å²	39.9	36%	0.361	23%	0.227	S	C	.	.	H	α-helix	trans	-56.6	-50.7	172.9	-178.2	68.2	0	0	0	110.9	P96 I97 T102 V103 L104 P108 L109	P96-L100 PolarHBondContact O-N 3.35Å; I97-L100 WeakPolarHBondContact O-CB 3.34Å; I97-L100 PolarHBondContact O-N 3.41Å; L100-T102 PolarHBondContact O-N 3.37Å; L100-V103 PolarHBondContact O-N 2.95Å; L100-L104 HydrophobicContact CD1-CD1 3.47Å; L100-L104 VanDerWaalsContact CD1-CD1 3.47Å; L100-L104 HydrophobicContact CD1-CG 3.96Å; L100-L104 HydrophobicContact CG-CD1 3.83Å; L100-L104 HydrophobicContact CG-CG 4.42Å; L100-L104 WeakPolarHBondContact O-CB 3.44Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 2.85Å; L100-P108 HydrophobicContact CD2-CG 4.32Å; L100-L109 HydrophobicContact CD2-CD1 4.06Å; L100-L109 HydrophobicContact CD2-CD2 4.12Å; L100-L109 HydrophobicContact CD2-CG 4.21Å
101	Y	93.3	Very high	93.2	Very high	31 Å²	31	41.9 Å²	41.9	12%	0.122	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-41.7	-180	-175.9	-128.3	0	0	0	112.5	I97 S98 A99 V103 Q105 T106 W107 W117	I97-Y101 PolarHBondContact O-N 3.31Å; S98-Y101 PolarHBondContact O-N 3.23Å; A99-Y101 PolarHBondContact O-N 3.24Å; Y101-V103 VanDerWaalsContact C-N 3.33Å; Y101-V103 PolarHBondContact O-N 2.95Å; Y101-Q105 WeakPolarHBondContact O-CA 3.27Å; Y101-Q105 PolarHBondContact O-N 3.42Å; Y101-T106 WeakPolarHBondContact CD2-O 3.35Å; Y101-W107 HydrophobicContact CD2-CB 4.21Å; Y101-W107 AromaticContact CD2-CE3 3.82Å; Y101-W107 HydrophobicContact CD2-CE3 3.82Å; Y101-W107 HydrophobicContact CE2-CB 3.93Å; Y101-W107 HydrophobicContact CE2-CE3 4.33Å; Y101-W107 HydrophobicContact CG-CE3 4.05Å; Y101-W117 HydrophobicContact CD1-CH2 4.32Å
102	T	92.2	Very high	92.6	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-37.8	177.6	-50.6	0	0	0	0	111.4	L44 L48 S98 A99 L100 Q105 D343 W347	L44-T102 HydrophobicContact CD2-CG2 4.24Å; L48-T102 HydrophobicContact CD1-CG2 4.01Å; S98-T102 WeakPolarHBondContact O-CB 3.27Å; S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 2.96Å; A99-T102 PolarHBondContact O-N 2.88Å; L100-T102 PolarHBondContact O-N 3.37Å; T102-Q105 PolarHBondContact O-NE2 3.34Å; T102-D343 HydrophobicContact CG2-CB 4.16Å; T102-W347 PolarHBondContact OG1-NE1 3.4Å
103	V	92.4	Very high	92.2	Very high	29 Å²	29	46.2 Å²	46.2	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-79.7	-42.4	-178.6	173.5	0	0	0	0	111.6	L44 A45 L48 A99 L100 Y101	L44-V103 HydrophobicContact CD2-CG2 4.48Å; L44-V103 HydrophobicContact CG-CG2 4.41Å; A45-V103 HydrophobicContact CB-CG1 4.31Å; A45-V103 HydrophobicContact CB-CG2 3.78Å; L48-V103 HydrophobicContact CD1-CG2 4.48Å; A99-V103 WeakPolarHBondContact O-CB 3.37Å; A99-V103 VanDerWaalsContact O-CG2 3.23Å; A99-V103 WeakPolarHBondContact O-CG2 3.43Å; A99-V103 PolarHBondContact O-N 3.32Å; L100-V103 PolarHBondContact O-N 2.95Å; Y101-V103 VanDerWaalsContact C-N 3.33Å; Y101-V103 PolarHBondContact O-N 2.95Å
104	L	90.1	Very high	91.9	Very high	83 Å²	83	42.8 Å²	42.8	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-78.5	-20.4	-178.3	-67.6	-176	0	0	0	113.6	L100 T106 P108	L100-L104 HydrophobicContact CD1-CD1 3.47Å; L100-L104 VanDerWaalsContact CD1-CD1 3.47Å; L100-L104 HydrophobicContact CD1-CG 3.96Å; L100-L104 HydrophobicContact CG-CD1 3.83Å; L100-L104 HydrophobicContact CG-CG 4.42Å; L100-L104 WeakPolarHBondContact O-CB 3.44Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 2.85Å; L104-T106 PolarHBondContact O-N 2.98Å; L104-T106 PolarHBondContact O-OG1 3.48Å; L104-T106 VanDerWaalsContact O-OG1 3.13Å; L104-P108 HydrophobicContact CD1-CG 3.82Å
105	Q	87.4	Confident	91.3	Very high	72 Å²	72	44.4 Å²	44.4	34%	0.336	25%	0.252	S	S	.	.	S	Bend	trans	55.9	14.4	-177.6	-64.9	-73.5	-60.1	0	0	114	Y101 T102 D343	Y101-Q105 WeakPolarHBondContact O-CA 3.27Å; Y101-Q105 PolarHBondContact O-N 3.42Å; T102-Q105 PolarHBondContact O-NE2 3.34Å; Q105-D343 PolarHBondContact NE2-OD2 3.37Å
106	T	89.1	Confident	90.9	Very high	81 Å²	81	48.2 Å²	48.2	50%	0.497	27%	0.272	S	S	.	.	S	Bend	trans	-146.6	152.2	-179.8	51.3	0	0	0	0	107.9	Y101 L104 P108	Y101-T106 WeakPolarHBondContact CD2-O 3.35Å; L104-T106 PolarHBondContact O-N 2.98Å; L104-T106 PolarHBondContact O-OG1 3.48Å; L104-T106 VanDerWaalsContact O-OG1 3.13Å; T106-P108 WeakPolarHBondContact O-CD 3.28Å
107	W	89.9	Confident	90.7	Very high	12 Å²	12	46 Å²	46	5%	0.045	26%	0.256	C	S	.	.			trans	-97.8	106	-178.9	-178.2	-98.9	0	0	0	111.9	I97 Y101 L109 G110 M113 C114 W117 T188 C190	I97-W107 HydrophobicContact CG2-CH2 3.6Å; I97-W107 HydrophobicContact CG2-CZ3 3.76Å; Y101-W107 HydrophobicContact CD2-CB 4.21Å; Y101-W107 AromaticContact CD2-CE3 3.82Å; Y101-W107 HydrophobicContact CD2-CE3 3.82Å; Y101-W107 HydrophobicContact CE2-CB 3.93Å; Y101-W107 HydrophobicContact CE2-CE3 4.33Å; Y101-W107 HydrophobicContact CG-CE3 4.05Å; W107-L109 HydrophobicContact CH2-CB 4.41Å; W107-L109 HydrophobicContact CH2-CD1 4.02Å; W107-L109 HydrophobicContact CZ2-CB 3.69Å; W107-L109 HydrophobicContact CZ2-CD1 4.12Å; W107-L109 HydrophobicContact CZ2-CG 4.36Å; W107-G110 PolarHBondContact NE1-O 3.49Å; W107-M113 HydrophobicContact CZ2-CB 4.02Å; W107-C114 HydrophobicContact CZ2-CB 3.73Å; W107-C114 VanDerWaalsContact CZ2-N 3.3Å; W107-W117 HydrophobicContact CH2-CB 4.18Å; W107-W117 HydrophobicContact CH2-CD2 4.2Å; W107-W117 AromaticContact CH2-CE3 3.96Å; W107-W117 HydrophobicContact CH2-CE3 3.96Å; W107-W117 HydrophobicContact CH2-CG 4.31Å; W107-W117 HydrophobicContact CZ3-CD2 4.23Å; W107-W117 AromaticContact CZ3-CE3 3.85Å; W107-W117 HydrophobicContact CZ3-CE3 3.85Å; W107-W117 HydrophobicContact CZ3-CZ3 4.21Å; W107-T188 PolarHBondContact N-O 3.33Å; W107-C190 HydrophobicContact CB-CB 4.28Å; W107-C190 HydrophobicContact CD2-CB 3.32Å; W107-C190 HydrophobicContact CE3-CB 3.41Å; W107-C190 VanDerWaalsContact CE3-CB 3.41Å; W107-C190 HydrophobicContact CG-CB 3.69Å; W107-C190 HydrophobicContact CH2-CB 4.29Å; W107-C190 HydrophobicContact CZ2-CB 4.24Å; W107-C190 HydrophobicContact CZ3-CB 3.89Å
108	P	89.9	Confident	90.4	Very high	75 Å²	75	44.9 Å²	44.9	49%	0.487	25%	0.25	S	S	.	.			trans	-94	-9.9	-176.7	36.9	-38	0	0	0	114.5	L100 L104 T106 G110	L100-P108 HydrophobicContact CD2-CG 4.32Å; L104-P108 HydrophobicContact CD1-CG 3.82Å; T106-P108 WeakPolarHBondContact O-CD 3.28Å; P108-G110 PolarHBondContact O-N 2.87Å
109	L	90.1	Very high	90.2	Very high	70 Å²	70	45.9 Å²	45.9	37%	0.366	26%	0.257	S	S	.	.	S	Bend	trans	-89.6	0.6	-165.3	-57	177.3	0	0	0	114.4	I97 L100 W107 M113	I97-L109 HydrophobicContact CG2-CD1 3.9Å; L100-L109 HydrophobicContact CD2-CD1 4.06Å; L100-L109 HydrophobicContact CD2-CD2 4.12Å; L100-L109 HydrophobicContact CD2-CG 4.21Å; W107-L109 HydrophobicContact CH2-CB 4.41Å; W107-L109 HydrophobicContact CH2-CD1 4.02Å; W107-L109 HydrophobicContact CZ2-CB 3.69Å; W107-L109 HydrophobicContact CZ2-CD1 4.12Å; W107-L109 HydrophobicContact CZ2-CG 4.36Å; L109-M113 HydrophobicContact CB-CB 3.62Å; L109-M113 HydrophobicContact CB-CG 4.04Å; L109-M113 HydrophobicContact CD1-CB 4.46Å; L109-M113 WeakPolarHBondContact O-CB 3.46Å; L109-M113 WeakPolarHBondContact O-CG 3.3Å
110	G	88.9	Confident	90.1	Very high	33 Å²	33	46.4 Å²	46.4	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	72.6	175.7	-179.5	0	0	0	0	0	114.6	W107 P108 V112 C114	W107-G110 PolarHBondContact NE1-O 3.49Å; P108-G110 PolarHBondContact O-N 2.87Å; G110-V112 PolarHBondContact O-N 2.89Å; G110-C114 PolarHBondContact O-N 3.5Å
111	Q	85	Confident	90	Very high	42 Å²	42	44.3 Å²	44.3	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-41.4	-170.8	-177.4	56.6	30.2	0	0	113.5	M113 C114 D115 V187	Q111-M113 PolarHBondContact O-N 3.25Å; Q111-C114 WeakPolarHBondContact O-CA 3.33Å; Q111-C114 VanDerWaalsContact O-CB 3.28Å; Q111-C114 WeakPolarHBondContact O-CB 3.41Å; Q111-C114 PolarHBondContact O-N 3.26Å; Q111-D115 PolarHBondContact NE2-OD1 2.94Å; Q111-D115 PolarHBondContact NE2-OD2 2.94Å; Q111-D115 PolarHBondContact O-N 3.5Å; Q111-V187 HydrophobicContact CB-CG2 4.07Å
112	V	86.2	Confident	90	Very high	102 Å²	102	44.1 Å²	44.1	62%	0.618	25%	0.25	S	C	*	.	H	α-helix	trans	-62.4	-44.3	-176.7	179.1	0	0	0	0	111.4	G110 C114 D115 I116	G110-V112 PolarHBondContact O-N 2.89Å; V112-C114 VanDerWaalsContact C-N 3.28Å; V112-C114 PolarHBondContact O-N 3.37Å; V112-D115 PolarHBondContact O-N 2.98Å; V112-I116 HydrophobicContact CG1-CD1 4.03Å; V112-I116 WeakPolarHBondContact O-CG1 3.36Å; V112-I116 PolarHBondContact O-N 2.91Å
113	M	90.1	Very high	90.1	Very high	81 Å²	81	44.7 Å²	44.7	40%	0.399	25%	0.254	S	S	.	.	H	α-helix	trans	-68.1	-31.2	175.9	-70.2	-61	119.4	0	0	111.8	W107 L109 Q111 I116 W117	W107-M113 HydrophobicContact CZ2-CB 4.02Å; L109-M113 HydrophobicContact CB-CB 3.62Å; L109-M113 HydrophobicContact CB-CG 4.04Å; L109-M113 HydrophobicContact CD1-CB 4.46Å; L109-M113 WeakPolarHBondContact O-CB 3.46Å; L109-M113 WeakPolarHBondContact O-CG 3.3Å; Q111-M113 PolarHBondContact O-N 3.25Å; M113-I116 HydrophobicContact CE-CD1 3.7Å; M113-I116 HydrophobicContact SD-CD1 4.45Å; M113-W117 WeakPolarHBondContact O-CB 3.34Å; M113-W117 PolarHBondContact O-N 3.39Å
114	C	88.9	Confident	90.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-46.5	176.2	176.6	0	0	0	0	110.4	W107 G110 Q111 V112 W117 L118 C190	W107-C114 HydrophobicContact CZ2-CB 3.73Å; W107-C114 VanDerWaalsContact CZ2-N 3.3Å; G110-C114 PolarHBondContact O-N 3.5Å; Q111-C114 WeakPolarHBondContact O-CA 3.33Å; Q111-C114 VanDerWaalsContact O-CB 3.28Å; Q111-C114 WeakPolarHBondContact O-CB 3.41Å; Q111-C114 PolarHBondContact O-N 3.26Å; V112-C114 VanDerWaalsContact C-N 3.28Å; V112-C114 PolarHBondContact O-N 3.37Å; C114-W117 PolarHBondContact O-N 2.89Å; C114-L118 WeakPolarHBondContact O-CB 3.47Å; C114-L118 VanDerWaalsContact O-CG 3.31Å; C114-L118 WeakPolarHBondContact O-CG 3.43Å; C114-L118 PolarHBondContact O-N 3.39Å; C114-C190 WeakPolarHBondContact CA-SG 3.5Å; C114-C190 HydrophobicContact CB-CB 3.81Å; C114-C190 WeakPolarHBondContact CB-SG 3.49Å; C114-C190 WeakPolarHBondContact SG-CA 3.49Å; C114-C190 WeakPolarHBondContact SG-CB 3.39Å; C114-C190 CovalentContact SG-SG 2.02Å; C114-C190 PolarHBondContact SG-SG 2.85Å
115	D	86.1	Confident	90.4	Very high	35 Å²	35	40.3 Å²	40.3	19%	0.187	23%	0.231	C	C	.	.	H	α-helix	trans	-66.4	-41.3	179.4	-65.9	-34.3	0	0	0	112.1	Q111 V112 S119 F177 R180	Q111-D115 PolarHBondContact NE2-OD1 2.94Å; Q111-D115 PolarHBondContact NE2-OD2 2.94Å; Q111-D115 PolarHBondContact O-N 3.5Å; V112-D115 PolarHBondContact O-N 2.98Å; D115-S119 WeakPolarHBondContact O-CB 3.22Å; D115-S119 PolarHBondContact O-N 3.48Å; D115-F177 HydrophobicContact CB-CE1 4.04Å; D115-R180 IonicContact OD1-NE 3.99Å; D115-R180 IonicContact OD1-NH1 3.85Å
116	I	89.7	Confident	90.7	Very high	80 Å²	80	36.9 Å²	36.9	41%	0.41	22%	0.215	S	C	.	.	H	α-helix	trans	-63.3	-44.9	175.2	-69	169	0	0	0	111	V112 M113 S120	V112-I116 HydrophobicContact CG1-CD1 4.03Å; V112-I116 WeakPolarHBondContact O-CG1 3.36Å; V112-I116 PolarHBondContact O-N 2.91Å; M113-I116 HydrophobicContact CE-CD1 3.7Å; M113-I116 HydrophobicContact SD-CD1 4.45Å; I116-S120 VanDerWaalsContact O-CB 3.25Å; I116-S120 WeakPolarHBondContact O-CB 3.46Å; I116-S120 PolarHBondContact O-N 3.42Å; I116-S120 PolarHBondContact O-OG 3.43Å
117	W	93.4	Very high	91.1	Very high	12 Å²	12	33 Å²	33	5%	0.045	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-51.7	-178.6	173.5	64	0	0	0	111.4	V94 I97 Y101 W107 M113 C114 S119 S120 D121 C190	V94-W117 PolarHBondContact O-NE1 2.84Å; I97-W117 HydrophobicContact CB-CG 4.2Å; I97-W117 HydrophobicContact CD1-CB 4.31Å; I97-W117 HydrophobicContact CD1-CG 4.44Å; I97-W117 HydrophobicContact CG2-CB 4.19Å; I97-W117 HydrophobicContact CG2-CD2 4.07Å; I97-W117 HydrophobicContact CG2-CG 3.67Å; Y101-W117 HydrophobicContact CD1-CH2 4.32Å; W107-W117 HydrophobicContact CH2-CB 4.18Å; W107-W117 HydrophobicContact CH2-CD2 4.2Å; W107-W117 AromaticContact CH2-CE3 3.96Å; W107-W117 HydrophobicContact CH2-CE3 3.96Å; W107-W117 HydrophobicContact CH2-CG 4.31Å; W107-W117 HydrophobicContact CZ3-CD2 4.23Å; W107-W117 AromaticContact CZ3-CE3 3.85Å; W107-W117 HydrophobicContact CZ3-CE3 3.85Å; W107-W117 HydrophobicContact CZ3-CZ3 4.21Å; M113-W117 WeakPolarHBondContact O-CB 3.34Å; M113-W117 PolarHBondContact O-N 3.39Å; C114-W117 PolarHBondContact O-N 2.89Å; W117-S119 VanDerWaalsContact C-N 3.32Å; W117-S119 PolarHBondContact O-N 2.93Å; W117-S120 PolarHBondContact O-N 2.94Å; W117-D121 WeakPolarHBondContact O-CB 3.48Å; W117-D121 PolarHBondContact O-N 3.33Å; W117-C190 HydrophobicContact CE3-CB 4.47Å; W117-C190 HydrophobicContact CZ3-CB 4.26Å
118	L	89.4	Confident	91.3	Very high	17 Å²	17	32.7 Å²	32.7	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-40.5	177.8	-69.7	176.5	0	0	0	112.1	C114 D121 I122 V192	C114-L118 WeakPolarHBondContact O-CB 3.47Å; C114-L118 VanDerWaalsContact O-CG 3.31Å; C114-L118 WeakPolarHBondContact O-CG 3.43Å; C114-L118 PolarHBondContact O-N 3.39Å; L118-D121 PolarHBondContact O-N 3.06Å; L118-I122 WeakPolarHBondContact O-CB 3.29Å; L118-I122 VanDerWaalsContact O-CG1 3.26Å; L118-I122 WeakPolarHBondContact O-CG1 3.39Å; L118-I122 PolarHBondContact O-N 3.4Å; L118-V192 HydrophobicContact CD1-CG2 4.4Å; L118-V192 HydrophobicContact CD2-CG2 3.95Å
119	S	91.1	Very high	91.6	Very high	24 Å²	24	29.1 Å²	29.1	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-44.8	176.1	177.5	0	0	0	0	112	D115 W117 D121 T123 F177	D115-S119 WeakPolarHBondContact O-CB 3.22Å; D115-S119 PolarHBondContact O-N 3.48Å; W117-S119 VanDerWaalsContact C-N 3.32Å; W117-S119 PolarHBondContact O-N 2.93Å; S119-D121 VanDerWaalsContact C-N 3.35Å; S119-T123 WeakPolarHBondContact O-CB 3.46Å; S119-T123 PolarHBondContact O-N 2.94Å; S119-T123 PolarHBondContact O-OG1 3.09Å; S119-F177 VanDerWaalsContact CB-CE2 3.46Å; S119-F177 VanDerWaalsContact CB-CZ 3.42Å; S119-F177 WeakPolarHBondContact OG-CE2 3.13Å
120	S	93.8	Very high	91.8	Very high	25 Å²	25	26.7 Å²	26.7	18%	0.175	16%	0.155	C	C	.	.	H	α-helix	trans	-62.9	-43.1	177.7	-61.1	0	0	0	0	111.3	I116 W117 C124	I116-S120 VanDerWaalsContact O-CB 3.25Å; I116-S120 WeakPolarHBondContact O-CB 3.46Å; I116-S120 PolarHBondContact O-N 3.42Å; I116-S120 PolarHBondContact O-OG 3.43Å; W117-S120 PolarHBondContact O-N 2.94Å; S120-C124 VanDerWaalsContact O-CB 3.29Å; S120-C124 WeakPolarHBondContact O-CB 3.49Å; S120-C124 PolarHBondContact O-N 3.35Å; S120-C124 PolarHBondContact O-SG 2.88Å
121	D	93.8	Very high	92.2	Very high	24 Å²	24	25.1 Å²	25.1	13%	0.128	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-56.8	177.3	-177.6	24.8	0	0	0	111.6	V94 W117 L118 S119 T123 C124 C125 Y350	V94-D121 HydrophobicContact CG1-CB 3.79Å; V94-D121 HydrophobicContact CG2-CB 4.09Å; W117-D121 WeakPolarHBondContact O-CB 3.48Å; W117-D121 PolarHBondContact O-N 3.33Å; L118-D121 PolarHBondContact O-N 3.06Å; S119-D121 VanDerWaalsContact C-N 3.35Å; D121-T123 VanDerWaalsContact C-N 3.29Å; D121-T123 PolarHBondContact O-N 3.48Å; D121-C124 PolarHBondContact O-N 3.46Å; D121-C125 VanDerWaalsContact O-CB 3.26Å; D121-C125 WeakPolarHBondContact O-CB 3.4Å; D121-C125 PolarHBondContact O-N 3.09Å; D121-C125 PolarHBondContact O-SG 3.39Å; D121-C125 PolarHBondContact OD1-SG 3.45Å; D121-Y350 WeakPolarHBondContact OD1-CE1 3.49Å; D121-Y350 PolarHBondContact OD2-OH 3.02Å
122	I	91.4	Very high	92.6	Very high	27 Å²	27	23.6 Å²	23.6	14%	0.138	13%	0.132	C	C	.	.	H	α-helix	trans	-57.6	-44.5	179.1	-66.5	169.3	0	0	0	110.7	L118 T126 I172 Y199	L118-I122 WeakPolarHBondContact O-CB 3.29Å; L118-I122 VanDerWaalsContact O-CG1 3.26Å; L118-I122 WeakPolarHBondContact O-CG1 3.39Å; L118-I122 PolarHBondContact O-N 3.4Å; I122-T126 WeakPolarHBondContact O-CB 2.99Å; I122-T126 PolarHBondContact O-N 2.99Å; I122-T126 PolarHBondContact O-OG1 3.33Å; I122-I172 HydrophobicContact CG2-CG2 4.17Å; I122-Y199 WeakPolarHBondContact CD1-OH 3.33Å
123	T	94.7	Very high	93	Very high	15 Å²	15	18.9 Å²	18.9	9%	0.092	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-50.7	-180	-55.3	0	0	0	0	111.3	S119 D121 T126 A127 W166 A169 I170 S173	S119-T123 WeakPolarHBondContact O-CB 3.46Å; S119-T123 PolarHBondContact O-N 2.94Å; S119-T123 PolarHBondContact O-OG1 3.09Å; D121-T123 VanDerWaalsContact C-N 3.29Å; D121-T123 PolarHBondContact O-N 3.48Å; T123-T126 PolarHBondContact O-N 3.34Å; T123-A127 WeakPolarHBondContact O-CB 3.22Å; T123-A127 PolarHBondContact O-N 3.15Å; T123-W166 HydrophobicContact CG2-CE3 4.38Å; T123-W166 HydrophobicContact CG2-CZ3 4.13Å; T123-A169 HydrophobicContact CG2-CB 4.21Å; T123-I170 HydrophobicContact CG2-CG1 3.69Å; T123-S173 WeakPolarHBondContact OG1-CB 3.31Å; T123-S173 PolarHBondContact OG1-OG 2.8Å
124	C	95.8	Very high	93.3	Very high	5 Å²	5	15.8 Å²	15.8	3%	0.034	9%	0.089	C	C	.	.	H	α-helix	trans	-68.5	-40.6	-175.5	-65.2	0	0	0	0	111.5	T86 V90 S120 D121 A127 S128	T86-C124 HydrophobicContact CG2-CB 4.28Å; T86-C124 WeakPolarHBondContact CG2-O 3.28Å; V90-C124 HydrophobicContact CG2-CB 3.49Å; V90-C124 VanDerWaalsContact CG2-CB 3.49Å; S120-C124 VanDerWaalsContact O-CB 3.29Å; S120-C124 WeakPolarHBondContact O-CB 3.49Å; S120-C124 PolarHBondContact O-N 3.35Å; S120-C124 PolarHBondContact O-SG 2.88Å; D121-C124 PolarHBondContact O-N 3.46Å; C124-A127 PolarHBondContact O-N 3.1Å; C124-S128 WeakPolarHBondContact O-CB 3.48Å; C124-S128 PolarHBondContact O-N 3.17Å
125	C	92.7	Very high	93.5	Very high	14 Å²	14	16.5 Å²	16.5	10%	0.095	9%	0.093	C	C	.	.	H	α-helix	trans	-66	-42.4	177.2	-67.4	0	0	0	0	111.7	D121 S128 I129 W320	D121-C125 VanDerWaalsContact O-CB 3.26Å; D121-C125 WeakPolarHBondContact O-CB 3.4Å; D121-C125 PolarHBondContact O-N 3.09Å; D121-C125 PolarHBondContact O-SG 3.39Å; D121-C125 PolarHBondContact OD1-SG 3.45Å; C125-S128 PolarHBondContact O-N 2.88Å; C125-I129 PolarHBondContact O-N 3.27Å; C125-W320 HydrophobicContact CB-CH2 3.99Å; C125-W320 HydrophobicContact CB-CZ2 4.05Å; C125-W320 WeakPolarHBondContact SG-CH2 3.42Å; C125-W320 WeakPolarHBondContact SG-CZ2 3.14Å
126	T	94.6	Very high	93.8	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-43.3	173.8	-55.7	0	0	0	0	111.5	I122 T123 S128 I129 L130 A169 I172 A207	I122-T126 WeakPolarHBondContact O-CB 2.99Å; I122-T126 PolarHBondContact O-N 2.99Å; I122-T126 PolarHBondContact O-OG1 3.33Å; T123-T126 PolarHBondContact O-N 3.34Å; T126-S128 VanDerWaalsContact C-N 3.32Å; T126-S128 PolarHBondContact O-N 2.83Å; T126-I129 WeakPolarHBondContact O-CG2 3.48Å; T126-L130 HydrophobicContact CG2-CD1 3.85Å; T126-L130 HydrophobicContact CG2-CG 4.37Å; T126-L130 WeakPolarHBondContact O-CB 3.28Å; T126-L130 VanDerWaalsContact O-CG 3.28Å; T126-L130 WeakPolarHBondContact O-CG 3.47Å; T126-L130 PolarHBondContact O-N 3.41Å; T126-A169 HydrophobicContact CG2-CB 3.99Å; T126-I172 HydrophobicContact CG2-CG1 4.34Å; T126-A207 HydrophobicContact CG2-CB 4.49Å; T126-A207 VanDerWaalsContact OG1-CB 3.22Å; T126-A207 WeakPolarHBondContact OG1-CB 3.29Å
127	A	96.8	Very high	94	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.5	-40.9	176.2	0	0	0	0	0	111.1	T86 T123 C124 I129 L130 H131 W166 A169	T86-A127 HydrophobicContact CG2-CB 3.69Å; T123-A127 WeakPolarHBondContact O-CB 3.22Å; T123-A127 PolarHBondContact O-N 3.15Å; C124-A127 PolarHBondContact O-N 3.1Å; A127-I129 PolarHBondContact O-N 3.36Å; A127-L130 PolarHBondContact O-N 3.03Å; A127-H131 WeakPolarHBondContact O-CB 3.4Å; A127-H131 PolarHBondContact O-N 2.88Å; A127-H131 PolarHBondContact O-ND1 3.03Å; A127-W166 HydrophobicContact CB-CD2 4.42Å; A127-W166 HydrophobicContact CB-CE3 4.07Å; A127-W166 HydrophobicContact CB-CH2 4.13Å; A127-W166 HydrophobicContact CB-CZ2 4.48Å; A127-W166 HydrophobicContact CB-CZ3 3.92Å; A127-A169 HydrophobicContact CB-CB 3.75Å
128	S	95.3	Very high	94	Very high	4 Å²	4	13.1 Å²	13.1	3%	0.028	8%	0.077	C	C	.	.	H	α-helix	trans	-59.7	-48.4	-178.6	-171.6	0	0	0	0	111	L83 D87 C124 C125 T126 H131 L132	L83-S128 WeakPolarHBondContact CD1-OG 3.45Å; D87-S128 PolarHBondContact OD1-OG 3.03Å; C124-S128 WeakPolarHBondContact O-CB 3.48Å; C124-S128 PolarHBondContact O-N 3.17Å; C125-S128 PolarHBondContact O-N 2.88Å; T126-S128 VanDerWaalsContact C-N 3.32Å; T126-S128 PolarHBondContact O-N 2.83Å; S128-H131 PolarHBondContact O-N 3.38Å; S128-L132 WeakPolarHBondContact O-CG 3.23Å; S128-L132 PolarHBondContact O-N 3.15Å; S128-L132 VanDerWaalsContact O-N 3.08Å
129	I	94.8	Very high	94	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.5	-37.8	176.1	-173.8	171.3	0	0	0	113.4	C125 T126 A127 H131 L132 C133 A207 P211 T212 Y316	C125-I129 PolarHBondContact O-N 3.27Å; T126-I129 WeakPolarHBondContact O-CG2 3.48Å; A127-I129 PolarHBondContact O-N 3.36Å; I129-H131 VanDerWaalsContact C-N 3.33Å; I129-H131 PolarHBondContact O-N 3.21Å; I129-L132 WeakPolarHBondContact O-CB 3.32Å; I129-L132 PolarHBondContact O-N 3.19Å; I129-C133 PolarHBondContact O-N 3.13Å; I129-C133 PolarHBondContact O-SG 2.95Å; I129-A207 WeakPolarHBondContact CG2-O 3.49Å; I129-P211 HydrophobicContact CD1-CB 3.66Å; I129-P211 HydrophobicContact CG1-CB 3.87Å; I129-P211 HydrophobicContact CG2-CB 4.07Å; I129-P211 HydrophobicContact CG2-CG 4.48Å; I129-T212 WeakPolarHBondContact CD1-OG1 3.1Å; I129-Y316 HydrophobicContact CB-CE1 4.35Å; I129-Y316 HydrophobicContact CB-CE2 3.85Å; I129-Y316 WeakPolarHBondContact CB-OH 3.23Å; I129-Y316 HydrophobicContact CD1-CD1 4.35Å; I129-Y316 HydrophobicContact CD1-CE1 3.46Å; I129-Y316 VanDerWaalsContact CD1-CE1 3.46Å; I129-Y316 WeakPolarHBondContact CD1-OH 3.39Å; I129-Y316 HydrophobicContact CG1-CE1 4.03Å; I129-Y316 HydrophobicContact CG1-CE2 4.35Å
130	L	96	Very high	93.9	Very high	19 Å²	19	16.9 Å²	16.9	10%	0.099	9%	0.087	C	C	.	.	H	α-helix	trans	-66	-36.3	176.6	-71.4	173.3	0	0	0	111.8	T126 A127 L132 C133 V134 A165 I168 A169 P211	T126-L130 HydrophobicContact CG2-CD1 3.85Å; T126-L130 HydrophobicContact CG2-CG 4.37Å; T126-L130 WeakPolarHBondContact O-CB 3.28Å; T126-L130 VanDerWaalsContact O-CG 3.28Å; T126-L130 WeakPolarHBondContact O-CG 3.47Å; T126-L130 PolarHBondContact O-N 3.41Å; A127-L130 PolarHBondContact O-N 3.03Å; L130-L132 VanDerWaalsContact C-N 3.35Å; L130-C133 WeakPolarHBondContact O-CB 3.02Å; L130-C133 PolarHBondContact O-N 3.18Å; L130-V134 WeakPolarHBondContact O-CB 3.48Å; L130-V134 WeakPolarHBondContact O-CG2 3.15Å; L130-V134 PolarHBondContact O-N 3.32Å; L130-A165 HydrophobicContact CB-CB 3.97Å; L130-A165 WeakPolarHBondContact CD1-O 3.17Å; L130-I168 HydrophobicContact CD1-CB 3.84Å; L130-I168 HydrophobicContact CD1-CG2 3.6Å; L130-A169 HydrophobicContact CD1-CB 4.27Å; L130-P211 HydrophobicContact CD2-CB 4.18Å; L130-P211 HydrophobicContact CD2-CG 4.19Å
131	H	96.4	Very high	93.8	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.5	-38.7	171.8	-77	94	0	0	0	111.6	S82 L83 A127 S128 I129 C133 V134 I135 W166	S82-H131 WeakPolarHBondContact CB-NE2 3.38Å; S82-H131 PolarHBondContact OG-CD2 3.43Å; S82-H131 PolarHBondContact OG-NE2 3.04Å; L83-H131 HydrophobicContact CB-CB 4.05Å; L83-H131 HydrophobicContact CD1-CB 4.09Å; L83-H131 HydrophobicContact CG-CB 4.48Å; A127-H131 WeakPolarHBondContact O-CB 3.4Å; A127-H131 PolarHBondContact O-N 2.88Å; A127-H131 PolarHBondContact O-ND1 3.03Å; S128-H131 PolarHBondContact O-N 3.38Å; I129-H131 VanDerWaalsContact C-N 3.33Å; I129-H131 PolarHBondContact O-N 3.21Å; H131-C133 VanDerWaalsContact C-N 3.34Å; H131-C133 PolarHBondContact O-N 2.8Å; H131-V134 PolarHBondContact O-N 3.15Å; H131-I135 WeakPolarHBondContact O-CB 3.45Å; H131-I135 VanDerWaalsContact O-CG1 3.23Å; H131-I135 WeakPolarHBondContact O-CG1 3.37Å; H131-I135 PolarHBondContact O-N 2.95Å; H131-W166 AromaticContact CE1-CD1 3.85Å; H131-W166 AromaticContact CE1-CE2 3.87Å; H131-W166 AromaticContact CE1-NE1 3.45Å; H131-W166 PolarHBondContact CE1-NE1 2.9Å; H131-W166 AromaticContact NE2-NE1 3.71Å
132	L	93.6	Very high	93.5	Very high	10 Å²	10	18.8 Å²	18.8	5%	0.052	9%	0.093	C	C	.	.	H	α-helix	trans	-61.2	-41.3	171.1	-69.1	177	0	0	0	112.1	L83 S128 I129 L130 I135 A136 L215 I312 Y316	L83-L132 HydrophobicContact CD2-CD2 3.49Å; L83-L132 VanDerWaalsContact CD2-CD2 3.49Å; L83-L132 HydrophobicContact CD2-CG 4.07Å; S128-L132 WeakPolarHBondContact O-CG 3.23Å; S128-L132 PolarHBondContact O-N 3.15Å; S128-L132 VanDerWaalsContact O-N 3.08Å; I129-L132 WeakPolarHBondContact O-CB 3.32Å; I129-L132 PolarHBondContact O-N 3.19Å; L130-L132 VanDerWaalsContact C-N 3.35Å; L132-I135 PolarHBondContact O-N 2.73Å; L132-A136 WeakPolarHBondContact O-CB 3.35Å; L132-A136 PolarHBondContact O-N 3.31Å; L132-L215 HydrophobicContact CB-CD1 4.21Å; L132-L215 HydrophobicContact CB-CD2 4.12Å; L132-I312 HydrophobicContact CD1-CG2 4.38Å; L132-I312 HydrophobicContact CD2-CG2 3.35Å; L132-Y316 HydrophobicContact CD1-CD2 3.76Å; L132-Y316 HydrophobicContact CD1-CG 3.97Å
133	C	95.1	Very high	93.2	Very high	4 Å²	4	18.4 Å²	18.4	3%	0.027	9%	0.091	C	C	.	.	H	α-helix	trans	-63	-43.7	174.9	-65.4	0	0	0	0	111.8	I129 L130 H131 A136 L137 P211 L214	I129-C133 PolarHBondContact O-N 3.13Å; I129-C133 PolarHBondContact O-SG 2.95Å; L130-C133 WeakPolarHBondContact O-CB 3.02Å; L130-C133 PolarHBondContact O-N 3.18Å; H131-C133 VanDerWaalsContact C-N 3.34Å; H131-C133 PolarHBondContact O-N 2.8Å; C133-A136 WeakPolarHBondContact O-CB 3.48Å; C133-A136 PolarHBondContact O-N 3.47Å; C133-L137 WeakPolarHBondContact O-CG 3.3Å; C133-L137 PolarHBondContact O-N 3.3Å; C133-P211 PolarHBondContact SG-O 3.27Å; C133-P211 VanDerWaalsContact SG-O 3.37Å; C133-L214 HydrophobicContact CB-CD2 4.25Å
134	V	95.8	Very high	92.8	Very high	15 Å²	15	19.2 Å²	19.2	9%	0.091	10%	0.095	C	C	.	.	H	α-helix	trans	-63.3	-43.4	176.9	156.8	0	0	0	0	111.4	L79 L130 H131 L137 D138 M161 A165	L79-V134 HydrophobicContact CD1-CG1 3.85Å; L79-V134 HydrophobicContact CD2-CG1 3.56Å; L79-V134 HydrophobicContact CG-CG1 4.22Å; L130-V134 WeakPolarHBondContact O-CB 3.48Å; L130-V134 WeakPolarHBondContact O-CG2 3.15Å; L130-V134 PolarHBondContact O-N 3.32Å; H131-V134 PolarHBondContact O-N 3.15Å; V134-L137 PolarHBondContact O-N 3.26Å; V134-D138 PolarHBondContact O-N 3.27Å; V134-M161 HydrophobicContact CB-CE 4.33Å; V134-M161 HydrophobicContact CG1-CB 3.9Å; V134-M161 HydrophobicContact CG1-CE 3.74Å; V134-M161 HydrophobicContact CG2-CB 4.39Å; V134-M161 HydrophobicContact CG2-CE 4.37Å; V134-A165 HydrophobicContact CG2-CB 4.42Å
135	I	93.6	Very high	92.3	Very high	15 Å²	15	23.6 Å²	23.6	8%	0.077	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-47.7	172.6	-69.6	164.2	0	0	0	109.4	L79 I80 L83 H131 L132 L137 D138 R139 L309	L79-I135 HydrophobicContact CB-CD1 4.45Å; L79-I135 HydrophobicContact CB-CG1 3.71Å; L79-I135 HydrophobicContact CD1-CG1 4.36Å; I80-I135 HydrophobicContact CG1-CD1 4.42Å; L83-I135 HydrophobicContact CB-CD1 4.44Å; L83-I135 HydrophobicContact CD2-CD1 3.74Å; H131-I135 WeakPolarHBondContact O-CB 3.45Å; H131-I135 VanDerWaalsContact O-CG1 3.23Å; H131-I135 WeakPolarHBondContact O-CG1 3.37Å; H131-I135 PolarHBondContact O-N 2.95Å; L132-I135 PolarHBondContact O-N 2.73Å; I135-L137 VanDerWaalsContact C-N 3.34Å; I135-L137 PolarHBondContact O-N 3.1Å; I135-D138 PolarHBondContact O-N 3.15Å; I135-R139 HydrophobicContact CG2-CG 4.33Å; I135-R139 WeakPolarHBondContact O-CB 3.42Å; I135-R139 WeakPolarHBondContact O-CG 3Å; I135-R139 PolarHBondContact O-N 3.17Å; I135-L309 HydrophobicContact CG2-CD2 3.83Å
136	A	91.9	Very high	91.9	Very high	8 Å²	8	25 Å²	25	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-41.7	178.1	0	0	0	0	0	112.3	L132 C133 R139 Y140 L215 L218 I222	L132-A136 WeakPolarHBondContact O-CB 3.35Å; L132-A136 PolarHBondContact O-N 3.31Å; C133-A136 WeakPolarHBondContact O-CB 3.48Å; C133-A136 PolarHBondContact O-N 3.47Å; A136-R139 PolarHBondContact O-N 3.02Å; A136-Y140 VanDerWaalsContact O-CB 3.32Å; A136-Y140 WeakPolarHBondContact O-CB 3.48Å; A136-Y140 PolarHBondContact O-N 3.22Å; A136-L215 HydrophobicContact CB-CD1 3.79Å; A136-L218 HydrophobicContact CB-CB 4.25Å; A136-L218 HydrophobicContact CB-CD1 4.23Å; A136-I222 HydrophobicContact CB-CD1 4.5Å; A136-I222 WeakPolarHBondContact O-CD1 3.26Å
137	L	93.4	Very high	91.5	Very high	44 Å²	44	30.6 Å²	30.6	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-48.6	175.2	-79.8	168.8	0	0	0	112.4	C133 V134 I135 R139 Y140 W141 M161 L218	C133-L137 WeakPolarHBondContact O-CG 3.3Å; C133-L137 PolarHBondContact O-N 3.3Å; V134-L137 PolarHBondContact O-N 3.26Å; I135-L137 VanDerWaalsContact C-N 3.34Å; I135-L137 PolarHBondContact O-N 3.1Å; L137-R139 PolarHBondContact O-N 3.48Å; L137-Y140 WeakPolarHBondContact O-CB 3.33Å; L137-Y140 PolarHBondContact O-N 2.96Å; L137-Y140 VanDerWaalsContact O-N 3.16Å; L137-W141 HydrophobicContact CB-CZ3 4.37Å; L137-W141 HydrophobicContact CD2-CZ2 4.4Å; L137-W141 PolarHBondContact O-N 3.43Å; L137-M161 HydrophobicContact CB-CE 4.31Å; L137-L218 HydrophobicContact CD2-CD1 3.9Å; L137-L218 HydrophobicContact CD2-CD2 3.5Å; L137-L218 HydrophobicContact CD2-CG 4.36Å; L137-L218 HydrophobicContact CG-CD1 3.68Å; L137-L218 HydrophobicContact CG-CD2 4.23Å
138	D	92.9	Very high	91.1	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-40.5	176.5	169.6	75	0	0	0	111.2	L79 V134 I135 A142 Y149	L79-D138 HydrophobicContact CD1-CB 3.74Å; V134-D138 PolarHBondContact O-N 3.27Å; I135-D138 PolarHBondContact O-N 3.15Å; D138-A142 VanDerWaalsContact O-CB 3.24Å; D138-A142 WeakPolarHBondContact O-CB 3.47Å; D138-A142 PolarHBondContact O-N 3.38Å; D138-Y149 WeakPolarHBondContact O-CE1 3.19Å; D138-Y149 WeakPolarHBondContact OD1-CE1 3.17Å; D138-Y149 PolarHBondContact OD1-OH 3.26Å
139	R	89.6	Confident	90.9	Very high	58 Å²	58	35 Å²	35	22%	0.219	19%	0.185	C	C	.	.	H	α-helix	trans	-69.8	-40.6	176.5	-64.2	-63.6	91.5	-173.9	7.5	112.3	I135 A136 L137 A142 I143 I222 L309	I135-R139 HydrophobicContact CG2-CG 4.33Å; I135-R139 WeakPolarHBondContact O-CB 3.42Å; I135-R139 WeakPolarHBondContact O-CG 3Å; I135-R139 PolarHBondContact O-N 3.17Å; A136-R139 PolarHBondContact O-N 3.02Å; L137-R139 PolarHBondContact O-N 3.48Å; R139-A142 PolarHBondContact O-N 3.07Å; R139-I143 VanDerWaalsContact O-CG1 3.29Å; R139-I143 WeakPolarHBondContact O-CG1 3.49Å; R139-I143 PolarHBondContact O-N 2.7Å; R139-I222 HydrophobicContact CB-CD1 4.42Å; R139-L309 HydrophobicContact CB-CD1 3.8Å; R139-L309 HydrophobicContact CG-CD1 3.57Å; R139-L309 HydrophobicContact CG-CD2 4.21Å
140	Y	89.3	Confident	90.6	Very high	62 Å²	62	38.4 Å²	38.4	24%	0.243	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-48.6	176.2	174	-106.5	0	0	0	111.4	A136 L137 I143 T144 R221 I222	A136-Y140 VanDerWaalsContact O-CB 3.32Å; A136-Y140 WeakPolarHBondContact O-CB 3.48Å; A136-Y140 PolarHBondContact O-N 3.22Å; L137-Y140 WeakPolarHBondContact O-CB 3.33Å; L137-Y140 PolarHBondContact O-N 2.96Å; L137-Y140 VanDerWaalsContact O-N 3.16Å; Y140-I143 PolarHBondContact O-N 3.23Å; Y140-T144 HydrophobicContact CD2-CG2 3.88Å; Y140-T144 HydrophobicContact CE1-CG2 4.32Å; Y140-T144 HydrophobicContact CE2-CG2 3.37Å; Y140-T144 WeakPolarHBondContact O-CB 3.05Å; Y140-T144 PolarHBondContact O-N 3.47Å; Y140-T144 PolarHBondContact O-OG1 3.43Å; Y140-R221 HydrophobicContact CD2-CB 4.19Å; Y140-R221 HydrophobicContact CE2-CB 3.8Å; Y140-I222 HydrophobicContact CD2-CG1 3.92Å; Y140-I222 HydrophobicContact CG-CG1 4.36Å
141	W	91.3	Very high	90.3	Very high	71 Å²	71	44.3 Å²	44.3	27%	0.269	23%	0.234	S	C	.	.	H	α-helix	trans	-67.8	-38.3	176.9	-65.8	-38.4	0	0	0	112.8	L137 I143 D145 Y149 R157 M161	L137-W141 HydrophobicContact CB-CZ3 4.37Å; L137-W141 HydrophobicContact CD2-CZ2 4.4Å; L137-W141 PolarHBondContact O-N 3.43Å; W141-I143 PolarHBondContact O-N 3.27Å; W141-D145 CarbonylContact O-C 3.56Å; W141-D145 PolarHBondContact O-N 2.87Å; W141-Y149 HydrophobicContact CB-CD1 3.87Å; W141-Y149 HydrophobicContact CB-CD2 3.48Å; W141-Y149 VanDerWaalsContact CB-CD2 3.48Å; W141-Y149 HydrophobicContact CB-CE1 3.97Å; W141-Y149 HydrophobicContact CB-CE2 3.62Å; W141-Y149 HydrophobicContact CB-CG 3.61Å; W141-Y149 HydrophobicContact CD2-CD2 4.45Å; W141-Y149 AromaticContact CD2-CE2 4Å; W141-Y149 HydrophobicContact CD2-CE2 4Å; W141-Y149 HydrophobicContact CE3-CD2 4.35Å; W141-Y149 AromaticContact CE3-CE2 3.48Å; W141-Y149 HydrophobicContact CE3-CE2 3.48Å; W141-Y149 VanDerWaalsContact CE3-CE2 3.48Å; W141-Y149 AromaticContact CE3-CZ 3.81Å; W141-Y149 HydrophobicContact CG-CD2 4.17Å; W141-Y149 HydrophobicContact CG-CE2 4.12Å; W141-Y149 HydrophobicContact CZ3-CE2 4.39Å; W141-R157 VanDerWaalsContact CE3-NH2 3.3Å; W141-M161 HydrophobicContact CH2-CE 4.45Å; W141-M161 HydrophobicContact CZ3-CE 3.79Å; W141-M161 HydrophobicContact CZ3-SD 4.24Å
142	A	88.1	Confident	90	Very high	19 Å²	19	49.3 Å²	49.3	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-31.5	175.4	0	0	0	0	0	112.8	D138 R139 A146 Y149	D138-A142 VanDerWaalsContact O-CB 3.24Å; D138-A142 WeakPolarHBondContact O-CB 3.47Å; D138-A142 PolarHBondContact O-N 3.38Å; R139-A142 PolarHBondContact O-N 3.07Å; A142-A146 WeakPolarHBondContact O-CA 3.45Å; A142-A146 WeakPolarHBondContact O-CB 3.18Å; A142-Y149 HydrophobicContact CB-CD1 3.95Å; A142-Y149 HydrophobicContact CB-CE1 4.1Å
143	I	85.6	Confident	89.9	Confident	19 Å²	19	53.2 Å²	53.2	10%	0.097	27%	0.269	C	S	.	.	H	α-helix	trans	-76.6	-72.5	172	-66.3	168.5	0	0	0	107.5	R139 Y140 W141 D145 A146 I222 E225 R229	R139-I143 VanDerWaalsContact O-CG1 3.29Å; R139-I143 WeakPolarHBondContact O-CG1 3.49Å; R139-I143 PolarHBondContact O-N 2.7Å; Y140-I143 PolarHBondContact O-N 3.23Å; W141-I143 PolarHBondContact O-N 3.27Å; I143-D145 PolarHBondContact O-N 3.05Å; I143-A146 PolarHBondContact O-N 3.36Å; I143-I222 HydrophobicContact CD1-CG2 3.7Å; I143-E225 HydrophobicContact CG2-CB 4.46Å; I143-R229 VanDerWaalsContact C-NH2 3.31Å; I143-R229 PolarHBondContact O-NH1 2.84Å; I143-R229 PolarHBondContact O-NH2 3.44Å
144	T	86.9	Confident	89.9	Confident	31 Å²	31	56.5 Å²	56.5	19%	0.19	29%	0.289	C	S	.	.	H	α-helix	trans	-53.3	-52.3	-169.6	49.1	0	0	0	0	114.3	Y140 E225 R229	Y140-T144 HydrophobicContact CD2-CG2 3.88Å; Y140-T144 HydrophobicContact CE1-CG2 4.32Å; Y140-T144 HydrophobicContact CE2-CG2 3.37Å; Y140-T144 WeakPolarHBondContact O-CB 3.05Å; Y140-T144 PolarHBondContact O-N 3.47Å; Y140-T144 PolarHBondContact O-OG1 3.43Å; T144-E225 HydrophobicContact CG2-CB 4.4Å; T144-E225 HydrophobicContact CG2-CG 3.98Å; T144-R229 PolarHBondContact O-NH2 2.85Å
145	D	85.3	Confident	89.8	Confident	98 Å²	98	58.2 Å²	58.2	52%	0.524	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	45.1	-175	-66.7	-31.8	0	0	0	112.3	W141 I143 V147 E148 Y149	W141-D145 CarbonylContact O-C 3.56Å; W141-D145 PolarHBondContact O-N 2.87Å; I143-D145 PolarHBondContact O-N 3.05Å; D145-V147 VanDerWaalsContact C-N 3.29Å; D145-V147 PolarHBondContact O-N 3.47Å; D145-E148 PolarHBondContact O-N 2.86Å; D145-Y149 WeakPolarHBondContact O-CB 3.21Å; D145-Y149 PolarHBondContact O-N 3.26Å
146	A	84.8	Confident	89.9	Confident	44 Å²	44	60.1 Å²	60.1	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-46.7	-43.5	-170	0	0	0	0	0	115.4	A142 I143 S150	A142-A146 WeakPolarHBondContact O-CA 3.45Å; A142-A146 WeakPolarHBondContact O-CB 3.18Å; I143-A146 PolarHBondContact O-N 3.36Å; A146-S150 WeakPolarHBondContact O-CB 3.1Å; A146-S150 PolarHBondContact O-N 2.92Å
147	V	85.1	Confident	90	Very high	117 Å²	117	63.7 Å²	63.7	71%	0.709	34%	0.34	S	S	*	.	H	α-helix	trans	-72.6	-48.1	-176.2	178.4	0	0	0	0	111.8	D145	D145-V147 VanDerWaalsContact C-N 3.29Å; D145-V147 PolarHBondContact O-N 3.47Å
148	E	89.4	Confident	90.1	Very high	85 Å²	85	61.9 Å²	61.9	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-79.7	-38.7	-174.2	-172.4	56.1	-156.4	0	0	111.3	D145 S150 K151 K152	D145-E148 PolarHBondContact O-N 2.86Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 3.21Å; E148-K151 PolarHBondContact O-N 3.19Å; E148-K151 IonicContact OE2-NZ 3.28Å; E148-K151 PolarHBondContact OE2-NZ 3.49Å; E148-K152 PolarHBondContact O-N 3.08Å; E148-K152 WeakPolarHBondContact OE1-CE 3.45Å; E148-K152 IonicContact OE1-NZ 3.32Å; E148-K152 PolarHBondContact OE1-NZ 2.66Å
149	Y	90.1	Very high	90.3	Very high	12 Å²	12	64.3 Å²	64.3	5%	0.047	35%	0.352	C	S	.	.	H	α-helix	trans	-66.2	-34.6	175.9	-172.2	-109.9	0	0	0	112.5	D138 W141 A142 D145 K151 K152 R153	D138-Y149 WeakPolarHBondContact O-CE1 3.19Å; D138-Y149 WeakPolarHBondContact OD1-CE1 3.17Å; D138-Y149 PolarHBondContact OD1-OH 3.26Å; W141-Y149 HydrophobicContact CB-CD1 3.87Å; W141-Y149 HydrophobicContact CB-CD2 3.48Å; W141-Y149 VanDerWaalsContact CB-CD2 3.48Å; W141-Y149 HydrophobicContact CB-CE1 3.97Å; W141-Y149 HydrophobicContact CB-CE2 3.62Å; W141-Y149 HydrophobicContact CB-CG 3.61Å; W141-Y149 HydrophobicContact CD2-CD2 4.45Å; W141-Y149 AromaticContact CD2-CE2 4Å; W141-Y149 HydrophobicContact CD2-CE2 4Å; W141-Y149 HydrophobicContact CE3-CD2 4.35Å; W141-Y149 AromaticContact CE3-CE2 3.48Å; W141-Y149 HydrophobicContact CE3-CE2 3.48Å; W141-Y149 VanDerWaalsContact CE3-CE2 3.48Å; W141-Y149 AromaticContact CE3-CZ 3.81Å; W141-Y149 HydrophobicContact CG-CD2 4.17Å; W141-Y149 HydrophobicContact CG-CE2 4.12Å; W141-Y149 HydrophobicContact CZ3-CE2 4.39Å; A142-Y149 HydrophobicContact CB-CD1 3.95Å; A142-Y149 HydrophobicContact CB-CE1 4.1Å; D145-Y149 WeakPolarHBondContact O-CB 3.21Å; D145-Y149 PolarHBondContact O-N 3.26Å; Y149-K151 PolarHBondContact O-N 3.46Å; Y149-K152 CarbonylContact O-C 3.22Å; Y149-K152 PolarHBondContact O-N 2.93Å; Y149-R153 HydrophobicContact CD1-CB 4.43Å; Y149-R153 HydrophobicContact CE1-CB 4.14Å; Y149-R153 HydrophobicContact CE1-CG 4.1Å; Y149-R153 WeakPolarHBondContact O-CB 3.31Å; Y149-R153 PolarHBondContact O-N 3.02Å
150	S	88.5	Confident	90.7	Very high	71 Å²	71	63.3 Å²	63.3	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-55.7	-37.4	176.2	-175	0	0	0	0	112.3	A146 E148	A146-S150 WeakPolarHBondContact O-CB 3.1Å; A146-S150 PolarHBondContact O-N 2.92Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 3.21Å
151	K	89.6	Confident	91	Very high	144 Å²	144	61.7 Å²	61.7	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-71.2	-32.6	176.1	-58.3	174.7	-169.8	163	0	112.8	E148 Y149	E148-K151 PolarHBondContact O-N 3.19Å; E148-K151 IonicContact OE2-NZ 3.28Å; E148-K151 PolarHBondContact OE2-NZ 3.49Å; Y149-K151 PolarHBondContact O-N 3.46Å
152	K	90.5	Very high	91.4	Very high	104 Å²	104	59.7 Å²	59.7	45%	0.452	35%	0.349	S	S	.	.	H	α-helix	trans	-88.7	-11.9	-176.4	-64.6	176.9	-177.9	169.8	0	113.6	E148 Y149 T154	E148-K152 PolarHBondContact O-N 3.08Å; E148-K152 WeakPolarHBondContact OE1-CE 3.45Å; E148-K152 IonicContact OE1-NZ 3.32Å; E148-K152 PolarHBondContact OE1-NZ 2.66Å; Y149-K152 CarbonylContact O-C 3.22Å; Y149-K152 PolarHBondContact O-N 2.93Å; K152-T154 VanDerWaalsContact C-N 3.34Å; K152-T154 PolarHBondContact O-N 3.32Å
153	R	91.8	Very high	91.9	Very high	93 Å²	93	61.2 Å²	61.2	35%	0.351	36%	0.361	S	S	.	.			trans	-79.1	81.7	-176.9	-168.9	179.2	65	-171.8	-1.5	110.5	P75 Y149	P75-R153 HydrophobicContact CB-CG 4.02Å; P75-R153 HydrophobicContact CG-CG 4.19Å; Y149-R153 HydrophobicContact CD1-CB 4.43Å; Y149-R153 HydrophobicContact CE1-CB 4.14Å; Y149-R153 HydrophobicContact CE1-CG 4.1Å; Y149-R153 WeakPolarHBondContact O-CB 3.31Å; Y149-R153 PolarHBondContact O-N 3.02Å
154	T	94.9	Very high	92.4	Very high	73 Å²	73	64.3 Å²	64.3	45%	0.448	38%	0.381	S	S	.	.			trans	-108.4	160.6	179.8	65.8	0	0	0	0	111.8	K152 G156 R157 A158	K152-T154 VanDerWaalsContact C-N 3.34Å; K152-T154 PolarHBondContact O-N 3.32Å; T154-G156 VanDerWaalsContact C-N 3.33Å; T154-G156 PolarHBondContact O-N 3.11Å; T154-R157 PolarHBondContact O-N 2.7Å; T154-R157 PolarHBondContact OG1-N 3.26Å; T154-A158 PolarHBondContact O-N 3.21Å
155	A	93.1	Very high	92.9	Very high	50 Å²	50	63 Å²	63	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-38.5	176.3	0	0	0	0	0	112.2	F78 R157 A158 A159	F78-A155 HydrophobicContact CD2-CB 4.27Å; F78-A155 HydrophobicContact CE2-CB 3.93Å; A155-R157 PolarHBondContact O-N 2.95Å; A155-A158 PolarHBondContact O-N 3.34Å; A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3.48Å
156	G	95.4	Very high	93.5	Very high	55 Å²	55	60.7 Å²	60.7	57%	0.567	36%	0.357	S	S	*	.	H	α-helix	trans	-62.3	-40.5	177.3	0	0	0	0	0	113	T154 A159 G160	T154-G156 VanDerWaalsContact C-N 3.33Å; T154-G156 PolarHBondContact O-N 3.11Å; G156-A159 PolarHBondContact O-N 3.18Å; G156-G160 PolarHBondContact O-N 3.4Å
157	R	95.1	Very high	94.1	Very high	83 Å²	83	63.3 Å²	63.3	31%	0.313	37%	0.369	S	S	.	.	H	α-helix	trans	-64.3	-43.7	174.1	-178.5	177.4	174.2	161.5	0.5	111.7	W141 T154 A155 A159 G160 M161	W141-R157 VanDerWaalsContact CE3-NH2 3.3Å; T154-R157 PolarHBondContact O-N 2.7Å; T154-R157 PolarHBondContact OG1-N 3.26Å; A155-R157 PolarHBondContact O-N 2.95Å; R157-A159 VanDerWaalsContact C-N 3.35Å; R157-G160 PolarHBondContact O-N 2.99Å; R157-M161 HydrophobicContact CG-SD 4.44Å; R157-M161 WeakPolarHBondContact O-CG 3.42Å; R157-M161 PolarHBondContact O-N 3.35Å
158	A	95.8	Very high	94.5	Very high	6 Å²	6	61.2 Å²	61.2	5%	0.05	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-42.8	176.8	0	0	0	0	0	111.8	P75 L79 T154 A155 G160 M161 I162	P75-A158 HydrophobicContact CB-CB 3.98Å; L79-A158 HydrophobicContact CD2-CB 4.09Å; T154-A158 PolarHBondContact O-N 3.21Å; A155-A158 PolarHBondContact O-N 3.34Å; A158-G160 VanDerWaalsContact C-N 3.33Å; A158-G160 PolarHBondContact O-N 3.48Å; A158-M161 PolarHBondContact O-N 3.1Å; A158-I162 WeakPolarHBondContact O-CG1 3.5Å; A158-I162 PolarHBondContact O-N 3.08Å
159	A	96.1	Very high	94.8	Very high	56 Å²	56	57.2 Å²	57.2	46%	0.463	33%	0.334	S	S	.	.	H	α-helix	trans	-60	-42	174.1	0	0	0	0	0	112	A155 G156 R157 I162 A163	A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3.48Å; G156-A159 PolarHBondContact O-N 3.18Å; R157-A159 VanDerWaalsContact C-N 3.35Å; A159-I162 PolarHBondContact O-N 3.48Å; A159-A163 WeakPolarHBondContact O-CB 3.35Å; A159-A163 PolarHBondContact O-N 3.49Å
160	G	97.6	Very high	95	Very high	36 Å²	36	60.3 Å²	60.3	37%	0.371	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-44.2	173.5	0	0	0	0	0	112.9	G156 R157 A158 I162 A163 T164	G156-G160 PolarHBondContact O-N 3.4Å; R157-G160 PolarHBondContact O-N 2.99Å; A158-G160 VanDerWaalsContact C-N 3.33Å; A158-G160 PolarHBondContact O-N 3.48Å; G160-I162 PolarHBondContact O-N 3.32Å; G160-A163 PolarHBondContact O-N 3.28Å; G160-T164 PolarHBondContact O-N 3.45Å; G160-T164 PolarHBondContact O-OG1 3.06Å
161	M	97.1	Very high	95.1	Very high	29 Å²	29	59.2 Å²	59.2	14%	0.143	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-41.1	176.2	-66.4	173.9	76.6	0	0	112.3	V134 L137 W141 R157 A158 A165	V134-M161 HydrophobicContact CB-CE 4.33Å; V134-M161 HydrophobicContact CG1-CB 3.9Å; V134-M161 HydrophobicContact CG1-CE 3.74Å; V134-M161 HydrophobicContact CG2-CB 4.39Å; V134-M161 HydrophobicContact CG2-CE 4.37Å; L137-M161 HydrophobicContact CB-CE 4.31Å; W141-M161 HydrophobicContact CH2-CE 4.45Å; W141-M161 HydrophobicContact CZ3-CE 3.79Å; W141-M161 HydrophobicContact CZ3-SD 4.24Å; R157-M161 HydrophobicContact CG-SD 4.44Å; R157-M161 WeakPolarHBondContact O-CG 3.42Å; R157-M161 PolarHBondContact O-N 3.35Å; A158-M161 PolarHBondContact O-N 3.1Å; M161-A165 PolarHBondContact O-N 2.95Å; M161-A165 VanDerWaalsContact O-N 3.07Å
162	I	98.3	Very high	95.1	Very high	28 Å²	28	53 Å²	53	14%	0.144	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-49.5	175	-71.3	162.5	0	0	0	110.5	L79 S82 A158 A159 G160 T164 A165 W166	L79-I162 HydrophobicContact CD2-CD1 3.95Å; L79-I162 HydrophobicContact CD2-CG1 3.73Å; S82-I162 WeakPolarHBondContact OG-CG2 3.26Å; A158-I162 WeakPolarHBondContact O-CG1 3.5Å; A158-I162 PolarHBondContact O-N 3.08Å; A159-I162 PolarHBondContact O-N 3.48Å; G160-I162 PolarHBondContact O-N 3.32Å; I162-T164 VanDerWaalsContact C-N 3.32Å; I162-T164 PolarHBondContact O-N 3.16Å; I162-A165 WeakPolarHBondContact O-CB 3.48Å; I162-A165 PolarHBondContact O-N 3.05Å; I162-A165 VanDerWaalsContact O-N 3.15Å; I162-W166 PolarHBondContact O-N 3.03Å
163	A	98.1	Very high	94.9	Very high	51 Å²	51	48.1 Å²	48.1	42%	0.421	30%	0.295	S	S	.	.	H	α-helix	trans	-59	-44.6	179.9	0	0	0	0	0	111.5	A159 G160 A165 W166 V167	A159-A163 WeakPolarHBondContact O-CB 3.35Å; A159-A163 PolarHBondContact O-N 3.49Å; G160-A163 PolarHBondContact O-N 3.28Å; A163-A165 VanDerWaalsContact C-N 3.34Å; A163-A165 PolarHBondContact O-N 3.13Å; A163-W166 PolarHBondContact O-N 3.33Å; A163-V167 VanDerWaalsContact O-CG2 3.32Å; A163-V167 WeakPolarHBondContact O-CG2 2.98Å; A163-V167 PolarHBondContact O-N 3.44Å
164	T	97.4	Very high	94.4	Very high	84 Å²	84	47.3 Å²	47.3	52%	0.515	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-43.2	175.5	-58.4	0	0	0	0	111.9	G160 I162 W166 V167 I168	G160-T164 PolarHBondContact O-N 3.45Å; G160-T164 PolarHBondContact O-OG1 3.06Å; I162-T164 VanDerWaalsContact C-N 3.32Å; I162-T164 PolarHBondContact O-N 3.16Å; T164-W166 PolarHBondContact O-N 3Å; T164-V167 PolarHBondContact O-N 3.33Å; T164-I168 HydrophobicContact CG2-CD1 3.84Å; T164-I168 HydrophobicContact CG2-CG1 4.42Å; T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.49Å; T164-I168 PolarHBondContact O-N 2.73Å
165	A	97.1	Very high	93.5	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-43.9	177.9	0	0	0	0	0	112	L130 V134 M161 I162 A163 I168 A169	L130-A165 HydrophobicContact CB-CB 3.97Å; L130-A165 WeakPolarHBondContact CD1-O 3.17Å; V134-A165 HydrophobicContact CG2-CB 4.42Å; M161-A165 PolarHBondContact O-N 2.95Å; M161-A165 VanDerWaalsContact O-N 3.07Å; I162-A165 WeakPolarHBondContact O-CB 3.48Å; I162-A165 PolarHBondContact O-N 3.05Å; I162-A165 VanDerWaalsContact O-N 3.15Å; A163-A165 VanDerWaalsContact C-N 3.34Å; A163-A165 PolarHBondContact O-N 3.13Å; A165-I168 PolarHBondContact O-N 3.43Å; A165-A169 WeakPolarHBondContact O-CB 3.48Å; A165-A169 PolarHBondContact O-N 2.98Å
166	W	97.9	Very high	92.4	Very high	50 Å²	50	43.5 Å²	43.5	19%	0.189	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-44.8	175.8	-82.7	107.9	0	0	0	112.9	T86 L89 T123 A127 H131 I162 A163 T164 I168 A169 I170	T86-W166 HydrophobicContact CG2-CH2 4.14Å; T86-W166 HydrophobicContact CG2-CZ2 4.41Å; T86-W166 VanDerWaalsContact OG1-CZ2 3.3Å; T86-W166 WeakPolarHBondContact OG1-CZ2 3.4Å; L89-W166 HydrophobicContact CD1-CH2 3.69Å; L89-W166 HydrophobicContact CD1-CZ2 4.22Å; T123-W166 HydrophobicContact CG2-CE3 4.38Å; T123-W166 HydrophobicContact CG2-CZ3 4.13Å; A127-W166 HydrophobicContact CB-CD2 4.42Å; A127-W166 HydrophobicContact CB-CE3 4.07Å; A127-W166 HydrophobicContact CB-CH2 4.13Å; A127-W166 HydrophobicContact CB-CZ2 4.48Å; A127-W166 HydrophobicContact CB-CZ3 3.92Å; H131-W166 AromaticContact CE1-CD1 3.85Å; H131-W166 AromaticContact CE1-CE2 3.87Å; H131-W166 AromaticContact CE1-NE1 3.45Å; H131-W166 PolarHBondContact CE1-NE1 2.9Å; H131-W166 AromaticContact NE2-NE1 3.71Å; I162-W166 PolarHBondContact O-N 3.03Å; A163-W166 PolarHBondContact O-N 3.33Å; T164-W166 PolarHBondContact O-N 3Å; W166-I168 VanDerWaalsContact C-N 3.32Å; W166-I168 PolarHBondContact O-N 3Å; W166-A169 PolarHBondContact O-N 3.28Å; W166-I170 WeakPolarHBondContact O-CB 3.49Å; W166-I170 VanDerWaalsContact O-CG1 3.3Å; W166-I170 WeakPolarHBondContact O-CG1 3.27Å; W166-I170 PolarHBondContact O-N 3.4Å
167	V	96.9	Very high	91.2	Very high	100 Å²	100	45.6 Å²	45.6	61%	0.606	26%	0.264	S	S	*	.	H	α-helix	trans	-60.1	-44.7	178	169	0	0	0	0	110.8	A163 T164 S171	A163-V167 VanDerWaalsContact O-CG2 3.32Å; A163-V167 WeakPolarHBondContact O-CG2 2.98Å; A163-V167 PolarHBondContact O-N 3.44Å; T164-V167 PolarHBondContact O-N 3.33Å; V167-S171 WeakPolarHBondContact O-CB 3.4Å; V167-S171 PolarHBondContact O-N 2.68Å; V167-S171 PolarHBondContact O-OG 3.45Å
168	I	94.5	Very high	89.9	Confident	73 Å²	73	49.5 Å²	49.5	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-49.2	175.5	-65.7	167.7	0	0	0	109.8	L130 T164 A165 W166 I170 S171 I172	L130-I168 HydrophobicContact CD1-CB 3.84Å; L130-I168 HydrophobicContact CD1-CG2 3.6Å; T164-I168 HydrophobicContact CG2-CD1 3.84Å; T164-I168 HydrophobicContact CG2-CG1 4.42Å; T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.49Å; T164-I168 PolarHBondContact O-N 2.73Å; A165-I168 PolarHBondContact O-N 3.43Å; W166-I168 VanDerWaalsContact C-N 3.32Å; W166-I168 PolarHBondContact O-N 3Å; I168-I170 PolarHBondContact O-N 3.06Å; I168-S171 PolarHBondContact O-N 3.29Å; I168-S171 VanDerWaalsContact O-N 3.13Å; I168-S171 PolarHBondContact O-OG 3.23Å; I168-I172 WeakPolarHBondContact O-CG1 3.36Å; I168-I172 PolarHBondContact O-N 2.64Å; I168-I172 VanDerWaalsContact O-N 3.15Å
169	A	95.8	Very high	88.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.3	-44.9	-179.2	0	0	0	0	0	113.2	T123 T126 A127 L130 A165 W166 I172 S173	T123-A169 HydrophobicContact CG2-CB 4.21Å; T126-A169 HydrophobicContact CG2-CB 3.99Å; A127-A169 HydrophobicContact CB-CB 3.75Å; L130-A169 HydrophobicContact CD1-CB 4.27Å; A165-A169 WeakPolarHBondContact O-CB 3.48Å; A165-A169 PolarHBondContact O-N 2.98Å; W166-A169 PolarHBondContact O-N 3.28Å; A169-I172 PolarHBondContact O-N 2.91Å; A169-S173 PolarHBondContact O-N 3.28Å
170	I	93.5	Very high	86.8	Confident	77 Å²	77	57.6 Å²	57.6	40%	0.395	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-42.3	176.5	-67.1	164.6	0	0	0	110.2	T123 W166 I168 I172 S173 L174	T123-I170 HydrophobicContact CG2-CG1 3.69Å; W166-I170 WeakPolarHBondContact O-CB 3.49Å; W166-I170 VanDerWaalsContact O-CG1 3.3Å; W166-I170 WeakPolarHBondContact O-CG1 3.27Å; W166-I170 PolarHBondContact O-N 3.4Å; I168-I170 PolarHBondContact O-N 3.06Å; I170-I172 PolarHBondContact O-N 3.2Å; I170-S173 PolarHBondContact O-N 2.86Å; I170-S173 PolarHBondContact O-OG 3.07Å; I170-L174 HydrophobicContact CG2-CD1 4.2Å; I170-L174 HydrophobicContact CG2-CG 4.18Å; I170-L174 WeakPolarHBondContact O-CG 3.1Å; I170-L174 PolarHBondContact O-N 3.37Å
171	S	91.2	Very high	84.9	Confident	48 Å²	48	64.4 Å²	64.4	34%	0.336	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-27.6	179.1	73.6	0	0	0	0	113.8	V167 I168 P175 Y202	V167-S171 WeakPolarHBondContact O-CB 3.4Å; V167-S171 PolarHBondContact O-N 2.68Å; V167-S171 PolarHBondContact O-OG 3.45Å; I168-S171 PolarHBondContact O-N 3.29Å; I168-S171 VanDerWaalsContact O-N 3.13Å; I168-S171 PolarHBondContact O-OG 3.23Å; S171-P175 WeakPolarHBondContact O-CD 3.48Å; S171-Y202 PolarHBondContact O-OH 2.83Å
172	I	88.8	Confident	82.9	Confident	13 Å²	13	68.6 Å²	68.6	7%	0.067	35%	0.35	C	S	.	.	H	α-helix	trans	-73.1	-33	175.1	-63.2	-58.7	0	0	0	111.8	I122 T126 I168 A169 I170 P175 Y202 A207	I122-I172 HydrophobicContact CG2-CG2 4.17Å; T126-I172 HydrophobicContact CG2-CG1 4.34Å; I168-I172 WeakPolarHBondContact O-CG1 3.36Å; I168-I172 PolarHBondContact O-N 2.64Å; I168-I172 VanDerWaalsContact O-N 3.15Å; A169-I172 PolarHBondContact O-N 2.91Å; I170-I172 PolarHBondContact O-N 3.2Å; I172-P175 WeakPolarHBondContact O-CD 3.31Å; I172-Y202 HydrophobicContact CD1-CE1 4.01Å; I172-Y202 HydrophobicContact CD1-CE2 4.23Å; I172-Y202 WeakPolarHBondContact CD1-OH 3.31Å; I172-Y202 HydrophobicContact CG2-CE1 4.41Å; I172-A207 HydrophobicContact CG2-CB 4.22Å
173	S	86.3	Confident	80.9	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.014	37%	0.374	C	S	.	.	H	α-helix	trans	-89.7	-9.2	-176.7	63.4	0	0	0	0	114.9	T123 A169 I170 P176	T123-S173 WeakPolarHBondContact OG1-CB 3.31Å; T123-S173 PolarHBondContact OG1-OG 2.8Å; A169-S173 PolarHBondContact O-N 3.28Å; I170-S173 PolarHBondContact O-N 2.86Å; I170-S173 PolarHBondContact O-OG 3.07Å; S173-P176 WeakPolarHBondContact O-CD 3.49Å
174	L	82.3	Confident	78.6	Confident	76 Å²	76	77.1 Å²	77.1	40%	0.398	40%	0.397	S	S	.	.	S	Bend	trans	-72.4	-37.4	-179.9	-76.3	176.5	0	0	0	116.6	I170 F177 F178	I170-L174 HydrophobicContact CG2-CD1 4.2Å; I170-L174 HydrophobicContact CG2-CG 4.18Å; I170-L174 WeakPolarHBondContact O-CG 3.1Å; I170-L174 PolarHBondContact O-N 3.37Å; L174-F177 WeakPolarHBondContact O-CB 3.18Å; L174-F177 PolarHBondContact O-N 2.88Å; L174-F178 HydrophobicContact CB-CE2 4.24Å; L174-F178 WeakPolarHBondContact O-CD2 3.42Å
175	P	75.9	Confident	76.8	Confident	17 Å²	17	80.5 Å²	80.5	11%	0.11	41%	0.407	C	S	.	.	H	α-helix	trans	-52.6	-39.4	-174.4	-31	38.7	0	0	0	116.3	S171 I172 F177 F178 W179 Y199 Y202	S171-P175 WeakPolarHBondContact O-CD 3.48Å; I172-P175 WeakPolarHBondContact O-CD 3.31Å; P175-F177 PolarHBondContact O-N 3.26Å; P175-F178 PolarHBondContact O-N 3.45Å; P175-F178 VanDerWaalsContact O-N 3.1Å; P175-W179 HydrophobicContact CB-CE3 3.81Å; P175-W179 HydrophobicContact CB-CZ3 3.82Å; P175-W179 PolarHBondContact O-N 2.66Å; P175-W179 VanDerWaalsContact O-N 3.15Å; P175-Y199 HydrophobicContact CB-CD2 3.9Å; P175-Y199 HydrophobicContact CB-CE2 4.01Å; P175-Y202 HydrophobicContact CG-CD1 4.3Å; P175-Y202 HydrophobicContact CG-CE1 3.68Å
176	P	68.9	Low	75	Confident	27 Å²	27	88.8 Å²	88.8	18%	0.175	45%	0.445	C	S	.	.	H	α-helix	trans	-54.3	-34.7	175.4	-29	38.5	0	0	0	114	S173 F178 R180 Y199	S173-P176 WeakPolarHBondContact O-CD 3.49Å; P176-F178 VanDerWaalsContact C-N 3.27Å; P176-F178 PolarHBondContact O-N 2.96Å; P176-R180 WeakPolarHBondContact O-CB 3.31Å; P176-R180 PolarHBondContact O-N 2.81Å; P176-Y199 VanDerWaalsContact CD-CE2 3.47Å; P176-Y199 HydrophobicContact CG-CD2 4.38Å; P176-Y199 HydrophobicContact CG-CE1 3.89Å; P176-Y199 HydrophobicContact CG-CE2 3.49Å; P176-Y199 VanDerWaalsContact CG-CE2 3.49Å; P176-Y199 WeakPolarHBondContact CG-OH 3.26Å
177	F	70.1	Confident	73.7	Confident	99 Å²	99	88.2 Å²	88.2	43%	0.434	45%	0.447	S	S	.	.	H	α-helix	trans	-69.2	-25.4	-178.3	-68.2	-83.7	0	0	0	113.3	D115 S119 L174 P175	D115-F177 HydrophobicContact CB-CE1 4.04Å; S119-F177 VanDerWaalsContact CB-CE2 3.46Å; S119-F177 VanDerWaalsContact CB-CZ 3.42Å; S119-F177 WeakPolarHBondContact OG-CE2 3.13Å; L174-F177 WeakPolarHBondContact O-CB 3.18Å; L174-F177 PolarHBondContact O-N 2.88Å; P175-F177 PolarHBondContact O-N 3.26Å
178	F	69.3	Low	72.7	Confident	165 Å²	165	88.4 Å²	88.4	72%	0.724	45%	0.449	S	S	*	.	H	α-helix	trans	-94.9	-27.5	-179.4	-61.3	-74.4	0	0	0	112.8	L174 P175 P176	L174-F178 HydrophobicContact CB-CE2 4.24Å; L174-F178 WeakPolarHBondContact O-CD2 3.42Å; P175-F178 PolarHBondContact O-N 3.45Å; P175-F178 VanDerWaalsContact O-N 3.1Å; P176-F178 VanDerWaalsContact C-N 3.27Å; P176-F178 PolarHBondContact O-N 2.96Å
179	W	62.8	Low	72.1	Confident	176 Å²	176	87.6 Å²	87.6	67%	0.667	45%	0.449	S	S	*	.	H	α-helix	trans	-102.3	-21.2	-176.5	-88.3	-70.8	0	0	0	114.7	P175 Q181	P175-W179 HydrophobicContact CB-CE3 3.81Å; P175-W179 HydrophobicContact CB-CZ3 3.82Å; P175-W179 PolarHBondContact O-N 2.66Å; P175-W179 VanDerWaalsContact O-N 3.15Å; W179-Q181 PolarHBondContact O-N 3.37Å
180	R	63.9	Low	71.5	Confident	56 Å²	56	87.7 Å²	87.7	21%	0.211	45%	0.45	C	S	.	.			trans	-79.4	93.4	179.7	-161.7	171.9	-166.7	146.7	6.6	109	D115 P176 V182 N191	D115-R180 IonicContact OD1-NE 3.99Å; D115-R180 IonicContact OD1-NH1 3.85Å; P176-R180 WeakPolarHBondContact O-CB 3.31Å; P176-R180 PolarHBondContact O-N 2.81Å; R180-V182 PolarHBondContact O-N 3.32Å; R180-N191 PolarHBondContact NH1-O 3.05Å; R180-N191 PolarHBondContact NH2-O 2.94Å
181	Q	56.8	Low	70.7	Confident	178 Å²	178	87.4 Å²	87.4	83%	0.832	45%	0.449	S	S	*	.			trans	-64.5	122.1	171.4	-157.4	148.6	-8.4	0	0	108.4	W179 K183	W179-Q181 PolarHBondContact O-N 3.37Å; Q181-K183 PolarHBondContact O-N 3.34Å
182	V	56.2	Low	69.9	Low	117 Å²	117	87.7 Å²	87.7	71%	0.709	45%	0.449	S	S	*	.			trans	-60.7	99.1	-177.7	-178.2	0	0	0	0	108.6	R180 A184	R180-V182 PolarHBondContact O-N 3.32Å; V182-A184 PolarHBondContact O-N 3.48Å
183	K	54.7	Low	68.8	Low	149 Å²	149	89.4 Å²	89.4	65%	0.648	46%	0.458	S	S	*	.			trans	-76.8	113.3	165.9	-70.3	-176.9	-179.9	172.3	0	106.3	Q181 E185	Q181-K183 PolarHBondContact O-N 3.34Å; K183-E185 PolarHBondContact O-N 2.97Å
184	A	50.8	Low	67.8	Low	109 Å²	109	93.4 Å²	93.4	90%	0.901	48%	0.482	S	S	*	.			trans	-75.2	62.6	177.2	0	0	0	0	0	110.4	V182	V182-A184 PolarHBondContact O-N 3.48Å
185	E	58.5	Low	66.9	Low	156 Å²	156	94.8 Å²	94.8	73%	0.729	49%	0.49	S	S	*	.	S	Bend	trans	-125.2	149.6	178.2	-152.7	167.4	-162.1	0	0	108.8	K183 V187	K183-E185 PolarHBondContact O-N 2.97Å; E185-V187 WeakPolarHBondContact O-CG2 3.49Å; E185-V187 PolarHBondContact O-N 2.85Å
186	E	60.1	Low	66.5	Low	177 Å²	177	98.2 Å²	98.2	83%	0.827	51%	0.505	S	S	*	.			trans	-61.3	109.5	-178.8	-70	-176.1	169.9	0	0	110.3	T188	E186-T188 PolarHBondContact O-N 3.39Å
187	V	70.2	Confident	66.9	Low	38 Å²	38	102.8 Å²	102.8	23%	0.23	53%	0.526	C	S	.	.			trans	-79	94.4	-175.3	-174.9	0	0	0	0	109.4	Q111 E185 S189	Q111-V187 HydrophobicContact CB-CG2 4.07Å; E185-V187 WeakPolarHBondContact O-CG2 3.49Å; E185-V187 PolarHBondContact O-N 2.85Å; V187-S189 WeakPolarHBondContact CG1-O 2.98Å
188	T	77.1	Confident	67.2	Low	104 Å²	104	106.6 Å²	106.6	64%	0.638	54%	0.543	S	S	*	.			trans	-80.8	-19	178.6	53.9	0	0	0	0	113.5	W107 E186	W107-T188 PolarHBondContact N-O 3.33Å; E186-T188 PolarHBondContact O-N 3.39Å
189	S	80.8	Confident	67.6	Low	55 Å²	55	100 Å²	100	39%	0.385	51%	0.513	S	S	.	.			trans	-136.1	138.9	176.7	65.1	0	0	0	0	111.5	V187	V187-S189 WeakPolarHBondContact CG1-O 2.98Å
190	C	83.8	Confident	68.3	Low	2 Å²	2	92.9 Å²	92.9	1%	0.014	49%	0.49	C	S	.	.			trans	-105.6	94	176.7	178.9	0	0	0	0	110	W107 C114 W117	W107-C190 HydrophobicContact CB-CB 4.28Å; W107-C190 HydrophobicContact CD2-CB 3.32Å; W107-C190 HydrophobicContact CE3-CB 3.41Å; W107-C190 VanDerWaalsContact CE3-CB 3.41Å; W107-C190 HydrophobicContact CG-CB 3.69Å; W107-C190 HydrophobicContact CH2-CB 4.29Å; W107-C190 HydrophobicContact CZ2-CB 4.24Å; W107-C190 HydrophobicContact CZ3-CB 3.89Å; C114-C190 WeakPolarHBondContact CA-SG 3.5Å; C114-C190 HydrophobicContact CB-CB 3.81Å; C114-C190 WeakPolarHBondContact CB-SG 3.49Å; C114-C190 WeakPolarHBondContact SG-CA 3.49Å; C114-C190 WeakPolarHBondContact SG-CB 3.39Å; C114-C190 CovalentContact SG-SG 2.02Å; C114-C190 PolarHBondContact SG-SG 2.85Å; W117-C190 HydrophobicContact CE3-CB 4.47Å; W117-C190 HydrophobicContact CZ3-CB 4.26Å
191	N	75.7	Confident	69.2	Low	71 Å²	71	94.5 Å²	94.5	38%	0.38	50%	0.501	S	S	.	.			trans	-121.8	154.3	178	-67	-54.2	0	0	0	110.9	R180 N193	R180-N191 PolarHBondContact NH1-O 3.05Å; R180-N191 PolarHBondContact NH2-O 2.94Å; N191-N193 PolarHBondContact O-N 2.82Å
192	V	74.1	Confident	70.5	Confident	55 Å²	55	90.8 Å²	90.8	33%	0.333	48%	0.481	S	S	.	.			trans	-61.3	124.5	169.7	-178.1	0	0	0	0	108.2	L118 T194 Y199	L118-V192 HydrophobicContact CD1-CG2 4.4Å; L118-V192 HydrophobicContact CD2-CG2 3.95Å; V192-T194 PolarHBondContact O-N 3.3Å; V192-T194 VanDerWaalsContact O-N 3.14Å; V192-Y199 HydrophobicContact CG1-CD1 4.31Å; V192-Y199 HydrophobicContact CG1-CE1 3.5Å; V192-Y199 VanDerWaalsContact CG1-CE1 3.5Å
193	N	67.1	Low	71.7	Confident	49 Å²	49	85.9 Å²	85.9	26%	0.262	45%	0.451	S	S	.	.			trans	-67.1	115.6	-177.9	-167	16.1	0	0	0	110.3	N191 D195	N191-N193 PolarHBondContact O-N 2.82Å; N193-D195 PolarHBondContact ND2-OD2 2.9Å; N193-D195 PolarHBondContact OD1-N 2.78Å; N193-D195 PolarHBondContact OD1-OD2 3.12Å; N193-D195 VanDerWaalsContact OD1-OD2 3.12Å
194	T	64.3	Low	73.2	Confident	85 Å²	85	79.4 Å²	79.4	52%	0.521	42%	0.424	S	S	.	.			trans	-93.8	0.7	-178.6	50.5	0	0	0	0	113.5	V192 H196	V192-T194 PolarHBondContact O-N 3.3Å; V192-T194 VanDerWaalsContact O-N 3.14Å; T194-H196 PolarHBondContact O-N 3.4Å
195	D	63.5	Low	75	Confident	106 Å²	106	78.5 Å²	78.5	57%	0.567	40%	0.4	S	S	*	.	S	Bend	trans	-54.9	-26.5	179.1	-70	-19.2	0	0	0	112.9	N193	N193-D195 PolarHBondContact ND2-OD2 2.9Å; N193-D195 PolarHBondContact OD1-N 2.78Å; N193-D195 PolarHBondContact OD1-OD2 3.12Å; N193-D195 VanDerWaalsContact OD1-OD2 3.12Å
196	H	68.8	Low	76.5	Confident	89 Å²	89	71.9 Å²	71.9	41%	0.412	37%	0.374	S	S	.	.			trans	-108.9	98.6	173.5	-64.6	-57.1	0	0	0	111.2	T194 F198 Y199 T200	T194-H196 PolarHBondContact O-N 3.4Å; H196-F198 PolarHBondContact O-N 3.14Å; H196-Y199 WeakPolarHBondContact O-CB 3.38Å; H196-Y199 PolarHBondContact O-N 3.34Å; H196-T200 PolarHBondContact O-N 2.86Å
197	I	75.6	Confident	77.8	Confident	123 Å²	123	64 Å²	64	63%	0.631	34%	0.339	S	S	*	.	H	α-helix	trans	-48	-38.7	173.3	-67.8	169.7	0	0	0	111.7	Y199 T200 I201	I197-Y199 VanDerWaalsContact C-N 3.32Å; I197-Y199 PolarHBondContact O-N 2.89Å; I197-T200 PolarHBondContact O-N 2.99Å; I197-I201 HydrophobicContact CG2-CD1 3.69Å; I197-I201 HydrophobicContact CG2-CG1 4.27Å; I197-I201 WeakPolarHBondContact O-CG1 3.11Å; I197-I201 PolarHBondContact O-N 3.12Å
198	F	78.1	Confident	78.8	Confident	179 Å²	179	62.2 Å²	62.2	79%	0.785	33%	0.328	S	S	*	.	H	α-helix	trans	-57.5	-42.3	176.5	-69	-71.8	0	0	0	113	H196 Y202	H196-F198 PolarHBondContact O-N 3.14Å; F198-Y202 WeakPolarHBondContact O-CB 3.47Å; F198-Y202 PolarHBondContact O-N 3.32Å
199	Y	76.4	Confident	79.5	Confident	25 Å²	25	59.3 Å²	59.3	10%	0.098	31%	0.306	C	S	.	.	H	α-helix	trans	-71	-40.5	178.8	174	-104.8	0	0	0	111.5	I122 P175 P176 V192 H196 I197 I201 Y202 S203	I122-Y199 WeakPolarHBondContact CD1-OH 3.33Å; P175-Y199 HydrophobicContact CB-CD2 3.9Å; P175-Y199 HydrophobicContact CB-CE2 4.01Å; P176-Y199 VanDerWaalsContact CD-CE2 3.47Å; P176-Y199 HydrophobicContact CG-CD2 4.38Å; P176-Y199 HydrophobicContact CG-CE1 3.89Å; P176-Y199 HydrophobicContact CG-CE2 3.49Å; P176-Y199 VanDerWaalsContact CG-CE2 3.49Å; P176-Y199 WeakPolarHBondContact CG-OH 3.26Å; V192-Y199 HydrophobicContact CG1-CD1 4.31Å; V192-Y199 HydrophobicContact CG1-CE1 3.5Å; V192-Y199 VanDerWaalsContact CG1-CE1 3.5Å; H196-Y199 WeakPolarHBondContact O-CB 3.38Å; H196-Y199 PolarHBondContact O-N 3.34Å; I197-Y199 VanDerWaalsContact C-N 3.32Å; I197-Y199 PolarHBondContact O-N 2.89Å; Y199-I201 PolarHBondContact O-N 3.03Å; Y199-Y202 HydrophobicContact CD2-CD1 4.43Å; Y199-Y202 PolarHBondContact O-N 3.26Å; Y199-S203 VanDerWaalsContact O-CB 3.29Å; Y199-S203 WeakPolarHBondContact O-CB 3.44Å; Y199-S203 PolarHBondContact O-N 3.45Å; Y199-S203 PolarHBondContact O-OG 3.41Å
200	T	78	Confident	80.1	Confident	28 Å²	28	61.6 Å²	61.6	17%	0.172	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-45.5	174.2	-55.2	0	0	0	0	111.3	H196 I197 S203 T204	H196-T200 PolarHBondContact O-N 2.86Å; I197-T200 PolarHBondContact O-N 2.99Å; T200-S203 PolarHBondContact O-OG 2.88Å; T200-T204 HydrophobicContact CG2-CG2 4.43Å; T200-T204 VanDerWaalsContact O-CB 3.32Å; T200-T204 WeakPolarHBondContact O-CB 3.5Å; T200-T204 VanDerWaalsContact O-CG2 3.23Å; T200-T204 WeakPolarHBondContact O-CG2 3.47Å; T200-T204 PolarHBondContact O-N 2.97Å; T200-T204 PolarHBondContact O-OG1 3.4Å
201	I	82.5	Confident	80.5	Confident	89 Å²	89	61.8 Å²	61.8	46%	0.456	31%	0.314	S	S	.	.	H	α-helix	trans	-64.9	-49.6	176.1	-66.4	171.5	0	0	0	110.6	I197 Y199 S203 T204 F205	I197-I201 HydrophobicContact CG2-CD1 3.69Å; I197-I201 HydrophobicContact CG2-CG1 4.27Å; I197-I201 WeakPolarHBondContact O-CG1 3.11Å; I197-I201 PolarHBondContact O-N 3.12Å; Y199-I201 PolarHBondContact O-N 3.03Å; I201-S203 PolarHBondContact O-N 3.39Å; I201-T204 PolarHBondContact O-OG1 2.67Å; I201-F205 HydrophobicContact CG2-CD2 3.88Å; I201-F205 HydrophobicContact CG2-CE2 4.19Å; I201-F205 WeakPolarHBondContact O-CB 3.42Å; I201-F205 VanDerWaalsContact O-CD2 3.3Å; I201-F205 WeakPolarHBondContact O-CD2 3.4Å; I201-F205 PolarHBondContact O-N 3.17Å
202	Y	84.4	Confident	81.3	Confident	101 Å²	101	59 Å²	59	40%	0.396	30%	0.299	S	S	.	.	H	α-helix	trans	-57.5	-49.9	-179.2	170.1	-94.9	0	0	0	112.1	S171 I172 P175 F198 Y199 G206	S171-Y202 PolarHBondContact O-OH 2.83Å; I172-Y202 HydrophobicContact CD1-CE1 4.01Å; I172-Y202 HydrophobicContact CD1-CE2 4.23Å; I172-Y202 WeakPolarHBondContact CD1-OH 3.31Å; I172-Y202 HydrophobicContact CG2-CE1 4.41Å; P175-Y202 HydrophobicContact CG-CD1 4.3Å; P175-Y202 HydrophobicContact CG-CE1 3.68Å; F198-Y202 WeakPolarHBondContact O-CB 3.47Å; F198-Y202 PolarHBondContact O-N 3.32Å; Y199-Y202 HydrophobicContact CD2-CD1 4.43Å; Y199-Y202 PolarHBondContact O-N 3.26Å; Y202-G206 WeakPolarHBondContact O-CA 3.25Å; Y202-G206 PolarHBondContact O-N 3.21Å
203	S	81.3	Confident	82.3	Confident	13 Å²	13	62 Å²	62	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-67.8	-46.7	-178.2	56.8	0	0	0	0	111.7	Y199 T200 I201 A207	Y199-S203 VanDerWaalsContact O-CB 3.29Å; Y199-S203 WeakPolarHBondContact O-CB 3.44Å; Y199-S203 PolarHBondContact O-N 3.45Å; Y199-S203 PolarHBondContact O-OG 3.41Å; T200-S203 PolarHBondContact O-OG 2.88Å; I201-S203 PolarHBondContact O-N 3.39Å; S203-A207 WeakPolarHBondContact O-CA 3.4Å; S203-A207 WeakPolarHBondContact O-CB 3.47Å; S203-A207 PolarHBondContact O-N 3.39Å
204	T	86.3	Confident	83.5	Confident	13 Å²	13	63.3 Å²	63.3	8%	0.08	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-44.5	179.9	54.5	0	0	0	0	112.6	T200 I201 F208 Y209	T200-T204 HydrophobicContact CG2-CG2 4.43Å; T200-T204 VanDerWaalsContact O-CB 3.32Å; T200-T204 WeakPolarHBondContact O-CB 3.5Å; T200-T204 VanDerWaalsContact O-CG2 3.23Å; T200-T204 WeakPolarHBondContact O-CG2 3.47Å; T200-T204 PolarHBondContact O-N 2.97Å; T200-T204 PolarHBondContact O-OG1 3.4Å; I201-T204 PolarHBondContact O-OG1 2.67Å; T204-F208 PolarHBondContact O-N 2.91Å; T204-F208 VanDerWaalsContact O-N 3.11Å; T204-Y209 WeakPolarHBondContact O-CD2 3.43Å; T204-Y209 PolarHBondContact O-N 3.48Å
205	F	89.8	Confident	84.8	Confident	91 Å²	91	59.7 Å²	59.7	40%	0.399	30%	0.297	S	S	.	.	I	π-helix	trans	-72.5	-42.8	178.9	-80.4	-103.6	0	0	0	112.4	I201 Y209 I210	I201-F205 HydrophobicContact CG2-CD2 3.88Å; I201-F205 HydrophobicContact CG2-CE2 4.19Å; I201-F205 WeakPolarHBondContact O-CB 3.42Å; I201-F205 VanDerWaalsContact O-CD2 3.3Å; I201-F205 WeakPolarHBondContact O-CD2 3.4Å; I201-F205 PolarHBondContact O-N 3.17Å; F205-Y209 HydrophobicContact CD1-CD2 4.4Å; F205-Y209 HydrophobicContact CD2-CD2 4.15Å; F205-Y209 HydrophobicContact CE2-CD2 4.36Å; F205-Y209 HydrophobicContact CG-CD2 4.19Å; F205-Y209 PolarHBondContact O-N 3.33Å; F205-I210 HydrophobicContact CB-CD1 4.27Å; F205-I210 HydrophobicContact CB-CG1 4.44Å; F205-I210 WeakPolarHBondContact O-CB 3.31Å; F205-I210 WeakPolarHBondContact O-CG1 3.48Å; F205-I210 PolarHBondContact O-N 3.17Å
206	G	88.3	Confident	86.2	Confident	17 Å²	17	58.4 Å²	58.4	18%	0.175	29%	0.289	C	S	.	.	I	π-helix	trans	-68.5	-40.9	180	0	0	0	0	0	113.2	Y202 P211	Y202-G206 WeakPolarHBondContact O-CA 3.25Å; Y202-G206 PolarHBondContact O-N 3.21Å; G206-P211 WeakPolarHBondContact O-CD 3.26Å; G206-P211 VanDerWaalsContact O-CG 3.28Å; G206-P211 WeakPolarHBondContact O-CG 3.46Å
207	A	87.8	Confident	87.3	Confident	11 Å²	11	57.7 Å²	57.7	9%	0.091	29%	0.293	C	S	.	.	I	π-helix	trans	-78.2	-35.6	-179.3	0	0	0	0	0	113.1	T126 I129 I172 S203	T126-A207 HydrophobicContact CG2-CB 4.49Å; T126-A207 VanDerWaalsContact OG1-CB 3.22Å; T126-A207 WeakPolarHBondContact OG1-CB 3.29Å; I129-A207 WeakPolarHBondContact CG2-O 3.49Å; I172-A207 HydrophobicContact CG2-CB 4.22Å; S203-A207 WeakPolarHBondContact O-CA 3.4Å; S203-A207 WeakPolarHBondContact O-CB 3.47Å; S203-A207 PolarHBondContact O-N 3.39Å
208	F	90.8	Very high	88	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.267	C	S	.	.	I	π-helix	trans	-126.6	-61.1	-169.6	179.8	-104.5	0	0	0	114.9	T204 I210 P211 T212 Y316 W320 L321 F324	T204-F208 PolarHBondContact O-N 2.91Å; T204-F208 VanDerWaalsContact O-N 3.11Å; F208-I210 PolarHBondContact O-N 3.44Å; F208-P211 WeakPolarHBondContact O-CD 3.4Å; F208-T212 WeakPolarHBondContact CE2-OG1 3.36Å; F208-T212 WeakPolarHBondContact O-CB 3.23Å; F208-T212 PolarHBondContact O-N 3.49Å; F208-T212 PolarHBondContact O-OG1 3.17Å; F208-Y316 HydrophobicContact CD2-CE1 4.02Å; F208-Y316 WeakPolarHBondContact CD2-OH 3.46Å; F208-Y316 AromaticContact CE2-CE1 3.63Å; F208-Y316 HydrophobicContact CE2-CE1 3.63Å; F208-W320 HydrophobicContact CD2-CB 4.2Å; F208-W320 HydrophobicContact CE2-CB 3.56Å; F208-W320 HydrophobicContact CZ-CB 4.35Å; F208-L321 HydrophobicContact CE1-CD1 3.88Å; F208-L321 HydrophobicContact CZ-CB 4.18Å; F208-L321 HydrophobicContact CZ-CD1 3.97Å; F208-F324 HydrophobicContact CB-CD1 3.73Å; F208-F324 HydrophobicContact CB-CD2 3.74Å; F208-F324 HydrophobicContact CB-CE1 3.5Å; F208-F324 VanDerWaalsContact CB-CE1 3.5Å; F208-F324 HydrophobicContact CB-CE2 3.51Å; F208-F324 HydrophobicContact CB-CG 3.86Å; F208-F324 HydrophobicContact CB-CZ 3.4Å; F208-F324 HydrophobicContact CD1-CB 3.62Å; F208-F324 AromaticContact CD1-CD1 3.99Å; F208-F324 HydrophobicContact CD1-CD1 3.99Å; F208-F324 AromaticContact CD1-CD2 3.43Å; F208-F324 HydrophobicContact CD1-CD2 3.43Å; F208-F324 VanDerWaalsContact CD1-CD2 3.43Å; F208-F324 HydrophobicContact CD1-CE2 4.09Å; F208-F324 AromaticContact CD1-CG 3.38Å; F208-F324 HydrophobicContact CD1-CG 3.38Å; F208-F324 AromaticContact CD2-CD2 3.21Å; F208-F324 HydrophobicContact CD2-CD2 3.21Å; F208-F324 AromaticContact CD2-CE2 3.18Å; F208-F324 HydrophobicContact CD2-CE2 3.18Å; F208-F324 HydrophobicContact CD2-CG 4.04Å; F208-F324 HydrophobicContact CD2-CZ 4Å; F208-F324 HydrophobicContact CE1-CB 3.71Å; F208-F324 AromaticContact CE1-CD2 3.73Å; F208-F324 HydrophobicContact CE1-CD2 3.73Å; F208-F324 AromaticContact CE1-CG 3.85Å; F208-F324 HydrophobicContact CE1-CG 3.85Å; F208-F324 AromaticContact CE2-CD2 3.52Å; F208-F324 HydrophobicContact CE2-CD2 3.52Å; F208-F324 AromaticContact CE2-CE2 3.85Å; F208-F324 HydrophobicContact CE2-CE2 3.85Å; F208-F324 HydrophobicContact CE2-CG 4.44Å; F208-F324 HydrophobicContact CG-CB 4.24Å; F208-F324 AromaticContact CG-CD1 3.91Å; F208-F324 HydrophobicContact CG-CD1 3.91Å; F208-F324 AromaticContact CG-CD2 3.15Å; F208-F324 HydrophobicContact CG-CD2 3.15Å; F208-F324 HydrophobicContact CG-CE1 4.05Å; F208-F324 AromaticContact CG-CE2 3.32Å; F208-F324 HydrophobicContact CG-CE2 3.32Å; F208-F324 AromaticContact CG-CG 3.48Å; F208-F324 HydrophobicContact CG-CG 3.48Å; F208-F324 VanDerWaalsContact CG-CG 3.48Å; F208-F324 AromaticContact CG-CZ 3.79Å; F208-F324 HydrophobicContact CG-CZ 3.79Å; F208-F324 HydrophobicContact CZ-CB 4.39Å; F208-F324 AromaticContact CZ-CD2 3.78Å; F208-F324 HydrophobicContact CZ-CD2 3.78Å; F208-F324 HydrophobicContact CZ-CG 4.36Å
209	Y	92.4	Very high	88.4	Confident	42 Å²	42	46.5 Å²	46.5	17%	0.165	24%	0.239	C	C	.	.	I	π-helix	trans	-65.8	-46.2	-167.4	-67.2	-70.7	0	0	0	113	T204 F205 T212 L213 F324 L328	T204-Y209 WeakPolarHBondContact O-CD2 3.43Å; T204-Y209 PolarHBondContact O-N 3.48Å; F205-Y209 HydrophobicContact CD1-CD2 4.4Å; F205-Y209 HydrophobicContact CD2-CD2 4.15Å; F205-Y209 HydrophobicContact CE2-CD2 4.36Å; F205-Y209 HydrophobicContact CG-CD2 4.19Å; F205-Y209 PolarHBondContact O-N 3.33Å; Y209-T212 PolarHBondContact O-N 2.98Å; Y209-L213 WeakPolarHBondContact O-CB 3.27Å; Y209-L213 VanDerWaalsContact O-CG 3.27Å; Y209-L213 WeakPolarHBondContact O-CG 3.25Å; Y209-L213 PolarHBondContact O-N 3.05Å; Y209-F324 PolarHBondContact OH-O 3.36Å; Y209-L328 HydrophobicContact CE2-CD1 3.81Å; Y209-L328 HydrophobicContact CE2-CG 4.28Å; Y209-L328 WeakPolarHBondContact OH-CD1 3.43Å
210	I	93.6	Very high	89	Confident	104 Å²	104	46.9 Å²	46.9	53%	0.533	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-51.3	179.6	-65.8	169	0	0	0	110.8	F205 F208 T212 L213 L214	F205-I210 HydrophobicContact CB-CD1 4.27Å; F205-I210 HydrophobicContact CB-CG1 4.44Å; F205-I210 WeakPolarHBondContact O-CB 3.31Å; F205-I210 WeakPolarHBondContact O-CG1 3.48Å; F205-I210 PolarHBondContact O-N 3.17Å; F208-I210 PolarHBondContact O-N 3.44Å; I210-T212 VanDerWaalsContact C-N 3.29Å; I210-T212 PolarHBondContact O-N 3.28Å; I210-L213 PolarHBondContact O-N 3.42Å; I210-L214 PolarHBondContact O-N 3.09Å
211	P	92.7	Very high	89.6	Confident	6 Å²	6	52.9 Å²	52.9	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-32.5	177.8	-19.5	32	0	0	0	112.8	I129 L130 C133 G206 F208 L214 L215	I129-P211 HydrophobicContact CD1-CB 3.66Å; I129-P211 HydrophobicContact CG1-CB 3.87Å; I129-P211 HydrophobicContact CG2-CB 4.07Å; I129-P211 HydrophobicContact CG2-CG 4.48Å; L130-P211 HydrophobicContact CD2-CB 4.18Å; L130-P211 HydrophobicContact CD2-CG 4.19Å; C133-P211 PolarHBondContact SG-O 3.27Å; C133-P211 VanDerWaalsContact SG-O 3.37Å; G206-P211 WeakPolarHBondContact O-CD 3.26Å; G206-P211 VanDerWaalsContact O-CG 3.28Å; G206-P211 WeakPolarHBondContact O-CG 3.46Å; F208-P211 WeakPolarHBondContact O-CD 3.4Å; P211-L214 WeakPolarHBondContact O-CB 3.49Å; P211-L214 PolarHBondContact O-N 3.44Å; P211-L215 VanDerWaalsContact O-CB 3.3Å; P211-L215 WeakPolarHBondContact O-CB 3.41Å; P211-L215 PolarHBondContact O-N 2.99Å
212	T	92.9	Very high	89.8	Confident	12 Å²	12	48.7 Å²	48.7	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-44.5	176.6	-62.9	0	0	0	0	111.2	I129 F208 Y209 I210 L214 L215 I216 I317	I129-T212 WeakPolarHBondContact CD1-OG1 3.1Å; F208-T212 WeakPolarHBondContact CE2-OG1 3.36Å; F208-T212 WeakPolarHBondContact O-CB 3.23Å; F208-T212 PolarHBondContact O-N 3.49Å; F208-T212 PolarHBondContact O-OG1 3.17Å; Y209-T212 PolarHBondContact O-N 2.98Å; I210-T212 VanDerWaalsContact C-N 3.29Å; I210-T212 PolarHBondContact O-N 3.28Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.44Å; T212-L215 PolarHBondContact O-N 3.09Å; T212-I216 HydrophobicContact CG2-CD1 3.84Å; T212-I216 HydrophobicContact CG2-CG1 4.43Å; T212-I216 VanDerWaalsContact O-CG1 3.27Å; T212-I216 WeakPolarHBondContact O-CG1 3.32Å; T212-I216 PolarHBondContact O-N 3.01Å; T212-I317 HydrophobicContact CG2-CG1 4.3Å
213	L	94.2	Very high	89.9	Confident	117 Å²	117	49.5 Å²	49.5	61%	0.613	25%	0.252	S	S	*	.	H	α-helix	trans	-62.9	-41.9	175.2	-72.8	174.9	0	0	0	111.9	Y209 I210 L215 I216 C217	Y209-L213 WeakPolarHBondContact O-CB 3.27Å; Y209-L213 VanDerWaalsContact O-CG 3.27Å; Y209-L213 WeakPolarHBondContact O-CG 3.25Å; Y209-L213 PolarHBondContact O-N 3.05Å; I210-L213 PolarHBondContact O-N 3.42Å; L213-L215 VanDerWaalsContact C-N 3.33Å; L213-L215 PolarHBondContact O-N 2.97Å; L213-I216 PolarHBondContact O-N 2.98Å; L213-C217 VanDerWaalsContact O-CB 3.32Å; L213-C217 WeakPolarHBondContact O-CB 3.35Å; L213-C217 PolarHBondContact O-N 3.08Å
214	L	92.8	Very high	90.3	Very high	78 Å²	78	52 Å²	52	41%	0.408	27%	0.267	S	S	.	.	H	α-helix	trans	-57.7	-48.5	173.4	176.1	63	0	0	0	110.7	C133 I210 P211 T212 I216 C217 L218	C133-L214 HydrophobicContact CB-CD2 4.25Å; I210-L214 PolarHBondContact O-N 3.09Å; P211-L214 WeakPolarHBondContact O-CB 3.49Å; P211-L214 PolarHBondContact O-N 3.44Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.44Å; L214-I216 PolarHBondContact O-N 2.9Å; L214-C217 PolarHBondContact O-N 3.29Å; L214-L218 HydrophobicContact CD1-CD1 3.98Å; L214-L218 HydrophobicContact CD1-CG 4.08Å; L214-L218 HydrophobicContact CG-CD1 3.89Å; L214-L218 HydrophobicContact CG-CG 4.39Å; L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 VanDerWaalsContact O-CG 3.24Å; L214-L218 WeakPolarHBondContact O-CG 3.15Å; L214-L218 PolarHBondContact O-N 3.45Å
215	L	91.5	Very high	90.3	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-45.1	-179.8	-170.2	63.2	0	0	0	112.2	L132 A136 P211 T212 L213 L218 Y219 L313	L132-L215 HydrophobicContact CB-CD1 4.21Å; L132-L215 HydrophobicContact CB-CD2 4.12Å; A136-L215 HydrophobicContact CB-CD1 3.79Å; P211-L215 VanDerWaalsContact O-CB 3.3Å; P211-L215 WeakPolarHBondContact O-CB 3.41Å; P211-L215 PolarHBondContact O-N 2.99Å; T212-L215 PolarHBondContact O-N 3.09Å; L213-L215 VanDerWaalsContact C-N 3.33Å; L213-L215 PolarHBondContact O-N 2.97Å; L215-L218 PolarHBondContact O-N 2.86Å; L215-Y219 WeakPolarHBondContact O-CB 3.38Å; L215-Y219 PolarHBondContact O-N 2.89Å; L215-L313 HydrophobicContact CB-CD1 4.43Å; L215-L313 HydrophobicContact CD2-CD1 3.39Å; L215-L313 HydrophobicContact CG-CD1 3.59Å
216	I	92.4	Very high	89.9	Confident	80 Å²	80	50.2 Å²	50.2	41%	0.41	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.2	-68.9	166.4	0	0	0	110.5	T212 L213 L214 Y219 G220 I317	T212-I216 HydrophobicContact CG2-CD1 3.84Å; T212-I216 HydrophobicContact CG2-CG1 4.43Å; T212-I216 VanDerWaalsContact O-CG1 3.27Å; T212-I216 WeakPolarHBondContact O-CG1 3.32Å; T212-I216 PolarHBondContact O-N 3.01Å; L213-I216 PolarHBondContact O-N 2.98Å; L214-I216 PolarHBondContact O-N 2.9Å; I216-Y219 PolarHBondContact O-N 2.9Å; I216-G220 PolarHBondContact O-N 3.07Å; I216-I317 HydrophobicContact CD1-CD1 4.06Å; I216-I317 HydrophobicContact CG1-CD1 4.01Å
217	C	92.6	Very high	89.7	Confident	73 Å²	73	55.4 Å²	55.4	49%	0.493	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-49.1	178.9	-178.8	0	0	0	0	111.7	L213 L214 Y219 G220 R221	L213-C217 VanDerWaalsContact O-CB 3.32Å; L213-C217 WeakPolarHBondContact O-CB 3.35Å; L213-C217 PolarHBondContact O-N 3.08Å; L214-C217 PolarHBondContact O-N 3.29Å; C217-Y219 VanDerWaalsContact C-N 3.32Å; C217-Y219 PolarHBondContact O-N 2.96Å; C217-G220 PolarHBondContact O-N 2.98Å; C217-R221 VanDerWaalsContact O-CG 3.29Å; C217-R221 WeakPolarHBondContact O-CG 3.3Å; C217-R221 PolarHBondContact O-N 2.97Å
218	L	90	Very high	89.5	Confident	17 Å²	17	59.8 Å²	59.8	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-44.7	177.5	-70.5	172	0	0	0	111.3	A136 L137 L214 L215 R221 I222	A136-L218 HydrophobicContact CB-CB 4.25Å; A136-L218 HydrophobicContact CB-CD1 4.23Å; L137-L218 HydrophobicContact CD2-CD1 3.9Å; L137-L218 HydrophobicContact CD2-CD2 3.5Å; L137-L218 HydrophobicContact CD2-CG 4.36Å; L137-L218 HydrophobicContact CG-CD1 3.68Å; L137-L218 HydrophobicContact CG-CD2 4.23Å; L214-L218 HydrophobicContact CD1-CD1 3.98Å; L214-L218 HydrophobicContact CD1-CG 4.08Å; L214-L218 HydrophobicContact CG-CD1 3.89Å; L214-L218 HydrophobicContact CG-CG 4.39Å; L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 VanDerWaalsContact O-CG 3.24Å; L214-L218 WeakPolarHBondContact O-CG 3.15Å; L214-L218 PolarHBondContact O-N 3.45Å; L215-L218 PolarHBondContact O-N 2.86Å; L218-R221 PolarHBondContact O-N 2.74Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.13Å; L218-I222 PolarHBondContact O-N 3.37Å
219	Y	86.3	Confident	88.9	Confident	50 Å²	50	63.2 Å²	63.2	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-40.5	178.9	-169.9	-99	0	0	0	112.5	L215 I216 C217 R221 I222 Y223 T306 L309 G310 L313	L215-Y219 WeakPolarHBondContact O-CB 3.38Å; L215-Y219 PolarHBondContact O-N 2.89Å; I216-Y219 PolarHBondContact O-N 2.9Å; C217-Y219 VanDerWaalsContact C-N 3.32Å; C217-Y219 PolarHBondContact O-N 2.96Å; Y219-R221 VanDerWaalsContact C-N 3.3Å; Y219-R221 PolarHBondContact O-N 2.89Å; Y219-I222 PolarHBondContact O-N 3.39Å; Y219-Y223 WeakPolarHBondContact O-CB 3.45Å; Y219-Y223 PolarHBondContact O-N 2.91Å; Y219-T306 PolarHBondContact OH-O 2.99Å; Y219-L309 HydrophobicContact CE2-CB 4.07Å; Y219-G310 VanDerWaalsContact CE2-CA 3.44Å; Y219-G310 VanDerWaalsContact CE2-N 3.31Å; Y219-G310 WeakPolarHBondContact OH-CA 3.45Å; Y219-G310 PolarHBondContact OH-N 2.94Å; Y219-L313 HydrophobicContact CD1-CD2 3.69Å; Y219-L313 HydrophobicContact CD2-CD2 4.27Å; Y219-L313 HydrophobicContact CE1-CD2 4.49Å; Y219-L313 HydrophobicContact CG-CD2 3.56Å
220	G	88.8	Confident	88.2	Confident	34 Å²	34	64.5 Å²	64.5	35%	0.351	32%	0.315	S	S	.	.	H	α-helix	trans	-56.8	-44.5	172.3	0	0	0	0	0	111.7	I216 C217 Y223 V224	I216-G220 PolarHBondContact O-N 3.07Å; C217-G220 PolarHBondContact O-N 2.98Å; G220-Y223 PolarHBondContact O-N 2.94Å; G220-V224 VanDerWaalsContact O-CG2 3.29Å; G220-V224 WeakPolarHBondContact O-CG2 3.12Å; G220-V224 PolarHBondContact O-N 2.91Å
221	R	90.2	Very high	87.6	Confident	153 Å²	153	63.7 Å²	63.7	58%	0.577	31%	0.312	S	S	*	.	H	α-helix	trans	-63.4	-45.8	175.1	-68	-74.4	179.1	166.9	-0.8	112.1	Y140 C217 L218 Y219 Y223 V224 E225	Y140-R221 HydrophobicContact CD2-CB 4.19Å; Y140-R221 HydrophobicContact CE2-CB 3.8Å; C217-R221 VanDerWaalsContact O-CG 3.29Å; C217-R221 WeakPolarHBondContact O-CG 3.3Å; C217-R221 PolarHBondContact O-N 2.97Å; L218-R221 PolarHBondContact O-N 2.74Å; Y219-R221 VanDerWaalsContact C-N 3.3Å; Y219-R221 PolarHBondContact O-N 2.89Å; R221-Y223 VanDerWaalsContact C-N 3.35Å; R221-Y223 PolarHBondContact O-N 3.19Å; R221-V224 PolarHBondContact O-N 2.94Å; R221-E225 WeakPolarHBondContact O-CG 3.47Å; R221-E225 PolarHBondContact O-N 3.33Å
222	I	87.8	Confident	87	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-57.1	-48.7	175.3	-71.1	166.1	0	0	0	110.7	A136 R139 Y140 I143 L218 Y219 V224 E225 A226 T306	A136-I222 HydrophobicContact CB-CD1 4.5Å; A136-I222 WeakPolarHBondContact O-CD1 3.26Å; R139-I222 HydrophobicContact CB-CD1 4.42Å; Y140-I222 HydrophobicContact CD2-CG1 3.92Å; Y140-I222 HydrophobicContact CG-CG1 4.36Å; I143-I222 HydrophobicContact CD1-CG2 3.7Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.13Å; L218-I222 PolarHBondContact O-N 3.37Å; Y219-I222 PolarHBondContact O-N 3.39Å; I222-V224 PolarHBondContact O-N 3.29Å; I222-E225 PolarHBondContact O-N 3.08Å; I222-A226 VanDerWaalsContact O-CB 3.26Å; I222-A226 WeakPolarHBondContact O-CB 3.4Å; I222-A226 PolarHBondContact O-N 3.4Å; I222-T306 HydrophobicContact CG2-CG2 3.93Å
223	Y	86.3	Confident	86	Confident	118 Å²	118	73.3 Å²	73.3	46%	0.463	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-45.8	-178.4	177.2	-101.1	0	0	0	111.7	Y219 G220 R221 A226 R227	Y219-Y223 WeakPolarHBondContact O-CB 3.45Å; Y219-Y223 PolarHBondContact O-N 2.91Å; G220-Y223 PolarHBondContact O-N 2.94Å; R221-Y223 VanDerWaalsContact C-N 3.35Å; R221-Y223 PolarHBondContact O-N 3.19Å; Y223-A226 PolarHBondContact O-N 3.49Å; Y223-R227 HydrophobicContact CD1-CG 4.31Å; Y223-R227 HydrophobicContact CD2-CG 4.38Å; Y223-R227 HydrophobicContact CE1-CG 3.91Å; Y223-R227 HydrophobicContact CE2-CG 3.97Å; Y223-R227 WeakPolarHBondContact O-CB 3.45Å; Y223-R227 VanDerWaalsContact O-CG 3.27Å; Y223-R227 WeakPolarHBondContact O-CG 3.28Å; Y223-R227 PolarHBondContact O-N 2.85Å
224	V	88.2	Confident	85	Confident	66 Å²	66	70 Å²	70	40%	0.4	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-47.6	177.4	169.3	0	0	0	0	111	G220 R221 I222 R227 K228	G220-V224 VanDerWaalsContact O-CG2 3.29Å; G220-V224 WeakPolarHBondContact O-CG2 3.12Å; G220-V224 PolarHBondContact O-N 2.91Å; R221-V224 PolarHBondContact O-N 2.94Å; I222-V224 PolarHBondContact O-N 3.29Å; V224-R227 PolarHBondContact O-N 3.22Å; V224-K228 HydrophobicContact CG1-CD 4.15Å; V224-K228 HydrophobicContact CG1-CG 4.48Å; V224-K228 WeakPolarHBondContact O-CG 3.42Å; V224-K228 PolarHBondContact O-N 3.03Å
225	E	86.6	Confident	84	Confident	48 Å²	48	72.3 Å²	72.3	22%	0.224	35%	0.351	C	S	.	.	H	α-helix	trans	-67.8	-38.7	-179.4	-68.8	-54.1	133.3	0	0	112.6	I143 T144 R221 I222 K228 R229	I143-E225 HydrophobicContact CG2-CB 4.46Å; T144-E225 HydrophobicContact CG2-CB 4.4Å; T144-E225 HydrophobicContact CG2-CG 3.98Å; R221-E225 WeakPolarHBondContact O-CG 3.47Å; R221-E225 PolarHBondContact O-N 3.33Å; I222-E225 PolarHBondContact O-N 3.08Å; E225-K228 PolarHBondContact O-N 3.42Å; E225-K228 IonicContact OE1-NZ 2.97Å; E225-K228 PolarHBondContact OE1-NZ 2.98Å; E225-R229 WeakPolarHBondContact O-CG 2.89Å; E225-R229 PolarHBondContact O-N 2.91Å
226	A	81.6	Confident	82.7	Confident	18 Å²	18	77.2 Å²	77.2	15%	0.149	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-44.5	172.9	0	0	0	0	0	111.6	I222 Y223 R229 I230	I222-A226 VanDerWaalsContact O-CB 3.26Å; I222-A226 WeakPolarHBondContact O-CB 3.4Å; I222-A226 PolarHBondContact O-N 3.4Å; Y223-A226 PolarHBondContact O-N 3.49Å; A226-R229 PolarHBondContact O-N 3.42Å; A226-I230 WeakPolarHBondContact O-CG1 3.37Å; A226-I230 PolarHBondContact O-N 3.03Å; A226-I230 VanDerWaalsContact O-N 3.1Å
227	R	83.6	Confident	81.2	Confident	127 Å²	127	79.9 Å²	79.9	48%	0.479	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-46.4	175.9	-77.1	-79.8	-70.9	-175	-3.4	111.5	Y223 V224 R229 I230 L231	Y223-R227 HydrophobicContact CD1-CG 4.31Å; Y223-R227 HydrophobicContact CD2-CG 4.38Å; Y223-R227 HydrophobicContact CE1-CG 3.91Å; Y223-R227 HydrophobicContact CE2-CG 3.97Å; Y223-R227 WeakPolarHBondContact O-CB 3.45Å; Y223-R227 VanDerWaalsContact O-CG 3.27Å; Y223-R227 WeakPolarHBondContact O-CG 3.28Å; Y223-R227 PolarHBondContact O-N 2.85Å; V224-R227 PolarHBondContact O-N 3.22Å; R227-R229 VanDerWaalsContact C-N 3.28Å; R227-R229 PolarHBondContact O-N 3.34Å; R227-I230 PolarHBondContact O-N 3.39Å; R227-I230 VanDerWaalsContact O-N 3.11Å; R227-L231 WeakPolarHBondContact O-CD1 3.44Å; R227-L231 PolarHBondContact O-N 3.13Å
228	K	84.9	Confident	79.4	Confident	102 Å²	102	82.9 Å²	82.9	44%	0.443	39%	0.393	S	S	.	.	H	α-helix	trans	-55.8	-42.2	176.2	-76.2	174.5	-176	170.8	0	111.9	V224 E225 L231 K232	V224-K228 HydrophobicContact CG1-CD 4.15Å; V224-K228 HydrophobicContact CG1-CG 4.48Å; V224-K228 WeakPolarHBondContact O-CG 3.42Å; V224-K228 PolarHBondContact O-N 3.03Å; E225-K228 PolarHBondContact O-N 3.42Å; E225-K228 IonicContact OE1-NZ 2.97Å; E225-K228 PolarHBondContact OE1-NZ 2.98Å; K228-L231 PolarHBondContact O-N 3.12Å; K228-K232 WeakPolarHBondContact O-CB 3.37Å; K228-K232 WeakPolarHBondContact O-CG 3.3Å; K228-K232 PolarHBondContact O-N 2.93Å
229	R	78.4	Confident	77.7	Confident	73 Å²	73	84 Å²	84	28%	0.275	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-42.8	175.9	-72.6	173.8	-177.3	-154.5	-8.8	112.5	I143 T144 E225 A226 R227 K232 Q233	I143-R229 VanDerWaalsContact C-NH2 3.31Å; I143-R229 PolarHBondContact O-NH1 2.84Å; I143-R229 PolarHBondContact O-NH2 3.44Å; T144-R229 PolarHBondContact O-NH2 2.85Å; E225-R229 WeakPolarHBondContact O-CG 2.89Å; E225-R229 PolarHBondContact O-N 2.91Å; A226-R229 PolarHBondContact O-N 3.42Å; R227-R229 VanDerWaalsContact C-N 3.28Å; R227-R229 PolarHBondContact O-N 3.34Å; R229-K232 PolarHBondContact O-N 2.9Å; R229-Q233 WeakPolarHBondContact O-CB 3.27Å; R229-Q233 VanDerWaalsContact O-CG 3.29Å; R229-Q233 WeakPolarHBondContact O-CG 3.38Å; R229-Q233 PolarHBondContact O-N 3.09Å
230	I	76.9	Confident	76	Confident	70 Å²	70	88.6 Å²	88.6	36%	0.359	43%	0.429	S	S	.	.	H	α-helix	trans	-63.5	-45.6	177.5	-65.6	163.7	0	0	0	110.6	A226 R227 Q233 A234	A226-I230 WeakPolarHBondContact O-CG1 3.37Å; A226-I230 PolarHBondContact O-N 3.03Å; A226-I230 VanDerWaalsContact O-N 3.1Å; R227-I230 PolarHBondContact O-N 3.39Å; R227-I230 VanDerWaalsContact O-N 3.11Å; I230-Q233 PolarHBondContact O-N 3.33Å; I230-A234 WeakPolarHBondContact O-CB 3.43Å; I230-A234 PolarHBondContact O-N 3.32Å
231	L	81.3	Confident	73.9	Confident	87 Å²	87	97.3 Å²	97.3	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-62.7	-46.4	177.9	-86.8	79.6	0	0	0	111.8	R227 K228 Q233 A234 Q235	R227-L231 WeakPolarHBondContact O-CD1 3.44Å; R227-L231 PolarHBondContact O-N 3.13Å; K228-L231 PolarHBondContact O-N 3.12Å; L231-Q233 VanDerWaalsContact C-N 3.31Å; L231-Q233 PolarHBondContact O-N 3.32Å; L231-A234 PolarHBondContact O-N 3.41Å; L231-Q235 WeakPolarHBondContact O-CG 3.38Å; L231-Q235 PolarHBondContact O-N 3.06Å
232	K	78.9	Confident	71.8	Confident	142 Å²	142	96.8 Å²	96.8	62%	0.617	46%	0.46	S	S	*	.	H	α-helix	trans	-60.6	-38.8	175.7	-76.7	-175.9	176.9	-175.8	0	112.4	K228 R229 N236	K228-K232 WeakPolarHBondContact O-CB 3.37Å; K228-K232 WeakPolarHBondContact O-CG 3.3Å; K228-K232 PolarHBondContact O-N 2.93Å; R229-K232 PolarHBondContact O-N 2.9Å; K232-N236 WeakPolarHBondContact O-CB 3.31Å; K232-N236 PolarHBondContact O-N 2.78Å
233	Q	73.4	Confident	69.9	Low	77 Å²	77	101.9 Å²	101.9	36%	0.36	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-37.2	175.7	-75.5	-179.1	10	0	0	112.6	R229 I230 L231 K237	R229-Q233 WeakPolarHBondContact O-CB 3.27Å; R229-Q233 VanDerWaalsContact O-CG 3.29Å; R229-Q233 WeakPolarHBondContact O-CG 3.38Å; R229-Q233 PolarHBondContact O-N 3.09Å; I230-Q233 PolarHBondContact O-N 3.33Å; L231-Q233 VanDerWaalsContact C-N 3.31Å; L231-Q233 PolarHBondContact O-N 3.32Å; Q233-K237 PolarHBondContact O-N 3.37Å
234	A	72.1	Confident	67.8	Low	49 Å²	49	101.1 Å²	101.1	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-45.5	174.7	0	0	0	0	0	111.2	I230 L231 N236 K237 Q238	I230-A234 WeakPolarHBondContact O-CB 3.43Å; I230-A234 PolarHBondContact O-N 3.32Å; L231-A234 PolarHBondContact O-N 3.41Å; A234-N236 PolarHBondContact O-N 3.02Å; A234-K237 WeakPolarHBondContact O-CB 3.05Å; A234-K237 PolarHBondContact O-N 3.12Å; A234-Q238 PolarHBondContact O-N 3.29Å
235	Q	71.4	Confident	65.9	Low	125 Å²	125	101.6 Å²	101.6	58%	0.584	51%	0.514	S	S	*	.	H	α-helix	trans	-59.9	-45.2	174.8	-73	174.9	-28.2	0	0	112	L231 K237 Q238 G239	L231-Q235 WeakPolarHBondContact O-CG 3.38Å; L231-Q235 PolarHBondContact O-N 3.06Å; Q235-K237 VanDerWaalsContact C-N 3.3Å; Q235-K237 PolarHBondContact O-N 3.32Å; Q235-Q238 PolarHBondContact O-N 3.04Å; Q235-Q238 VanDerWaalsContact O-N 3.13Å; Q235-G239 PolarHBondContact O-N 3.46Å
236	N	64.1	Low	63.5	Low	112 Å²	112	106.8 Å²	106.8	60%	0.599	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-31.4	176	-81.3	-14.9	0	0	0	113.3	K232 A234 K240	K232-N236 WeakPolarHBondContact O-CB 3.31Å; K232-N236 PolarHBondContact O-N 2.78Å; A234-N236 PolarHBondContact O-N 3.02Å; N236-K240 WeakPolarHBondContact O-CB 3.03Å; N236-K240 WeakPolarHBondContact O-CG 3.39Å; N236-K240 PolarHBondContact O-N 3.02Å; N236-K240 VanDerWaalsContact O-N 3.16Å
237	K	60.9	Low	61.5	Low	136 Å²	136	111.8 Å²	111.8	59%	0.591	56%	0.561	S	S	*	*	H	α-helix	trans	-70.1	-38.5	171.6	-81.7	-177.1	177.3	-178.6	0	111.7	Q233 A234 Q235 R241	Q233-K237 PolarHBondContact O-N 3.37Å; A234-K237 WeakPolarHBondContact O-CB 3.05Å; A234-K237 PolarHBondContact O-N 3.12Å; Q235-K237 VanDerWaalsContact C-N 3.3Å; Q235-K237 PolarHBondContact O-N 3.32Å; K237-R241 WeakPolarHBondContact O-CB 3.28Å; K237-R241 PolarHBondContact O-N 3.07Å; K237-R241 VanDerWaalsContact O-N 3.07Å
238	Q	55.6	Low	59.7	Low	136 Å²	136	113.7 Å²	113.7	64%	0.636	58%	0.579	S	S	*	*	H	α-helix	trans	-69.5	-43.1	178.9	-135.2	159.5	5.8	0	0	111.4	A234 Q235 R241 L242	A234-Q238 PolarHBondContact O-N 3.29Å; Q235-Q238 PolarHBondContact O-N 3.04Å; Q235-Q238 VanDerWaalsContact O-N 3.13Å; Q238-R241 PolarHBondContact O-N 3.26Å; Q238-L242 PolarHBondContact O-N 2.92Å
239	G	54.4	Low	57.5	Low	39 Å²	39	113.5 Å²	113.5	40%	0.402	59%	0.591	S	S	.	*	H	α-helix	trans	-60.7	-43	173.4	0	0	0	0	0	113	Q235 R241 L242 T243	Q235-G239 PolarHBondContact O-N 3.46Å; G239-R241 VanDerWaalsContact C-N 3.33Å; G239-R241 PolarHBondContact O-N 3.22Å; G239-L242 PolarHBondContact O-N 3.3Å; G239-T243 PolarHBondContact O-N 3.49Å; G239-T243 PolarHBondContact O-OG1 3.1Å
240	K	51.5	Low	56.1	Low	148 Å²	148	115.3 Å²	115.3	64%	0.643	61%	0.614	S	S	*	*	H	α-helix	trans	-65.2	-33.3	174.3	-76.6	-175.4	178.8	-163.6	0	113.7	N236 T243 S244	N236-K240 WeakPolarHBondContact O-CB 3.03Å; N236-K240 WeakPolarHBondContact O-CG 3.39Å; N236-K240 PolarHBondContact O-N 3.02Å; N236-K240 VanDerWaalsContact O-N 3.16Å; K240-T243 WeakPolarHBondContact CA-OG1 3.36Å; K240-T243 PolarHBondContact O-OG1 3.49Å; K240-S244 VanDerWaalsContact O-CB 3.27Å; K240-S244 WeakPolarHBondContact O-CB 3.49Å; K240-S244 PolarHBondContact O-N 3.09Å
241	R	44.8	Very low	54.1	Low	216 Å²	216	116.7 Å²	116.7	82%	0.815	63%	0.63	S	S	*	*	H	α-helix	trans	-74.1	-29.6	178	-152.5	174	173.3	-168	-4.1	111.7	K237 Q238 G239	K237-R241 WeakPolarHBondContact O-CB 3.28Å; K237-R241 PolarHBondContact O-N 3.07Å; K237-R241 VanDerWaalsContact O-N 3.07Å; Q238-R241 PolarHBondContact O-N 3.26Å; G239-R241 VanDerWaalsContact C-N 3.33Å; G239-R241 PolarHBondContact O-N 3.22Å
242	L	45.7	Very low	52.5	Low	142 Å²	142	118.8 Å²	118.8	74%	0.743	65%	0.649	S	S	*	*	H	α-helix	trans	-75.7	-42.3	171.1	-118.8	85.6	0	0	0	112.4	Q238 G239 S244 A245	Q238-L242 PolarHBondContact O-N 2.92Å; G239-L242 PolarHBondContact O-N 3.3Å; L242-S244 VanDerWaalsContact C-N 3.32Å; L242-S244 PolarHBondContact O-N 3.13Å; L242-A245 PolarHBondContact O-N 3.32Å
243	T	46.7	Very low	51	Low	109 Å²	109	115.6 Å²	115.6	67%	0.669	66%	0.656	S	S	*	*	H	α-helix	trans	-75.5	-17.1	178.7	50.6	0	0	0	0	114	G239 K240 A245	G239-T243 PolarHBondContact O-N 3.49Å; G239-T243 PolarHBondContact O-OG1 3.1Å; K240-T243 WeakPolarHBondContact CA-OG1 3.36Å; K240-T243 PolarHBondContact O-OG1 3.49Å; T243-A245 PolarHBondContact O-N 3.16Å
244	S	43.5	Very low	49	Very low	102 Å²	102	117.8 Å²	117.8	71%	0.713	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	1.6	174.1	-162.5	0	0	0	0	113.3	K240 L242	K240-S244 VanDerWaalsContact O-CB 3.27Å; K240-S244 WeakPolarHBondContact O-CB 3.49Å; K240-S244 PolarHBondContact O-N 3.09Å; L242-S244 VanDerWaalsContact C-N 3.32Å; L242-S244 PolarHBondContact O-N 3.13Å
245	A	47.7	Very low	47.9	Very low	75 Å²	75	122.5 Å²	122.5	62%	0.62	70%	0.704	S	S	*	*			trans	-103.7	62.6	174	0	0	0	0	0	110.8	L242 T243	L242-A245 PolarHBondContact O-N 3.32Å; T243-A245 PolarHBondContact O-N 3.16Å
246	H	36.9	Very low	46.1	Very low	157 Å²	157	120.9 Å²	120.9	73%	0.727	71%	0.712	S	S	*	*			trans	-162.1	126.2	171.3	-136.5	37.7	0	0	0	108.1
247	L	39.1	Very low	44.9	Very low	124 Å²	124	121.1 Å²	121.1	65%	0.649	72%	0.722	S	S	*	*			cis	-142.4	124.7	-7.8	-88.4	156.8	0	0	0	105.4	S249	L247-S249 VanDerWaalsContact C-N 3.31Å; L247-S249 PolarHBondContact O-N 3.28Å
248	I	45.3	Very low	43.6	Very low	167 Å²	167	121.2 Å²	121.2	86%	0.856	73%	0.734	S	S	*	*			trans	-89.9	84.9	152.7	-58.6	176.1	0	0	0	104.6	S250	I248-S250 PolarHBondContact O-N 2.99Å
249	S	39.8	Very low	42.5	Very low	98 Å²	98	121.5 Å²	121.5	69%	0.685	75%	0.746	S	S	*	*			trans	-79.6	93.7	165	-174.4	0	0	0	0	107	L247 S251	L247-S249 VanDerWaalsContact C-N 3.31Å; L247-S249 PolarHBondContact O-N 3.28Å; S249-S251 PolarHBondContact O-N 3.1Å
250	S	47.4	Very low	41.6	Very low	110 Å²	110	124.3 Å²	124.3	77%	0.769	76%	0.759	S	S	*	*			trans	-80.9	92.5	161.1	52.5	0	0	0	0	107.9	I248	I248-S250 PolarHBondContact O-N 2.99Å
251	S	36.3	Very low	40.6	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	77%	0.773	S	S	*	*			trans	-149.8	126.9	156.1	-135.9	0	0	0	0	110.6	S249 G253	S249-S251 PolarHBondContact O-N 3.1Å; S251-G253 PolarHBondContact O-N 2.87Å
252	P	47.5	Very low	40.1	Very low	132 Å²	132	122.8 Å²	122.8	86%	0.857	77%	0.773	S	S	*	*			trans	-80.3	117.7	179.7	30.8	-29.1	0	0	0	109.8
253	G	46.2	Very low	39.4	Very low	74 Å²	74	127 Å²	127	76%	0.763	78%	0.78	S	S	*	*			trans	110.7	90.4	167	0	0	0	0	0	114.5	S251	S251-G253 PolarHBondContact O-N 2.87Å
254	S	32.6	Very low	38.8	Very low	124 Å²	124	124.2 Å²	124.2	87%	0.867	77%	0.774	S	S	*	*			trans	-164.7	131.9	138.3	-132.1	0	0	0	0	110.8
255	V	48.1	Very low	38.2	Very low	148 Å²	148	126 Å²	126	90%	0.897	78%	0.781	S	S	*	*			trans	-83.8	115.7	179.7	-168.1	0	0	0	0	107.4
256	A	33.7	Very low	37.5	Very low	91 Å²	91	129.6 Å²	129.6	75%	0.752	79%	0.79	S	S	*	*			trans	-157.4	107.3	163.1	0	0	0	0	0	111.6
257	S	38.4	Very low	37.3	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	80%	0.798	S	S	*	*			trans	-11.5	123.7	162	-49.8	0	0	0	0	118.4
258	T	33.7	Very low	36.9	Very low	139 Å²	139	128.4 Å²	128.4	85%	0.853	80%	0.802	S	S	*	*			trans	-114.4	114.5	148.9	44.6	0	0	0	0	108.9	S260	T258-S260 PolarHBondContact O-N 2.92Å
259	T	32.8	Very low	36.2	Very low	142 Å²	142	126.3 Å²	126.3	87%	0.871	80%	0.802	S	S	*	*			trans	-66.3	111.4	179.1	-22.6	0	0	0	0	109.6
260	S	35.7	Very low	35.6	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	81%	0.805	S	S	*	*			trans	-91	120.6	163.1	54.8	0	0	0	0	109.3	T258 N262	T258-S260 PolarHBondContact O-N 2.92Å; S260-N262 PolarHBondContact O-N 3.33Å
261	L	31.4	Very low	34.7	Very low	180 Å²	180	127.5 Å²	127.5	94%	0.942	81%	0.809	S	S	*	*			trans	-61.6	103.8	168.2	-84.3	154.8	0	0	0	109
262	N	34	Very low	34.3	Very low	151 Å²	151	130 Å²	130	81%	0.807	81%	0.814	S	S	*	*			trans	-89.6	117	165.8	-101.8	10.5	0	0	0	108.8	S260	S260-N262 PolarHBondContact O-N 3.33Å
263	Y	31.5	Very low	33.3	Very low	230 Å²	230	129.5 Å²	129.5	90%	0.902	81%	0.809	S	S	*	*			trans	-86	114.7	156.7	-172.7	-92.6	0	0	0	106.7
264	G	33.8	Very low	32.5	Very low	52 Å²	52	131.6 Å²	131.6	54%	0.536	81%	0.807	S	S	.	*			trans	-81.9	153.5	-174.2	0	0	0	0	0	113.5
265	T	31.3	Very low	32.6	Very low	140 Å²	140	130.8 Å²	130.8	86%	0.859	80%	0.801	S	S	*	*			trans	-152.9	124.7	131.9	33.3	0	0	0	0	107.7
266	N	32.8	Very low	31.7	Very low	150 Å²	150	129.1 Å²	129.1	80%	0.802	80%	0.797	S	S	*	*			trans	-63.6	147.6	175.4	-65.7	-27.6	0	0	0	111.1
267	D	31.2	Very low	32	Very low	167 Å²	167	130.7 Å²	130.7	89%	0.893	80%	0.802	S	S	*	*				-168.6	155.4	111.2	-95	-20.4	0	0	0	113.2
268	A	31.9	Very low	31.7	Very low	89 Å²	89	130.4 Å²	130.4	74%	0.736	80%	0.797	S	S	*	*			trans	-67.5	152.4	-158	0	0	0	0	0	117.3
269	S	29.4	Very low	31.8	Very low	122 Å²	122	128.8 Å²	128.8	85%	0.853	79%	0.792	S	S	*	*				164.5	145.7	112.2	52.3	0	0	0	0	112.9
270	S	28.5	Very low	31.9	Very low	108 Å²	108	128.1 Å²	128.1	76%	0.755	79%	0.787	S	S	*	*			trans	-69.3	149.4	179.2	55.4	0	0	0	0	114.3
271	C	27.5	Very low	31.9	Very low	126 Å²	126	128.3 Å²	128.3	85%	0.851	79%	0.788	S	S	*	*				161.1	164.7	111.4	61.2	0	0	0	0	113.1
272	D	27.8	Very low	32.2	Very low	150 Å²	150	128 Å²	128	80%	0.802	78%	0.782	S	S	*	*			trans	-65.4	171.6	-157.1	-73.3	-53.4	0	0	0	120.7
273	T	28.4	Very low	32.4	Very low	122 Å²	122	126.8 Å²	126.8	75%	0.748	78%	0.78	S	S	*	*			trans	98.6	124.1	141	26.2	0	0	0	0	122.3
274	T	28.4	Very low	32.8	Very low	119 Å²	119	124.5 Å²	124.5	73%	0.73	78%	0.775	S	S	*	*			trans	69.3	120	143	48.9	0	0	0	0	121.6
275	S	35.6	Very low	33.2	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	78%	0.775	S	S	*	*			trans	42.1	104.2	141.5	63.2	0	0	0	0	118.6
276	S	27.3	Very low	34.3	Very low	114 Å²	114	124.8 Å²	124.8	80%	0.797	77%	0.766	S	S	*	*				-176.4	129.4	129.5	39.1	0	0	0	0	109.3	P278	S276-P278 WeakPolarHBondContact O-CD 3.17Å
277	S	39.9	Very low	35.3	Very low	123 Å²	123	121.8 Å²	121.8	86%	0.86	75%	0.753	S	S	*	*			trans	-58.6	128.9	166.4	-54.4	0	0	0	0	109.7
278	P	32.8	Very low	36.9	Very low	110 Å²	110	117 Å²	117	71%	0.714	73%	0.732	S	S	*	*			trans	-95.3	112	152	24.3	-8.5	0	0	0	107.2	S276 V280	S276-P278 WeakPolarHBondContact O-CD 3.17Å; P278-V280 PolarHBondContact O-N 3.27Å
279	S	35.3	Very low	38.4	Very low	106 Å²	106	118.1 Å²	118.1	74%	0.741	73%	0.726	S	S	*	*			trans	-52.6	107.4	160.7	42.7	0	0	0	0	108.3	S281	S279-S281 VanDerWaalsContact C-N 3.33Å; S279-S281 PolarHBondContact O-N 3.01Å
280	V	35.7	Very low	40.1	Very low	128 Å²	128	114.7 Å²	114.7	78%	0.776	71%	0.705	S	S	*	*			trans	-63	102.2	169.4	177.3	0	0	0	0	106.4	P278 Q282	P278-V280 PolarHBondContact O-N 3.27Å; V280-Q282 VanDerWaalsContact C-N 3.32Å; V280-Q282 PolarHBondContact O-N 3.15Å
281	S	36.3	Very low	42.1	Very low	101 Å²	101	114.6 Å²	114.6	71%	0.706	70%	0.695	S	S	*	*			trans	-63.1	96.5	170.5	-66	0	0	0	0	107.7	S279 V283	S279-S281 VanDerWaalsContact C-N 3.33Å; S279-S281 PolarHBondContact O-N 3.01Å; S281-V283 VanDerWaalsContact C-N 3.33Å; S281-V283 PolarHBondContact O-N 3.39Å
282	Q	36.5	Very low	44	Very low	173 Å²	173	112.6 Å²	112.6	81%	0.808	68%	0.676	S	S	*	*			trans	-67	95.6	167.7	-80.3	-164.2	-22.1	0	0	108.2	V280 K284	V280-Q282 VanDerWaalsContact C-N 3.32Å; V280-Q282 PolarHBondContact O-N 3.15Å; Q282-K284 PolarHBondContact O-N 3.49Å
283	V	39.1	Very low	45.8	Very low	126 Å²	126	111.3 Å²	111.3	76%	0.764	67%	0.665	S	S	*	*			trans	-71.4	83	162.2	-178.9	0	0	0	0	107.1	S281 V285	S281-V283 VanDerWaalsContact C-N 3.33Å; S281-V283 PolarHBondContact O-N 3.39Å; V283-V285 PolarHBondContact O-N 2.94Å; V283-V285 VanDerWaalsContact O-N 3.1Å
284	K	38.8	Very low	47.6	Very low	182 Å²	182	112.8 Å²	112.8	79%	0.791	66%	0.661	S	S	*	*			trans	-72.3	103	171.4	-165.3	175.8	-176.1	-179.7	0	107.3	Q282 T286	Q282-K284 PolarHBondContact O-N 3.49Å; K284-T286 PolarHBondContact O-N 3.4Å
285	V	43.7	Very low	49.5	Very low	89 Å²	89	113.9 Å²	113.9	54%	0.539	66%	0.656	S	S	.	*			trans	-54.6	95.9	-177	178.3	0	0	0	0	111.1	V283 V287	V283-V285 PolarHBondContact O-N 2.94Å; V283-V285 VanDerWaalsContact O-N 3.1Å; V285-V287 HydrophobicContact CG1-CB 3.65Å; V285-V287 HydrophobicContact CG1-CG2 3.98Å; V285-V287 PolarHBondContact O-N 2.92Å
286	T	53.2	Low	51	Low	110 Å²	110	116.8 Å²	116.8	68%	0.675	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-8.5	170.1	35.8	0	0	0	0	113.1	K284 S288 A290	K284-T286 PolarHBondContact O-N 3.4Å; T286-S288 VanDerWaalsContact C-N 3.31Å; T286-S288 PolarHBondContact O-N 3.48Å; T286-A290 PolarHBondContact O-N 3.11Å
287	V	54.3	Low	52.7	Low	87 Å²	87	115 Å²	115	53%	0.527	63%	0.631	S	S	.	*	H	α-helix	trans	-65	-34.1	178.2	-175.5	0	0	0	0	111.7	V285 L291	V285-V287 HydrophobicContact CG1-CB 3.65Å; V285-V287 HydrophobicContact CG1-CG2 3.98Å; V285-V287 PolarHBondContact O-N 2.92Å; V287-L291 HydrophobicContact CG1-CD1 3.82Å; V287-L291 HydrophobicContact CG1-CG 4.21Å; V287-L291 WeakPolarHBondContact O-CB 3.31Å; V287-L291 WeakPolarHBondContact O-CG 3.31Å; V287-L291 PolarHBondContact O-N 2.93Å
288	S	64	Low	53.8	Low	66 Å²	66	112.2 Å²	112.2	46%	0.462	61%	0.612	S	S	.	*	H	α-helix	trans	-67.1	-40.5	-179.1	-75.3	0	0	0	0	112.8	T286 L291 L292	T286-S288 VanDerWaalsContact C-N 3.31Å; T286-S288 PolarHBondContact O-N 3.48Å; S288-L291 PolarHBondContact O-N 3.45Å; S288-L292 WeakPolarHBondContact O-CB 3.23Å; S288-L292 WeakPolarHBondContact O-CG 3.23Å; S288-L292 PolarHBondContact O-N 3.25Å
289	D	63.3	Low	55.3	Low	112 Å²	112	108.8 Å²	108.8	60%	0.599	59%	0.589	S	S	*	*	H	α-helix	trans	-71	-42.2	-179.8	-69.9	-28.2	0	0	0	111.3	L291 L292 E293	D289-L291 VanDerWaalsContact C-N 3.34Å; D289-L291 PolarHBondContact O-N 3.37Å; D289-L292 PolarHBondContact O-N 3.07Å; D289-E293 VanDerWaalsContact O-CB 3.28Å; D289-E293 WeakPolarHBondContact O-CB 3.03Å; D289-E293 PolarHBondContact O-N 2.95Å
290	A	66.1	Low	56.5	Low	50 Å²	50	106.6 Å²	106.6	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-62.5	-38	174.6	0	0	0	0	0	112.7	T286 K294	T286-A290 PolarHBondContact O-N 3.11Å; A290-K294 WeakPolarHBondContact O-CB 3.46Å; A290-K294 WeakPolarHBondContact O-CG 2.98Å; A290-K294 PolarHBondContact O-N 3.49Å
291	L	70.6	Confident	57.9	Low	106 Å²	106	108.6 Å²	108.6	56%	0.555	57%	0.571	S	S	*	*	H	α-helix	trans	-70.5	-40.3	175	-73.2	174.8	0	0	0	112.3	V287 S288 D289 K295	V287-L291 HydrophobicContact CG1-CD1 3.82Å; V287-L291 HydrophobicContact CG1-CG 4.21Å; V287-L291 WeakPolarHBondContact O-CB 3.31Å; V287-L291 WeakPolarHBondContact O-CG 3.31Å; V287-L291 PolarHBondContact O-N 2.93Å; S288-L291 PolarHBondContact O-N 3.45Å; D289-L291 VanDerWaalsContact C-N 3.34Å; D289-L291 PolarHBondContact O-N 3.37Å; L291-K295 VanDerWaalsContact O-CB 3.28Å; L291-K295 WeakPolarHBondContact O-CB 3.34Å; L291-K295 PolarHBondContact O-N 3.28Å
292	L	66.8	Low	59.3	Low	85 Å²	85	107.6 Å²	107.6	45%	0.445	56%	0.555	S	S	.	*	H	α-helix	trans	-66.5	-38.4	176	-74	171.6	0	0	0	111.7	S288 D289 K295 R296	S288-L292 WeakPolarHBondContact O-CB 3.23Å; S288-L292 WeakPolarHBondContact O-CG 3.23Å; S288-L292 PolarHBondContact O-N 3.25Å; D289-L292 PolarHBondContact O-N 3.07Å; L292-K295 PolarHBondContact O-N 2.95Å; L292-R296 WeakPolarHBondContact O-CG 3.34Å; L292-R296 PolarHBondContact O-N 2.94Å
293	E	65.8	Low	60.7	Low	123 Å²	123	108.1 Å²	108.1	58%	0.575	55%	0.55	S	S	*	.	H	α-helix	trans	-67.3	-48.1	175	-174.2	162.6	-162.4	0	0	111.4	D289 K295 R296 I297	D289-E293 VanDerWaalsContact O-CB 3.28Å; D289-E293 WeakPolarHBondContact O-CB 3.03Å; D289-E293 PolarHBondContact O-N 2.95Å; E293-K295 PolarHBondContact O-N 3.08Å; E293-R296 PolarHBondContact O-N 3.35Å; E293-R296 VanDerWaalsContact O-N 3.09Å; E293-I297 HydrophobicContact CG-CD1 3.99Å; E293-I297 VanDerWaalsContact O-CG1 3.32Å; E293-I297 WeakPolarHBondContact O-CG1 3.15Å; E293-I297 PolarHBondContact O-N 2.98Å
294	K	65.6	Low	62.2	Low	153 Å²	153	106.1 Å²	106.1	67%	0.665	53%	0.531	S	S	*	.	H	α-helix	trans	-54.3	-41.7	170.8	-81.2	-177	176.5	-178.4	0	112	A290 I297 S298	A290-K294 WeakPolarHBondContact O-CB 3.46Å; A290-K294 WeakPolarHBondContact O-CG 2.98Å; A290-K294 PolarHBondContact O-N 3.49Å; K294-I297 PolarHBondContact O-N 3.12Å; K294-S298 WeakPolarHBondContact O-CB 3.29Å; K294-S298 PolarHBondContact O-N 3.37Å
295	K	68.4	Low	63.5	Low	141 Å²	141	99.6 Å²	99.6	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-66.7	-40.5	177.1	-166.6	171.5	-175	171.6	0	112.2	L291 L292 E293 S298 V299	L291-K295 VanDerWaalsContact O-CB 3.28Å; L291-K295 WeakPolarHBondContact O-CB 3.34Å; L291-K295 PolarHBondContact O-N 3.28Å; L292-K295 PolarHBondContact O-N 2.95Å; E293-K295 PolarHBondContact O-N 3.08Å; K295-S298 PolarHBondContact O-N 3.46Å; K295-V299 WeakPolarHBondContact O-CG2 3.41Å; K295-V299 PolarHBondContact O-N 3.35Å; K295-V299 VanDerWaalsContact O-N 3.09Å
296	R	67.1	Low	64.8	Low	167 Å²	167	96.3 Å²	96.3	63%	0.63	49%	0.49	S	S	*	.	H	α-helix	trans	-63.9	-44.1	174.7	-76	177.4	-170.6	-172.5	5.2	111.8	L292 E293 V299 A300	L292-R296 WeakPolarHBondContact O-CG 3.34Å; L292-R296 PolarHBondContact O-N 2.94Å; E293-R296 PolarHBondContact O-N 3.35Å; E293-R296 VanDerWaalsContact O-N 3.09Å; R296-V299 PolarHBondContact O-N 2.88Å; R296-A300 WeakPolarHBondContact O-CB 3.39Å; R296-A300 PolarHBondContact O-N 3.48Å
297	I	62.5	Low	66	Low	77 Å²	77	98.1 Å²	98.1	40%	0.395	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-43.7	177.5	-66.5	166.4	0	0	0	110.4	E293 K294 V299 A300 R301	E293-I297 HydrophobicContact CG-CD1 3.99Å; E293-I297 VanDerWaalsContact O-CG1 3.32Å; E293-I297 WeakPolarHBondContact O-CG1 3.15Å; E293-I297 PolarHBondContact O-N 2.98Å; K294-I297 PolarHBondContact O-N 3.12Å; I297-V299 PolarHBondContact O-N 3.01Å; I297-A300 PolarHBondContact O-N 2.98Å; I297-R301 WeakPolarHBondContact O-CG 3.37Å; I297-R301 PolarHBondContact O-N 3.06Å
298	S	64.8	Low	67.2	Low	65 Å²	65	94.8 Å²	94.8	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-45.6	176.2	-170.8	0	0	0	0	112.3	K294 K295 R301 E302	K294-S298 WeakPolarHBondContact O-CB 3.29Å; K294-S298 PolarHBondContact O-N 3.37Å; K295-S298 PolarHBondContact O-N 3.46Å; S298-R301 PolarHBondContact O-N 2.02Å; S298-E302 PolarHBondContact O-N 3.41Å
299	V	63.5	Low	67.8	Low	37 Å²	37	93 Å²	93	22%	0.224	45%	0.454	C	S	.	.	H	α-helix	trans	-66.6	-38.7	178.4	171.7	0	0	0	0	111.7	K295 R296 I297 E302 R303	K295-V299 WeakPolarHBondContact O-CG2 3.41Å; K295-V299 PolarHBondContact O-N 3.35Å; K295-V299 VanDerWaalsContact O-N 3.09Å; R296-V299 PolarHBondContact O-N 2.88Å; I297-V299 PolarHBondContact O-N 3.01Å; V299-E302 PolarHBondContact O-N 3.4Å; V299-R303 PolarHBondContact O-N 2.88Å
300	A	61	Low	68.8	Low	61 Å²	61	88.5 Å²	88.5	50%	0.504	43%	0.434	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175.6	0	0	0	0	0	111.8	R296 I297 R303 K304	R296-A300 WeakPolarHBondContact O-CB 3.39Å; R296-A300 PolarHBondContact O-N 3.48Å; I297-A300 PolarHBondContact O-N 2.98Å; A300-R303 PolarHBondContact O-N 3.36Å; A300-K304 PolarHBondContact O-N 3.5Å
301	R	64.1	Low	69.8	Low	169 Å²	169	90.1 Å²	90.1	64%	0.638	44%	0.435	S	S	*	.	H	α-helix	trans	-63.4	-42.7	174.3	-74.4	178.9	178.7	-173.8	-1.4	112.2	I297 S298 R303 K304 A305	I297-R301 WeakPolarHBondContact O-CG 3.37Å; I297-R301 PolarHBondContact O-N 3.06Å; S298-R301 PolarHBondContact O-N 2.02Å; R301-R303 VanDerWaalsContact C-N 3.32Å; R301-R303 PolarHBondContact O-N 3.47Å; R301-K304 PolarHBondContact O-N 2.88Å; R301-A305 PolarHBondContact O-N 2.9Å
302	E	66.1	Low	70.6	Confident	80 Å²	80	85.4 Å²	85.4	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-60.4	-39.9	174.4	-80.2	-174	150.3	0	0	112.6	S298 V299 A305 T306	S298-E302 PolarHBondContact O-N 3.41Å; V299-E302 PolarHBondContact O-N 3.4Å; E302-A305 PolarHBondContact O-N 3.46Å; E302-T306 PolarHBondContact O-N 3.21Å; E302-T306 PolarHBondContact O-OG1 2.82Å
303	R	66.8	Low	71.5	Confident	185 Å²	185	82.2 Å²	82.2	70%	0.698	39%	0.394	S	S	*	.	H	α-helix	trans	-66.8	-41.7	177.8	-168.4	179.5	-178	-148.3	0.4	112	V299 A300 R301 T306 K307	V299-R303 PolarHBondContact O-N 2.88Å; A300-R303 PolarHBondContact O-N 3.36Å; R301-R303 VanDerWaalsContact C-N 3.32Å; R301-R303 PolarHBondContact O-N 3.47Å; R303-T306 PolarHBondContact O-N 3.32Å; R303-K307 PolarHBondContact O-N 3.34Å; R303-K307 VanDerWaalsContact O-N 3.13Å
304	K	68.8	Low	72.6	Confident	84 Å²	84	77.9 Å²	77.9	37%	0.365	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-46.5	175.5	-169.2	179.5	-179.4	-173.1	0	110.5	A300 R301 T306 K307 T308 S363 E365	A300-K304 PolarHBondContact O-N 3.5Å; R301-K304 PolarHBondContact O-N 2.88Å; K304-T306 PolarHBondContact O-N 2.86Å; K304-K307 PolarHBondContact O-N 3.33Å; K304-T308 PolarHBondContact O-N 2.72Å; K304-T308 PolarHBondContact O-OG1 2.02Å; K304-S363 VanDerWaalsContact CE-O 3.31Å; K304-S363 WeakPolarHBondContact CE-O 3.23Å; K304-E365 IonicContact NZ-OE1 2.76Å; K304-E365 PolarHBondContact NZ-OE1 3.22Å
305	A	66.5	Low	73.9	Confident	45 Å²	45	71.5 Å²	71.5	37%	0.372	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-42.8	178	0	0	0	0	0	112.9	R301 E302 K307 T308 L309	R301-A305 PolarHBondContact O-N 2.9Å; E302-A305 PolarHBondContact O-N 3.46Å; A305-K307 PolarHBondContact O-N 3.08Å; A305-T308 PolarHBondContact O-N 3.47Å; A305-L309 WeakPolarHBondContact O-CG 3.47Å; A305-L309 PolarHBondContact O-N 3.27Å; A305-L309 VanDerWaalsContact O-N 3.1Å
306	T	72.4	Confident	75	Confident	19 Å²	19	64.9 Å²	64.9	12%	0.117	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-41	177.8	-53.2	0	0	0	0	111.9	Y219 I222 E302 R303 K304 T308 L309 G310	Y219-T306 PolarHBondContact OH-O 2.99Å; I222-T306 HydrophobicContact CG2-CG2 3.93Å; E302-T306 PolarHBondContact O-N 3.21Å; E302-T306 PolarHBondContact O-OG1 2.82Å; R303-T306 PolarHBondContact O-N 3.32Å; K304-T306 PolarHBondContact O-N 2.86Å; T306-T308 VanDerWaalsContact C-N 3.35Å; T306-T308 PolarHBondContact O-N 3.46Å; T306-L309 PolarHBondContact O-N 3.17Å; T306-G310 PolarHBondContact O-N 3.39Å
307	K	78.2	Confident	76.2	Confident	148 Å²	148	58.9 Å²	58.9	64%	0.643	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-45	175.6	-177.1	-178.1	177.9	-176.1	0	111.3	R303 K304 A305 L309 G310 I311	R303-K307 PolarHBondContact O-N 3.34Å; R303-K307 VanDerWaalsContact O-N 3.13Å; K304-K307 PolarHBondContact O-N 3.33Å; A305-K307 PolarHBondContact O-N 3.08Å; K307-L309 PolarHBondContact O-N 3.17Å; K307-G310 PolarHBondContact O-N 2.96Å; K307-I311 HydrophobicContact CG-CD1 4.23Å; K307-I311 WeakPolarHBondContact O-CG1 3.31Å; K307-I311 PolarHBondContact O-N 3.05Å; K307-I311 VanDerWaalsContact O-N 3.08Å
308	T	78.9	Confident	77.8	Confident	18 Å²	18	59.9 Å²	59.9	11%	0.11	32%	0.318	C	S	.	.	H	α-helix	trans	-59.1	-45.2	177.7	-63.1	0	0	0	0	112	K304 A305 T306 G310 I311 I312 I359 S363	K304-T308 PolarHBondContact O-N 2.72Å; K304-T308 PolarHBondContact O-OG1 2.02Å; A305-T308 PolarHBondContact O-N 3.47Å; T306-T308 VanDerWaalsContact C-N 3.35Å; T306-T308 PolarHBondContact O-N 3.46Å; T308-G310 VanDerWaalsContact C-N 3.26Å; T308-G310 PolarHBondContact O-N 2.79Å; T308-I311 WeakPolarHBondContact O-CB 3.19Å; T308-I311 PolarHBondContact O-N 2.9Å; T308-I311 VanDerWaalsContact O-N 3.09Å; T308-I312 HydrophobicContact CG2-CD1 4.02Å; T308-I312 HydrophobicContact CG2-CG1 4.5Å; T308-I312 WeakPolarHBondContact O-CG1 3.35Å; T308-I312 PolarHBondContact O-N 2.93Å; T308-I359 HydrophobicContact CG2-CG2 3.77Å; T308-S363 VanDerWaalsContact CG2-OG 3.31Å; T308-S363 WeakPolarHBondContact CG2-OG 3.44Å; T308-S363 WeakPolarHBondContact OG1-CB 3.42Å
309	L	77.3	Confident	79.3	Confident	29 Å²	29	57 Å²	57	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-38.1	177.1	-66.3	166.4	0	0	0	112.2	I135 R139 Y219 A305 T306 K307 I312 L313	I135-L309 HydrophobicContact CG2-CD2 3.83Å; R139-L309 HydrophobicContact CB-CD1 3.8Å; R139-L309 HydrophobicContact CG-CD1 3.57Å; R139-L309 HydrophobicContact CG-CD2 4.21Å; Y219-L309 HydrophobicContact CE2-CB 4.07Å; A305-L309 WeakPolarHBondContact O-CG 3.47Å; A305-L309 PolarHBondContact O-N 3.27Å; A305-L309 VanDerWaalsContact O-N 3.1Å; T306-L309 PolarHBondContact O-N 3.17Å; K307-L309 PolarHBondContact O-N 3.17Å; L309-I312 PolarHBondContact O-N 3.12Å; L309-L313 WeakPolarHBondContact O-CB 3.29Å; L309-L313 PolarHBondContact O-N 3.36Å
310	G	83.4	Confident	80.7	Confident	17 Å²	17	55.8 Å²	55.8	18%	0.175	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-36.1	174.5	0	0	0	0	0	113.9	Y219 T306 K307 T308 G314	Y219-G310 VanDerWaalsContact CE2-CA 3.44Å; Y219-G310 VanDerWaalsContact CE2-N 3.31Å; Y219-G310 WeakPolarHBondContact OH-CA 3.45Å; Y219-G310 PolarHBondContact OH-N 2.94Å; T306-G310 PolarHBondContact O-N 3.39Å; K307-G310 PolarHBondContact O-N 2.96Å; T308-G310 VanDerWaalsContact C-N 3.26Å; T308-G310 PolarHBondContact O-N 2.79Å; G310-G314 PolarHBondContact O-N 2.9Å
311	I	87.4	Confident	82.3	Confident	83 Å²	83	55.8 Å²	55.8	43%	0.426	28%	0.281	S	S	.	.	H	α-helix	trans	-67.2	-44.5	175.3	-65.1	167	0	0	0	110.2	K307 T308 L313 G314 A315 I359	K307-I311 HydrophobicContact CG-CD1 4.23Å; K307-I311 WeakPolarHBondContact O-CG1 3.31Å; K307-I311 PolarHBondContact O-N 3.05Å; K307-I311 VanDerWaalsContact O-N 3.08Å; T308-I311 WeakPolarHBondContact O-CB 3.19Å; T308-I311 PolarHBondContact O-N 2.9Å; T308-I311 VanDerWaalsContact O-N 3.09Å; I311-L313 VanDerWaalsContact C-N 3.33Å; I311-L313 PolarHBondContact O-N 3.13Å; I311-G314 PolarHBondContact O-N 3.12Å; I311-A315 WeakPolarHBondContact O-CB 3.36Å; I311-A315 PolarHBondContact O-N 2.74Å; I311-I359 HydrophobicContact CG2-CD1 3.94Å; I311-I359 HydrophobicContact CG2-CG1 4.19Å; I311-I359 HydrophobicContact CG2-CG2 4.43Å
312	I	86.8	Confident	83.7	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-45.5	177.2	-62.1	168.1	0	0	0	110.4	L132 T308 L309 A315 Y316 I359 Y360	L132-I312 HydrophobicContact CD1-CG2 4.38Å; L132-I312 HydrophobicContact CD2-CG2 3.35Å; T308-I312 HydrophobicContact CG2-CD1 4.02Å; T308-I312 HydrophobicContact CG2-CG1 4.5Å; T308-I312 WeakPolarHBondContact O-CG1 3.35Å; T308-I312 PolarHBondContact O-N 2.93Å; L309-I312 PolarHBondContact O-N 3.12Å; I312-A315 PolarHBondContact O-N 3.31Å; I312-Y316 PolarHBondContact O-N 3.34Å; I312-I359 HydrophobicContact CB-CD1 4.49Å; I312-I359 HydrophobicContact CD1-CG2 4.06Å; I312-I359 HydrophobicContact CG1-CB 4.15Å; I312-I359 HydrophobicContact CG1-CD1 3.94Å; I312-I359 HydrophobicContact CG1-CG2 3.5Å; I312-Y360 HydrophobicContact CD1-CD1 4.26Å; I312-Y360 HydrophobicContact CD1-CE1 3.56Å
313	L	85.6	Confident	85	Confident	19 Å²	19	47.1 Å²	47.1	10%	0.099	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-50.4	175.2	172	58.2	0	0	0	112.4	L215 Y219 L309 I311 A315 Y316 I317	L215-L313 HydrophobicContact CB-CD1 4.43Å; L215-L313 HydrophobicContact CD2-CD1 3.39Å; L215-L313 HydrophobicContact CG-CD1 3.59Å; Y219-L313 HydrophobicContact CD1-CD2 3.69Å; Y219-L313 HydrophobicContact CD2-CD2 4.27Å; Y219-L313 HydrophobicContact CE1-CD2 4.49Å; Y219-L313 HydrophobicContact CG-CD2 3.56Å; L309-L313 WeakPolarHBondContact O-CB 3.29Å; L309-L313 PolarHBondContact O-N 3.36Å; I311-L313 VanDerWaalsContact C-N 3.33Å; I311-L313 PolarHBondContact O-N 3.13Å; L313-A315 VanDerWaalsContact C-N 3.32Å; L313-A315 PolarHBondContact O-N 2.88Å; L313-Y316 PolarHBondContact O-N 2.86Å; L313-I317 HydrophobicContact CD1-CD1 3.69Å; L313-I317 HydrophobicContact CD1-CG1 4.13Å; L313-I317 HydrophobicContact CG-CD1 4.11Å; L313-I317 PolarHBondContact O-N 3.48Å; L313-I317 VanDerWaalsContact O-N 3.09Å
314	G	88.9	Confident	86.1	Confident	32 Å²	32	39.2 Å²	39.2	33%	0.33	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-42.7	-179.3	0	0	0	0	0	111.9	G310 I311 I317 V318	G310-G314 PolarHBondContact O-N 2.9Å; I311-G314 PolarHBondContact O-N 3.12Å; G314-I317 PolarHBondContact O-N 2.69Å; G314-V318 WeakPolarHBondContact O-CB 3.46Å; G314-V318 VanDerWaalsContact O-CG2 3.26Å; G314-V318 WeakPolarHBondContact O-CG2 3.46Å; G314-V318 PolarHBondContact O-N 2.93Å
315	A	92.8	Very high	87.1	Confident	18 Å²	18	39 Å²	39	15%	0.149	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-47.9	175.8	0	0	0	0	0	111.4	I311 I312 L313 I317 V318 C319 I355 I359	I311-A315 WeakPolarHBondContact O-CB 3.36Å; I311-A315 PolarHBondContact O-N 2.74Å; I312-A315 PolarHBondContact O-N 3.31Å; L313-A315 VanDerWaalsContact C-N 3.32Å; L313-A315 PolarHBondContact O-N 2.88Å; A315-I317 PolarHBondContact O-N 3.31Å; A315-V318 PolarHBondContact O-N 3.34Å; A315-C319 WeakPolarHBondContact O-CB 3.48Å; A315-C319 PolarHBondContact O-N 3.43Å; A315-C319 PolarHBondContact O-SG 3.1Å; A315-I355 HydrophobicContact CB-CG2 3.88Å; A315-I359 HydrophobicContact CB-CD1 4.16Å
316	Y	92.4	Very high	88.1	Confident	3 Å²	3	38 Å²	38	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-50	178.2	179.7	-87.1	0	0	0	112.5	I129 L132 F208 I312 L313 V318 C319 W320 N352	I129-Y316 HydrophobicContact CB-CE1 4.35Å; I129-Y316 HydrophobicContact CB-CE2 3.85Å; I129-Y316 WeakPolarHBondContact CB-OH 3.23Å; I129-Y316 HydrophobicContact CD1-CD1 4.35Å; I129-Y316 HydrophobicContact CD1-CE1 3.46Å; I129-Y316 VanDerWaalsContact CD1-CE1 3.46Å; I129-Y316 WeakPolarHBondContact CD1-OH 3.39Å; I129-Y316 HydrophobicContact CG1-CE1 4.03Å; I129-Y316 HydrophobicContact CG1-CE2 4.35Å; L132-Y316 HydrophobicContact CD1-CD2 3.76Å; L132-Y316 HydrophobicContact CD1-CG 3.97Å; F208-Y316 HydrophobicContact CD2-CE1 4.02Å; F208-Y316 WeakPolarHBondContact CD2-OH 3.46Å; F208-Y316 AromaticContact CE2-CE1 3.63Å; F208-Y316 HydrophobicContact CE2-CE1 3.63Å; I312-Y316 PolarHBondContact O-N 3.34Å; L313-Y316 PolarHBondContact O-N 2.86Å; Y316-V318 PolarHBondContact O-N 3.26Å; Y316-C319 PolarHBondContact O-N 3.49Å; Y316-W320 AromaticContact CD2-CD1 3.65Å; Y316-W320 HydrophobicContact CE1-CB 4.27Å; Y316-W320 AromaticContact CE2-CD1 3.31Å; Y316-W320 HydrophobicContact CE2-CG 4.06Å; Y316-W320 AromaticContact CE2-NE1 3.75Å; Y316-W320 AromaticContact CZ-CD1 3.67Å; Y316-W320 AromaticContact CZ-CG 3.97Å; Y316-W320 PolarHBondContact O-N 2.97Å; Y316-N352 VanDerWaalsContact CA-OD1 3.28Å; Y316-N352 WeakPolarHBondContact CA-OD1 3.2Å
317	I	92.3	Very high	88.7	Confident	40 Å²	40	38.6 Å²	38.6	21%	0.205	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-45.9	-179.1	-66.6	172.4	0	0	0	110.5	T212 I216 L313 G314 A315 C319 W320 L321	T212-I317 HydrophobicContact CG2-CG1 4.3Å; I216-I317 HydrophobicContact CD1-CD1 4.06Å; I216-I317 HydrophobicContact CG1-CD1 4.01Å; L313-I317 HydrophobicContact CD1-CD1 3.69Å; L313-I317 HydrophobicContact CD1-CG1 4.13Å; L313-I317 HydrophobicContact CG-CD1 4.11Å; L313-I317 PolarHBondContact O-N 3.48Å; L313-I317 VanDerWaalsContact O-N 3.09Å; G314-I317 PolarHBondContact O-N 2.69Å; A315-I317 PolarHBondContact O-N 3.31Å; I317-C319 VanDerWaalsContact C-N 3.26Å; I317-C319 PolarHBondContact O-N 3.03Å; I317-W320 PolarHBondContact O-N 2.98Å; I317-L321 HydrophobicContact CG2-CB 4.12Å; I317-L321 HydrophobicContact CG2-CD2 3.96Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 PolarHBondContact O-N 3.36Å
318	V	95.3	Very high	89	Confident	98 Å²	98	34.7 Å²	34.7	59%	0.594	20%	0.199	S	C	*	.	H	α-helix	trans	-62.3	-36.2	179.6	169.7	0	0	0	0	111.5	G314 A315 Y316 P322	G314-V318 WeakPolarHBondContact O-CB 3.46Å; G314-V318 VanDerWaalsContact O-CG2 3.26Å; G314-V318 WeakPolarHBondContact O-CG2 3.46Å; G314-V318 PolarHBondContact O-N 2.93Å; A315-V318 PolarHBondContact O-N 3.34Å; Y316-V318 PolarHBondContact O-N 3.26Å; V318-P322 VanDerWaalsContact O-CD 3.31Å; V318-P322 WeakPolarHBondContact O-CD 3.36Å
319	C	96	Very high	89.3	Confident	4 Å²	4	37.2 Å²	37.2	3%	0.027	21%	0.211	C	C	.	.	H	α-helix	trans	-73.4	-45.1	-179.4	-67.2	0	0	0	0	112.6	A315 Y316 I317 L348 G349 N352	A315-C319 WeakPolarHBondContact O-CB 3.48Å; A315-C319 PolarHBondContact O-N 3.43Å; A315-C319 PolarHBondContact O-SG 3.1Å; Y316-C319 PolarHBondContact O-N 3.49Å; I317-C319 VanDerWaalsContact C-N 3.26Å; I317-C319 PolarHBondContact O-N 3.03Å; C319-L348 VanDerWaalsContact CB-O 3.3Å; C319-L348 WeakPolarHBondContact CB-O 3.44Å; C319-G349 PolarHBondContact O-N 2.98Å; C319-N352 HydrophobicContact CB-CB 3.88Å
320	W	94.5	Very high	89.6	Confident	13 Å²	13	37.9 Å²	37.9	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-98.1	-31.4	-169	-79.4	102.2	0	0	0	114.9	C125 F208 Y316 I317 P322 F323 F324 G349 Y350	C125-W320 HydrophobicContact CB-CH2 3.99Å; C125-W320 HydrophobicContact CB-CZ2 4.05Å; C125-W320 WeakPolarHBondContact SG-CH2 3.42Å; C125-W320 WeakPolarHBondContact SG-CZ2 3.14Å; F208-W320 HydrophobicContact CD2-CB 4.2Å; F208-W320 HydrophobicContact CE2-CB 3.56Å; F208-W320 HydrophobicContact CZ-CB 4.35Å; Y316-W320 AromaticContact CD2-CD1 3.65Å; Y316-W320 HydrophobicContact CE1-CB 4.27Å; Y316-W320 AromaticContact CE2-CD1 3.31Å; Y316-W320 HydrophobicContact CE2-CG 4.06Å; Y316-W320 AromaticContact CE2-NE1 3.75Å; Y316-W320 AromaticContact CZ-CD1 3.67Å; Y316-W320 AromaticContact CZ-CG 3.97Å; Y316-W320 PolarHBondContact O-N 2.97Å; I317-W320 PolarHBondContact O-N 2.98Å; W320-P322 VanDerWaalsContact C-CD 3.45Å; W320-F323 HydrophobicContact CE3-CD1 4.26Å; W320-F323 HydrophobicContact CZ3-CD1 4.19Å; W320-F323 WeakPolarHBondContact O-CB 3.22Å; W320-F323 PolarHBondContact O-N 2.97Å; W320-F323 VanDerWaalsContact O-N 3.17Å; W320-F324 HydrophobicContact CB-CD2 4.18Å; W320-F324 HydrophobicContact CB-CE2 4.13Å; W320-F324 HydrophobicContact CD2-CE2 4.14Å; W320-F324 HydrophobicContact CE3-CD2 4.22Å; W320-F324 AromaticContact CE3-CE2 3.47Å; W320-F324 HydrophobicContact CE3-CE2 3.47Å; W320-F324 VanDerWaalsContact CE3-CE2 3.47Å; W320-F324 HydrophobicContact CE3-CZ 4.2Å; W320-F324 HydrophobicContact CG-CE2 4.45Å; W320-F324 HydrophobicContact CZ3-CE2 4.22Å; W320-F324 VanDerWaalsContact O-CD2 3.27Å; W320-F324 WeakPolarHBondContact O-CD2 3.29Å; W320-F324 PolarHBondContact O-N 3.35Å; W320-F324 VanDerWaalsContact O-N 3.17Å; W320-G349 PolarHBondContact NE1-O 3.05Å; W320-Y350 HydrophobicContact CH2-CD1 4.23Å; W320-Y350 HydrophobicContact CH2-CE1 4.21Å; W320-Y350 HydrophobicContact CZ2-CD1 4.38Å
321	L	93.4	Very high	89.5	Confident	61 Å²	61	40.9 Å²	40.9	32%	0.319	23%	0.233	S	C	.	.	H	α-helix	trans	-57.5	-41	-176	-175.1	65.3	0	0	0	113.6	F208 I317 F323 F324 I325	F208-L321 HydrophobicContact CE1-CD1 3.88Å; F208-L321 HydrophobicContact CZ-CB 4.18Å; F208-L321 HydrophobicContact CZ-CD1 3.97Å; I317-L321 HydrophobicContact CG2-CB 4.12Å; I317-L321 HydrophobicContact CG2-CD2 3.96Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 PolarHBondContact O-N 3.36Å; L321-F323 VanDerWaalsContact C-N 3.32Å; L321-F323 PolarHBondContact O-N 3.15Å; L321-F324 PolarHBondContact O-N 2.92Å; L321-I325 HydrophobicContact CD1-CD1 4.04Å; L321-I325 HydrophobicContact CD1-CG1 4.12Å; L321-I325 HydrophobicContact CD2-CD1 4.29Å; L321-I325 HydrophobicContact CG-CD1 3.73Å; L321-I325 HydrophobicContact CG-CG1 4.24Å; L321-I325 VanDerWaalsContact O-CG1 3.31Å; L321-I325 WeakPolarHBondContact O-CG1 3.35Å; L321-I325 PolarHBondContact O-N 3.47Å
322	P	94.8	Very high	89.4	Confident	36 Å²	36	43.8 Å²	43.8	23%	0.234	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-42.3	177.5	-25.2	36.1	0	0	0	113	V318 W320 Y326 F345 L348	V318-P322 VanDerWaalsContact O-CD 3.31Å; V318-P322 WeakPolarHBondContact O-CD 3.36Å; W320-P322 VanDerWaalsContact C-CD 3.45Å; P322-Y326 WeakPolarHBondContact O-CB 3.41Å; P322-Y326 PolarHBondContact O-N 2.94Å; P322-F345 HydrophobicContact CB-CD1 3.69Å; P322-F345 HydrophobicContact CB-CD2 4.49Å; P322-F345 HydrophobicContact CB-CE1 3.89Å; P322-F345 HydrophobicContact CB-CG 4.03Å; P322-F345 HydrophobicContact CB-CZ 4.36Å; P322-L348 HydrophobicContact CG-CD2 4.12Å
323	F	92.1	Very high	89.1	Confident	30 Å²	30	45.2 Å²	45.2	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-50.3	177.3	176.9	-98.3	0	0	0	111.2	W320 L321 I325 Y326 T327 F342 F345 T346	W320-F323 HydrophobicContact CE3-CD1 4.26Å; W320-F323 HydrophobicContact CZ3-CD1 4.19Å; W320-F323 WeakPolarHBondContact O-CB 3.22Å; W320-F323 PolarHBondContact O-N 2.97Å; W320-F323 VanDerWaalsContact O-N 3.17Å; L321-F323 VanDerWaalsContact C-N 3.32Å; L321-F323 PolarHBondContact O-N 3.15Å; F323-I325 VanDerWaalsContact C-N 3.35Å; F323-I325 PolarHBondContact O-N 3.4Å; F323-Y326 WeakPolarHBondContact O-CB 3.49Å; F323-Y326 PolarHBondContact O-N 3.45Å; F323-Y326 VanDerWaalsContact O-N 3.12Å; F323-T327 HydrophobicContact CD1-CG2 4.11Å; F323-T327 HydrophobicContact CD2-CG2 4.41Å; F323-T327 HydrophobicContact CE1-CG2 3.69Å; F323-T327 HydrophobicContact CE2-CG2 4.01Å; F323-T327 HydrophobicContact CG-CG2 4.46Å; F323-T327 HydrophobicContact CZ-CG2 3.63Å; F323-T327 WeakPolarHBondContact O-CG2 3.27Å; F323-T327 PolarHBondContact O-N 3.45Å; F323-T327 PolarHBondContact O-OG1 3.44Å; F323-F342 HydrophobicContact CE2-CD2 4.1Å; F323-F342 AromaticContact CE2-CE2 3.67Å; F323-F342 HydrophobicContact CE2-CE2 3.67Å; F323-F342 HydrophobicContact CE2-CZ 4.24Å; F323-F342 HydrophobicContact CZ-CE2 4.19Å; F323-F345 HydrophobicContact CB-CB 3.9Å; F323-F345 HydrophobicContact CD2-CB 4.24Å; F323-T346 VanDerWaalsContact CE2-OG1 3.26Å; F323-T346 WeakPolarHBondContact CE2-OG1 3.47Å
324	F	90.3	Very high	88.7	Confident	20 Å²	20	52.3 Å²	52.3	9%	0.088	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-37.8	-178	-75.9	-74.1	0	0	0	112.5	F208 Y209 W320 L321 T327 L328	F208-F324 HydrophobicContact CB-CD1 3.73Å; F208-F324 HydrophobicContact CB-CD2 3.74Å; F208-F324 HydrophobicContact CB-CE1 3.5Å; F208-F324 VanDerWaalsContact CB-CE1 3.5Å; F208-F324 HydrophobicContact CB-CE2 3.51Å; F208-F324 HydrophobicContact CB-CG 3.86Å; F208-F324 HydrophobicContact CB-CZ 3.4Å; F208-F324 HydrophobicContact CD1-CB 3.62Å; F208-F324 AromaticContact CD1-CD1 3.99Å; F208-F324 HydrophobicContact CD1-CD1 3.99Å; F208-F324 AromaticContact CD1-CD2 3.43Å; F208-F324 HydrophobicContact CD1-CD2 3.43Å; F208-F324 VanDerWaalsContact CD1-CD2 3.43Å; F208-F324 HydrophobicContact CD1-CE2 4.09Å; F208-F324 AromaticContact CD1-CG 3.38Å; F208-F324 HydrophobicContact CD1-CG 3.38Å; F208-F324 AromaticContact CD2-CD2 3.21Å; F208-F324 HydrophobicContact CD2-CD2 3.21Å; F208-F324 AromaticContact CD2-CE2 3.18Å; F208-F324 HydrophobicContact CD2-CE2 3.18Å; F208-F324 HydrophobicContact CD2-CG 4.04Å; F208-F324 HydrophobicContact CD2-CZ 4Å; F208-F324 HydrophobicContact CE1-CB 3.71Å; F208-F324 AromaticContact CE1-CD2 3.73Å; F208-F324 HydrophobicContact CE1-CD2 3.73Å; F208-F324 AromaticContact CE1-CG 3.85Å; F208-F324 HydrophobicContact CE1-CG 3.85Å; F208-F324 AromaticContact CE2-CD2 3.52Å; F208-F324 HydrophobicContact CE2-CD2 3.52Å; F208-F324 AromaticContact CE2-CE2 3.85Å; F208-F324 HydrophobicContact CE2-CE2 3.85Å; F208-F324 HydrophobicContact CE2-CG 4.44Å; F208-F324 HydrophobicContact CG-CB 4.24Å; F208-F324 AromaticContact CG-CD1 3.91Å; F208-F324 HydrophobicContact CG-CD1 3.91Å; F208-F324 AromaticContact CG-CD2 3.15Å; F208-F324 HydrophobicContact CG-CD2 3.15Å; F208-F324 HydrophobicContact CG-CE1 4.05Å; F208-F324 AromaticContact CG-CE2 3.32Å; F208-F324 HydrophobicContact CG-CE2 3.32Å; F208-F324 AromaticContact CG-CG 3.48Å; F208-F324 HydrophobicContact CG-CG 3.48Å; F208-F324 VanDerWaalsContact CG-CG 3.48Å; F208-F324 AromaticContact CG-CZ 3.79Å; F208-F324 HydrophobicContact CG-CZ 3.79Å; F208-F324 HydrophobicContact CZ-CB 4.39Å; F208-F324 AromaticContact CZ-CD2 3.78Å; F208-F324 HydrophobicContact CZ-CD2 3.78Å; F208-F324 HydrophobicContact CZ-CG 4.36Å; Y209-F324 PolarHBondContact OH-O 3.36Å; W320-F324 HydrophobicContact CB-CD2 4.18Å; W320-F324 HydrophobicContact CB-CE2 4.13Å; W320-F324 HydrophobicContact CD2-CE2 4.14Å; W320-F324 HydrophobicContact CE3-CD2 4.22Å; W320-F324 AromaticContact CE3-CE2 3.47Å; W320-F324 HydrophobicContact CE3-CE2 3.47Å; W320-F324 VanDerWaalsContact CE3-CE2 3.47Å; W320-F324 HydrophobicContact CE3-CZ 4.2Å; W320-F324 HydrophobicContact CG-CE2 4.45Å; W320-F324 HydrophobicContact CZ3-CE2 4.22Å; W320-F324 VanDerWaalsContact O-CD2 3.27Å; W320-F324 WeakPolarHBondContact O-CD2 3.29Å; W320-F324 PolarHBondContact O-N 3.35Å; W320-F324 VanDerWaalsContact O-N 3.17Å; L321-F324 PolarHBondContact O-N 2.92Å; F324-T327 WeakPolarHBondContact CA-OG1 3.44Å; F324-T327 PolarHBondContact O-N 3.45Å; F324-T327 PolarHBondContact O-OG1 3.02Å; F324-L328 PolarHBondContact O-N 2.83Å
325	I	89.9	Confident	88.5	Confident	79 Å²	79	56.2 Å²	56.2	41%	0.405	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-49	170.8	-68.9	171.7	0	0	0	110.5	L321 F323 T327 L328 L329	L321-I325 HydrophobicContact CD1-CD1 4.04Å; L321-I325 HydrophobicContact CD1-CG1 4.12Å; L321-I325 HydrophobicContact CD2-CD1 4.29Å; L321-I325 HydrophobicContact CG-CD1 3.73Å; L321-I325 HydrophobicContact CG-CG1 4.24Å; L321-I325 VanDerWaalsContact O-CG1 3.31Å; L321-I325 WeakPolarHBondContact O-CG1 3.35Å; L321-I325 PolarHBondContact O-N 3.47Å; F323-I325 VanDerWaalsContact C-N 3.35Å; F323-I325 PolarHBondContact O-N 3.4Å; I325-T327 PolarHBondContact O-N 2.92Å; I325-L328 PolarHBondContact O-N 3.48Å; I325-L329 HydrophobicContact CG2-CD1 3.62Å; I325-L329 HydrophobicContact CG2-CG 4.24Å; I325-L329 WeakPolarHBondContact O-CG 3.48Å; I325-L329 PolarHBondContact O-N 2.95Å; I325-L329 VanDerWaalsContact O-N 3.08Å
326	Y	88.3	Confident	88.2	Confident	24 Å²	24	59.4 Å²	59.4	9%	0.094	33%	0.334	C	S	.	.	H	α-helix	trans	-56.3	-47.8	177.9	175.7	-86.9	0	0	0	111.8	P322 F323 L328 L329 V330 F337 L341 F342 F345	P322-Y326 WeakPolarHBondContact O-CB 3.41Å; P322-Y326 PolarHBondContact O-N 2.94Å; F323-Y326 WeakPolarHBondContact O-CB 3.49Å; F323-Y326 PolarHBondContact O-N 3.45Å; F323-Y326 VanDerWaalsContact O-N 3.12Å; Y326-L328 VanDerWaalsContact C-N 3.26Å; Y326-L328 PolarHBondContact O-N 3.06Å; Y326-L329 PolarHBondContact O-N 3.49Å; Y326-L329 VanDerWaalsContact O-N 3.07Å; Y326-V330 HydrophobicContact CD1-CG2 3.86Å; Y326-V330 HydrophobicContact CD2-CG2 4Å; Y326-V330 HydrophobicContact CE1-CB 4.46Å; Y326-V330 HydrophobicContact CE1-CG2 3.42Å; Y326-V330 VanDerWaalsContact CE1-CG2 3.42Å; Y326-V330 HydrophobicContact CE2-CG2 3.63Å; Y326-V330 HydrophobicContact CG-CG2 4.11Å; Y326-V330 WeakPolarHBondContact O-CG2 3.27Å; Y326-V330 PolarHBondContact O-N 3.47Å; Y326-F337 HydrophobicContact CD2-CB 4.43Å; Y326-F337 HydrophobicContact CD2-CD1 4.41Å; Y326-F337 HydrophobicContact CD2-CG 4.37Å; Y326-F337 HydrophobicContact CE2-CB 3.75Å; Y326-F337 HydrophobicContact CE2-CG 4.14Å; Y326-L341 HydrophobicContact CD2-CB 4.25Å; Y326-L341 HydrophobicContact CE2-CB 3.86Å; Y326-F342 HydrophobicContact CD1-CD2 4.22Å; Y326-F342 HydrophobicContact CE1-CB 3.83Å; Y326-F342 AromaticContact CE1-CD2 3.68Å; Y326-F342 HydrophobicContact CE1-CD2 3.68Å; Y326-F342 HydrophobicContact CE1-CG 4.25Å; Y326-F345 HydrophobicContact CD2-CD2 4.04Å; Y326-F345 AromaticContact CD2-CE2 3.97Å; Y326-F345 HydrophobicContact CD2-CE2 3.97Å; Y326-F345 AromaticContact CG-CD2 3.97Å; Y326-F345 HydrophobicContact CG-CD2 3.97Å; Y326-F345 HydrophobicContact CG-CE2 4.28Å
327	T	84.6	Confident	87.8	Confident	32 Å²	32	62.3 Å²	62.3	20%	0.196	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-28.1	-179.5	59.9	0	0	0	0	113.9	F323 F324 I325 P331	F323-T327 HydrophobicContact CD1-CG2 4.11Å; F323-T327 HydrophobicContact CD2-CG2 4.41Å; F323-T327 HydrophobicContact CE1-CG2 3.69Å; F323-T327 HydrophobicContact CE2-CG2 4.01Å; F323-T327 HydrophobicContact CG-CG2 4.46Å; F323-T327 HydrophobicContact CZ-CG2 3.63Å; F323-T327 WeakPolarHBondContact O-CG2 3.27Å; F323-T327 PolarHBondContact O-N 3.45Å; F323-T327 PolarHBondContact O-OG1 3.44Å; F324-T327 WeakPolarHBondContact CA-OG1 3.44Å; F324-T327 PolarHBondContact O-N 3.45Å; F324-T327 PolarHBondContact O-OG1 3.02Å; I325-T327 PolarHBondContact O-N 2.92Å; T327-P331 WeakPolarHBondContact O-CD 3.44Å
328	L	84.2	Confident	87.4	Confident	66 Å²	66	65 Å²	65	35%	0.346	36%	0.358	S	S	.	.	H	α-helix	trans	-78.5	-32.5	173.3	-71.7	-172.9	0	0	0	112.8	Y209 F324 I325 Y326	Y209-L328 HydrophobicContact CE2-CD1 3.81Å; Y209-L328 HydrophobicContact CE2-CG 4.28Å; Y209-L328 WeakPolarHBondContact OH-CD1 3.43Å; F324-L328 PolarHBondContact O-N 2.83Å; I325-L328 PolarHBondContact O-N 3.48Å; Y326-L328 VanDerWaalsContact C-N 3.26Å; Y326-L328 PolarHBondContact O-N 3.06Å
329	L	85.9	Confident	86.6	Confident	71 Å²	71	64 Å²	64	37%	0.372	35%	0.354	S	S	.	.	H	α-helix	trans	-85.7	-34	-174.4	-67.1	178.9	0	0	0	113.5	I325 Y326 L332 C333 F337	I325-L329 HydrophobicContact CG2-CD1 3.62Å; I325-L329 HydrophobicContact CG2-CG 4.24Å; I325-L329 WeakPolarHBondContact O-CG 3.48Å; I325-L329 PolarHBondContact O-N 2.95Å; I325-L329 VanDerWaalsContact O-N 3.08Å; Y326-L329 PolarHBondContact O-N 3.49Å; Y326-L329 VanDerWaalsContact O-N 3.07Å; L329-L332 HydrophobicContact CD2-CD1 4.33Å; L329-L332 WeakPolarHBondContact O-CA 3.24Å; L329-L332 WeakPolarHBondContact O-CB 3.29Å; L329-L332 PolarHBondContact O-N 3.35Å; L329-C333 PolarHBondContact O-N 2.91Å; L329-F337 HydrophobicContact CB-CE2 3.68Å; L329-F337 HydrophobicContact CB-CZ 3.64Å; L329-F337 HydrophobicContact CD1-CE1 4.46Å; L329-F337 HydrophobicContact CD1-CZ 3.83Å; L329-F337 HydrophobicContact CG-CZ 4.37Å
330	V	83.6	Confident	86	Confident	42 Å²	42	63.9 Å²	63.9	26%	0.255	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-43.1	-179	165.4	0	0	0	0	113.4	Y326 L332 C333 Q334 F337	Y326-V330 HydrophobicContact CD1-CG2 3.86Å; Y326-V330 HydrophobicContact CD2-CG2 4Å; Y326-V330 HydrophobicContact CE1-CB 4.46Å; Y326-V330 HydrophobicContact CE1-CG2 3.42Å; Y326-V330 VanDerWaalsContact CE1-CG2 3.42Å; Y326-V330 HydrophobicContact CE2-CG2 3.63Å; Y326-V330 HydrophobicContact CG-CG2 4.11Å; Y326-V330 WeakPolarHBondContact O-CG2 3.27Å; Y326-V330 PolarHBondContact O-N 3.47Å; V330-L332 PolarHBondContact O-N 3.31Å; V330-C333 CarbonylContact O-C 3.45Å; V330-C333 PolarHBondContact O-N 3.43Å; V330-Q334 PolarHBondContact O-N 3Å; V330-F337 HydrophobicContact CG2-CD2 3.94Å; V330-F337 HydrophobicContact CG2-CG 4.43Å
331	P	81	Confident	85.7	Confident	80 Å²	80	65.7 Å²	65.7	52%	0.519	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.7	174.3	-24.6	35.3	0	0	0	113.9	T327	T327-P331 WeakPolarHBondContact O-CD 3.44Å
332	L	84.1	Confident	85.4	Confident	145 Å²	145	65.5 Å²	65.5	76%	0.759	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-30.7	178.7	-58.3	175.4	0	0	0	112.4	L329 V330	L329-L332 HydrophobicContact CD2-CD1 4.33Å; L329-L332 WeakPolarHBondContact O-CA 3.24Å; L329-L332 WeakPolarHBondContact O-CB 3.29Å; L329-L332 PolarHBondContact O-N 3.35Å; V330-L332 PolarHBondContact O-N 3.31Å
333	C	81.9	Confident	85.2	Confident	37 Å²	37	64.6 Å²	64.6	25%	0.25	35%	0.353	C	S	.	.			trans	-148.7	100.4	175.8	-174.2	0	0	0	0	111.7	L329 V330 S335 C336	L329-C333 PolarHBondContact O-N 2.91Å; V330-C333 CarbonylContact O-C 3.45Å; V330-C333 PolarHBondContact O-N 3.43Å; C333-S335 PolarHBondContact O-N 3.2Å; C333-C336 HydrophobicContact CB-CB 3.69Å; C333-C336 WeakPolarHBondContact CB-SG 3.48Å; C333-C336 WeakPolarHBondContact SG-CB 3.34Å; C333-C336 PolarHBondContact SG-N 3.11Å; C333-C336 VanDerWaalsContact SG-N 3.35Å; C333-C336 CovalentContact SG-SG 2.02Å; C333-C336 PolarHBondContact SG-SG 3.49Å
334	Q	77.2	Confident	85.3	Confident	168 Å²	168	66.9 Å²	66.9	79%	0.785	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-27.9	-177.5	-67.4	-179.3	-19.1	0	0	113.6	V330	V330-Q334 PolarHBondContact O-N 3Å
335	S	83.8	Confident	85.5	Confident	114 Å²	114	68.1 Å²	68.1	80%	0.797	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.1	-178.4	54.5	0	0	0	0	114.4	C333 F337	C333-S335 PolarHBondContact O-N 3.2Å; S335-F337 VanDerWaalsContact C-N 3.31Å; S335-F337 PolarHBondContact O-N 2.98Å
336	C	86.6	Confident	85.7	Confident	85 Å²	85	64.8 Å²	64.8	57%	0.574	36%	0.355	S	S	*	.	S	Bend	trans	-76.9	-15.9	-175.9	-70.6	0	0	0	0	113.7	C333	C333-C336 HydrophobicContact CB-CB 3.69Å; C333-C336 WeakPolarHBondContact CB-SG 3.48Å; C333-C336 WeakPolarHBondContact SG-CB 3.34Å; C333-C336 PolarHBondContact SG-N 3.11Å; C333-C336 VanDerWaalsContact SG-N 3.35Å; C333-C336 CovalentContact SG-SG 2.02Å; C333-C336 PolarHBondContact SG-SG 3.49Å
337	F	84.5	Confident	86.1	Confident	63 Å²	63	64.6 Å²	64.6	28%	0.276	35%	0.354	S	S	.	.	S	Bend	trans	-126.9	137.1	-169.6	-57.7	-77.3	0	0	0	112.3	Y326 L329 V330 S335 L341	Y326-F337 HydrophobicContact CD2-CB 4.43Å; Y326-F337 HydrophobicContact CD2-CD1 4.41Å; Y326-F337 HydrophobicContact CD2-CG 4.37Å; Y326-F337 HydrophobicContact CE2-CB 3.75Å; Y326-F337 HydrophobicContact CE2-CG 4.14Å; L329-F337 HydrophobicContact CB-CE2 3.68Å; L329-F337 HydrophobicContact CB-CZ 3.64Å; L329-F337 HydrophobicContact CD1-CE1 4.46Å; L329-F337 HydrophobicContact CD1-CZ 3.83Å; L329-F337 HydrophobicContact CG-CZ 4.37Å; V330-F337 HydrophobicContact CG2-CD2 3.94Å; V330-F337 HydrophobicContact CG2-CG 4.43Å; S335-F337 VanDerWaalsContact C-N 3.31Å; S335-F337 PolarHBondContact O-N 2.98Å; F337-L341 HydrophobicContact CB-CD1 4.45Å; F337-L341 HydrophobicContact CD1-CD1 4.45Å
338	H	84.6	Confident	86.7	Confident	98 Å²	98	65.7 Å²	65.7	45%	0.454	36%	0.358	S	S	.	.			trans	-68.5	133.8	174.4	-172.2	-86.6	0	0	0	110.4	G340 L341	H338-G340 VanDerWaalsContact C-N 3.28Å; H338-G340 PolarHBondContact ND1-N 3.49Å; H338-G340 VanDerWaalsContact ND1-N 3.13Å; H338-G340 PolarHBondContact O-N 2.99Å; H338-L341 HydrophobicContact CB-CD1 4.33Å; H338-L341 HydrophobicContact CB-CG 4.26Å; H338-L341 WeakPolarHBondContact O-CB 3.43Å; H338-L341 PolarHBondContact O-N 3.03Å
339	P	76.8	Confident	87.2	Confident	77 Å²	77	62.5 Å²	62.5	50%	0.5	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-38.6	-177.2	-27.9	34.8	0	0	0	114	I12 L341 F342	I12-P339 HydrophobicContact CD1-CB 4.06Å; I12-P339 HydrophobicContact CD1-CG 4.4Å; P339-L341 PolarHBondContact O-N 3.46Å; P339-L341 VanDerWaalsContact O-N 3.08Å; P339-F342 WeakPolarHBondContact O-CB 3.49Å; P339-F342 PolarHBondContact O-N 3.38Å; P339-F342 VanDerWaalsContact O-N 3.15Å
340	G	83.5	Confident	87.8	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-14.2	178.4	0	0	0	0	0	115.3	H338 F342 D343 I344	H338-G340 VanDerWaalsContact C-N 3.28Å; H338-G340 PolarHBondContact ND1-N 3.49Å; H338-G340 VanDerWaalsContact ND1-N 3.13Å; H338-G340 PolarHBondContact O-N 2.99Å; G340-F342 VanDerWaalsContact C-N 3.27Å; G340-F342 PolarHBondContact O-N 3.5Å; G340-D343 PolarHBondContact O-N 3.36Å; G340-I344 WeakPolarHBondContact O-CD1 3.48Å; G340-I344 VanDerWaalsContact O-CG1 3.27Å; G340-I344 WeakPolarHBondContact O-CG1 3.27Å; G340-I344 PolarHBondContact O-N 2.7Å; G340-I344 VanDerWaalsContact O-N 3.17Å
341	L	88.4	Confident	88.4	Confident	51 Å²	51	59.7 Å²	59.7	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-29.9	174.8	-69.8	174.7	0	0	0	112.2	Y326 F337 H338 P339 I344 F345	Y326-L341 HydrophobicContact CD2-CB 4.25Å; Y326-L341 HydrophobicContact CE2-CB 3.86Å; F337-L341 HydrophobicContact CB-CD1 4.45Å; F337-L341 HydrophobicContact CD1-CD1 4.45Å; H338-L341 HydrophobicContact CB-CD1 4.33Å; H338-L341 HydrophobicContact CB-CG 4.26Å; H338-L341 WeakPolarHBondContact O-CB 3.43Å; H338-L341 PolarHBondContact O-N 3.03Å; P339-L341 PolarHBondContact O-N 3.46Å; P339-L341 VanDerWaalsContact O-N 3.08Å; L341-I344 PolarHBondContact O-N 2.82Å; L341-F345 HydrophobicContact CB-CD2 4.33Å; L341-F345 HydrophobicContact CB-CE2 4Å; L341-F345 HydrophobicContact CB-CZ 4.5Å; L341-F345 HydrophobicContact CD2-CE2 4.43Å; L341-F345 HydrophobicContact CD2-CZ 4.1Å; L341-F345 WeakPolarHBondContact O-CB 3.39Å; L341-F345 VanDerWaalsContact O-CD2 3.24Å; L341-F345 WeakPolarHBondContact O-CD2 3.38Å; L341-F345 VanDerWaalsContact O-CG 3.27Å; L341-F345 WeakPolarHBondContact O-CG 3.22Å; L341-F345 PolarHBondContact O-N 2.88Å
342	F	88.2	Confident	89.1	Confident	57 Å²	57	55.9 Å²	55.9	25%	0.25	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-51.9	176.2	178.7	-98.1	0	0	0	110.7	F323 Y326 P339 G340 I344 F345 T346	F323-F342 HydrophobicContact CE2-CD2 4.1Å; F323-F342 AromaticContact CE2-CE2 3.67Å; F323-F342 HydrophobicContact CE2-CE2 3.67Å; F323-F342 HydrophobicContact CE2-CZ 4.24Å; F323-F342 HydrophobicContact CZ-CE2 4.19Å; Y326-F342 HydrophobicContact CD1-CD2 4.22Å; Y326-F342 HydrophobicContact CE1-CB 3.83Å; Y326-F342 AromaticContact CE1-CD2 3.68Å; Y326-F342 HydrophobicContact CE1-CD2 3.68Å; Y326-F342 HydrophobicContact CE1-CG 4.25Å; P339-F342 WeakPolarHBondContact O-CB 3.49Å; P339-F342 PolarHBondContact O-N 3.38Å; P339-F342 VanDerWaalsContact O-N 3.15Å; G340-F342 VanDerWaalsContact C-N 3.27Å; G340-F342 PolarHBondContact O-N 3.5Å; F342-I344 PolarHBondContact O-N 2.8Å; F342-F345 PolarHBondContact O-N 3.4Å; F342-T346 VanDerWaalsContact O-CB 3.29Å; F342-T346 WeakPolarHBondContact O-CB 3.27Å; F342-T346 PolarHBondContact O-N 2.95Å; F342-T346 PolarHBondContact O-OG1 2.93Å
343	D	90.1	Very high	89.6	Confident	17 Å²	17	49.1 Å²	49.1	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-43.2	179.5	-65.9	-30.7	0	0	0	111.1	Y13 T102 Q105 G340 F345 T346 W347	Y13-D343 WeakPolarHBondContact OH-CB 3.43Å; Y13-D343 PolarHBondContact OH-OD2 2.65Å; T102-D343 HydrophobicContact CG2-CB 4.16Å; Q105-D343 PolarHBondContact NE2-OD2 3.37Å; G340-D343 PolarHBondContact O-N 3.36Å; D343-F345 PolarHBondContact O-N 2.76Å; D343-T346 PolarHBondContact O-N 3.21Å; D343-W347 WeakPolarHBondContact O-CB 3.42Å; D343-W347 VanDerWaalsContact O-CD1 3.24Å; D343-W347 PolarHBondContact O-N 3.47Å
344	I	93.3	Very high	90.3	Very high	77 Å²	77	48.8 Å²	48.8	40%	0.395	26%	0.261	S	S	.	.	H	α-helix	trans	-59.2	-49.5	178.5	-69.4	166.3	0	0	0	111.1	G340 L341 F342 L348	G340-I344 WeakPolarHBondContact O-CD1 3.48Å; G340-I344 VanDerWaalsContact O-CG1 3.27Å; G340-I344 WeakPolarHBondContact O-CG1 3.27Å; G340-I344 PolarHBondContact O-N 2.7Å; G340-I344 VanDerWaalsContact O-N 3.17Å; L341-I344 PolarHBondContact O-N 2.82Å; F342-I344 PolarHBondContact O-N 2.8Å; I344-L348 VanDerWaalsContact O-CB 3.29Å; I344-L348 WeakPolarHBondContact O-CB 3.34Å; I344-L348 PolarHBondContact O-N 3.32Å
345	F	95.1	Very high	91.2	Very high	47 Å²	47	43.3 Å²	43.3	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-71.6	-32.4	-178.6	-62.7	-30.9	0	0	0	112.7	P322 F323 Y326 L341 F342 D343 L348 G349	P322-F345 HydrophobicContact CB-CD1 3.69Å; P322-F345 HydrophobicContact CB-CD2 4.49Å; P322-F345 HydrophobicContact CB-CE1 3.89Å; P322-F345 HydrophobicContact CB-CG 4.03Å; P322-F345 HydrophobicContact CB-CZ 4.36Å; F323-F345 HydrophobicContact CB-CB 3.9Å; F323-F345 HydrophobicContact CD2-CB 4.24Å; Y326-F345 HydrophobicContact CD2-CD2 4.04Å; Y326-F345 AromaticContact CD2-CE2 3.97Å; Y326-F345 HydrophobicContact CD2-CE2 3.97Å; Y326-F345 AromaticContact CG-CD2 3.97Å; Y326-F345 HydrophobicContact CG-CD2 3.97Å; Y326-F345 HydrophobicContact CG-CE2 4.28Å; L341-F345 HydrophobicContact CB-CD2 4.33Å; L341-F345 HydrophobicContact CB-CE2 4Å; L341-F345 HydrophobicContact CB-CZ 4.5Å; L341-F345 HydrophobicContact CD2-CE2 4.43Å; L341-F345 HydrophobicContact CD2-CZ 4.1Å; L341-F345 WeakPolarHBondContact O-CB 3.39Å; L341-F345 VanDerWaalsContact O-CD2 3.24Å; L341-F345 WeakPolarHBondContact O-CD2 3.38Å; L341-F345 VanDerWaalsContact O-CG 3.27Å; L341-F345 WeakPolarHBondContact O-CG 3.22Å; L341-F345 PolarHBondContact O-N 2.88Å; F342-F345 PolarHBondContact O-N 3.4Å; D343-F345 PolarHBondContact O-N 2.76Å; F345-L348 PolarHBondContact O-N 3.42Å; F345-G349 PolarHBondContact O-N 2.87Å
346	T	93.6	Very high	91.6	Very high	9 Å²	9	37.9 Å²	37.9	6%	0.055	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-50.6	173.8	-58.4	0	0	0	0	110.7	F323 F342 D343 L348 G349 Y350	F323-T346 VanDerWaalsContact CE2-OG1 3.26Å; F323-T346 WeakPolarHBondContact CE2-OG1 3.47Å; F342-T346 VanDerWaalsContact O-CB 3.29Å; F342-T346 WeakPolarHBondContact O-CB 3.27Å; F342-T346 PolarHBondContact O-N 2.95Å; F342-T346 PolarHBondContact O-OG1 2.93Å; D343-T346 PolarHBondContact O-N 3.21Å; T346-L348 VanDerWaalsContact C-N 3.33Å; T346-L348 PolarHBondContact O-N 3.46Å; T346-G349 WeakPolarHBondContact O-CA 3.44Å; T346-G349 PolarHBondContact O-N 3.31Å; T346-G349 VanDerWaalsContact O-N 3.1Å; T346-Y350 HydrophobicContact CG2-CD2 4.27Å; T346-Y350 HydrophobicContact CG2-CE1 4.39Å; T346-Y350 HydrophobicContact CG2-CE2 3.5Å; T346-Y350 VanDerWaalsContact CG2-CE2 3.5Å; T346-Y350 PolarHBondContact O-N 3.37Å
347	W	96.4	Very high	91.8	Very high	20 Å²	20	34 Å²	34	8%	0.076	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-33.2	177.6	-81.9	100.2	0	0	0	113.1	L48 I51 M95 A99 T102 D343 G349 Y350 L351	L48-W347 HydrophobicContact CB-CH2 3.82Å; L48-W347 HydrophobicContact CB-CZ2 3.99Å; L48-W347 HydrophobicContact CB-CZ3 4.27Å; L48-W347 HydrophobicContact CD1-CH2 4.36Å; L48-W347 HydrophobicContact CD1-CZ2 3.67Å; L48-W347 HydrophobicContact CD2-CD2 3.48Å; L48-W347 VanDerWaalsContact CD2-CD2 3.48Å; L48-W347 HydrophobicContact CD2-CE3 3.67Å; L48-W347 HydrophobicContact CD2-CG 4.04Å; L48-W347 HydrophobicContact CD2-CH2 3.98Å; L48-W347 HydrophobicContact CD2-CZ2 3.82Å; L48-W347 HydrophobicContact CD2-CZ3 3.89Å; L48-W347 HydrophobicContact CG-CH2 4.25Å; L48-W347 HydrophobicContact CG-CZ2 4.01Å; I51-W347 HydrophobicContact CG2-CZ3 4.49Å; M95-W347 HydrophobicContact CB-CH2 4.22Å; M95-W347 HydrophobicContact CB-CZ3 4.47Å; M95-W347 HydrophobicContact CE-CE3 4.4Å; M95-W347 HydrophobicContact CE-CH2 4.42Å; M95-W347 HydrophobicContact CE-CZ3 3.61Å; A99-W347 HydrophobicContact CB-CH2 3.94Å; A99-W347 HydrophobicContact CB-CZ2 3.77Å; T102-W347 PolarHBondContact OG1-NE1 3.4Å; D343-W347 WeakPolarHBondContact O-CB 3.42Å; D343-W347 VanDerWaalsContact O-CD1 3.24Å; D343-W347 PolarHBondContact O-N 3.47Å; W347-G349 VanDerWaalsContact C-N 3.31Å; W347-Y350 HydrophobicContact CD2-CD2 4.16Å; W347-Y350 HydrophobicContact CE3-CD2 4.1Å; W347-Y350 HydrophobicContact CZ3-CD2 4.46Å; W347-Y350 PolarHBondContact O-N 3.43Å; W347-L351 WeakPolarHBondContact O-CG 3.49Å; W347-L351 PolarHBondContact O-N 2.94Å
348	L	97.1	Very high	92	Very high	54 Å²	54	34.7 Å²	34.7	28%	0.283	18%	0.178	S	C	.	.	H	α-helix	trans	-61.8	-40.2	170.4	-177.4	62.9	0	0	0	111.6	C319 P322 I344 F345 T346 L351	C319-L348 VanDerWaalsContact CB-O 3.3Å; C319-L348 WeakPolarHBondContact CB-O 3.44Å; P322-L348 HydrophobicContact CG-CD2 4.12Å; I344-L348 VanDerWaalsContact O-CB 3.29Å; I344-L348 WeakPolarHBondContact O-CB 3.34Å; I344-L348 PolarHBondContact O-N 3.32Å; F345-L348 PolarHBondContact O-N 3.42Å; T346-L348 VanDerWaalsContact C-N 3.33Å; T346-L348 PolarHBondContact O-N 3.46Å; L348-L351 HydrophobicContact CD1-CD1 4.39Å; L348-L351 WeakPolarHBondContact O-CB 3.34Å; L348-L351 PolarHBondContact O-N 2.87Å
349	G	96.1	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-49.3	171.3	0	0	0	0	0	112.3	C319 W320 F345 T346 W347 L351 N352	C319-G349 PolarHBondContact O-N 2.98Å; W320-G349 PolarHBondContact NE1-O 3.05Å; F345-G349 PolarHBondContact O-N 2.87Å; T346-G349 WeakPolarHBondContact O-CA 3.44Å; T346-G349 PolarHBondContact O-N 3.31Å; T346-G349 VanDerWaalsContact O-N 3.1Å; W347-G349 VanDerWaalsContact C-N 3.31Å; G349-L351 VanDerWaalsContact C-N 3.28Å; G349-L351 PolarHBondContact O-N 2.89Å; G349-N352 WeakPolarHBondContact O-CB 3.38Å; G349-N352 PolarHBondContact O-N 3.01Å; G349-N352 VanDerWaalsContact O-N 3.09Å
350	Y	97.2	Very high	92.6	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-29	178.4	-60.3	-29.5	0	0	0	114	V90 V94 M95 S98 D121 W320 T346 W347 N352 S353	V90-Y350 HydrophobicContact CG1-CD1 4.09Å; V94-Y350 HydrophobicContact CG1-CE1 3.82Å; V94-Y350 HydrophobicContact CG1-CE2 4.37Å; V94-Y350 WeakPolarHBondContact CG1-OH 3.44Å; M95-Y350 HydrophobicContact CG-CD2 4.2Å; M95-Y350 HydrophobicContact CG-CG 4.23Å; S98-Y350 WeakPolarHBondContact OG-CE2 3.49Å; D121-Y350 WeakPolarHBondContact OD1-CE1 3.49Å; D121-Y350 PolarHBondContact OD2-OH 3.02Å; W320-Y350 HydrophobicContact CH2-CD1 4.23Å; W320-Y350 HydrophobicContact CH2-CE1 4.21Å; W320-Y350 HydrophobicContact CZ2-CD1 4.38Å; T346-Y350 HydrophobicContact CG2-CD2 4.27Å; T346-Y350 HydrophobicContact CG2-CE1 4.39Å; T346-Y350 HydrophobicContact CG2-CE2 3.5Å; T346-Y350 VanDerWaalsContact CG2-CE2 3.5Å; T346-Y350 PolarHBondContact O-N 3.37Å; W347-Y350 HydrophobicContact CD2-CD2 4.16Å; W347-Y350 HydrophobicContact CE3-CD2 4.1Å; W347-Y350 HydrophobicContact CZ3-CD2 4.46Å; W347-Y350 PolarHBondContact O-N 3.43Å; Y350-N352 PolarHBondContact O-N 3.13Å; Y350-N352 VanDerWaalsContact O-N 3.13Å; Y350-S353 WeakPolarHBondContact O-CB 3.35Å; Y350-S353 PolarHBondContact O-N 3.17Å
351	L	96.3	Very high	92.6	Very high	51 Å²	51	29 Å²	29	27%	0.267	15%	0.147	S	C	.	.	H	α-helix	trans	-59.5	-22.9	174.1	-77.9	173.6	0	0	0	112.8	I51 W347 L348 G349 S353 L354 I355	I51-L351 HydrophobicContact CD1-CD2 4.41Å; I51-L351 HydrophobicContact CG2-CD2 3.7Å; W347-L351 WeakPolarHBondContact O-CG 3.49Å; W347-L351 PolarHBondContact O-N 2.94Å; L348-L351 HydrophobicContact CD1-CD1 4.39Å; L348-L351 WeakPolarHBondContact O-CB 3.34Å; L348-L351 PolarHBondContact O-N 2.87Å; G349-L351 VanDerWaalsContact C-N 3.28Å; G349-L351 PolarHBondContact O-N 2.89Å; L351-S353 PolarHBondContact O-N 3.34Å; L351-L354 HydrophobicContact CD2-CD2 4.1Å; L351-L354 WeakPolarHBondContact O-CB 3.32Å; L351-L354 PolarHBondContact O-N 3.47Å; L351-I355 HydrophobicContact CB-CD1 4.45Å; L351-I355 WeakPolarHBondContact O-CD1 3.3Å; L351-I355 VanDerWaalsContact O-CG1 3.27Å; L351-I355 WeakPolarHBondContact O-CG1 3.39Å; L351-I355 PolarHBondContact O-N 3.27Å
352	N	95.7	Very high	92.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-54	-42	171.6	-177.2	71.3	0	0	0	112.1	Y316 C319 G349 Y350 L354 I355 N356	Y316-N352 VanDerWaalsContact CA-OD1 3.28Å; Y316-N352 WeakPolarHBondContact CA-OD1 3.2Å; C319-N352 HydrophobicContact CB-CB 3.88Å; G349-N352 WeakPolarHBondContact O-CB 3.38Å; G349-N352 PolarHBondContact O-N 3.01Å; G349-N352 VanDerWaalsContact O-N 3.09Å; Y350-N352 PolarHBondContact O-N 3.13Å; Y350-N352 VanDerWaalsContact O-N 3.13Å; N352-L354 PolarHBondContact O-N 3.21Å; N352-I355 PolarHBondContact O-N 3.08Å; N352-I355 VanDerWaalsContact O-N 3.16Å; N352-N356 PolarHBondContact O-N 3.41Å; N352-N356 VanDerWaalsContact O-N 3.1Å; N352-N356 PolarHBondContact O-ND2 3.5Å
353	S	96.1	Very high	91.7	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.028	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-25.3	179.2	-57.9	0	0	0	0	112.9	N59 D87 Y350 L351 P357	N59-S353 PolarHBondContact ND2-O 3Å; D87-S353 PolarHBondContact OD1-OG 3.46Å; Y350-S353 WeakPolarHBondContact O-CB 3.35Å; Y350-S353 PolarHBondContact O-N 3.17Å; L351-S353 PolarHBondContact O-N 3.34Å; S353-P357 WeakPolarHBondContact O-CD 3.45Å
354	L	96.1	Very high	91.1	Very high	30 Å²	30	32.8 Å²	32.8	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-83.3	-38	173	178.1	58.3	0	0	0	112.1	I51 A54 L351 N352 N356 I358	I51-L354 HydrophobicContact CG2-CD2 4.41Å; A54-L354 HydrophobicContact CB-CD1 3.89Å; A54-L354 HydrophobicContact CB-CD2 4.47Å; L351-L354 HydrophobicContact CD2-CD2 4.1Å; L351-L354 WeakPolarHBondContact O-CB 3.32Å; L351-L354 PolarHBondContact O-N 3.47Å; N352-L354 PolarHBondContact O-N 3.21Å; L354-N356 VanDerWaalsContact C-N 3.34Å; L354-N356 PolarHBondContact O-N 3.18Å; L354-I358 HydrophobicContact CG-CD1 4.39Å
355	I	95.2	Very high	90.3	Very high	52 Å²	52	33.7 Å²	33.7	27%	0.267	17%	0.171	S	C	.	.	H	α-helix	trans	-67.5	-35.9	-176.5	-70.1	163.4	0	0	0	111.2	A315 L351 N352 I358 I359	A315-I355 HydrophobicContact CB-CG2 3.88Å; L351-I355 HydrophobicContact CB-CD1 4.45Å; L351-I355 WeakPolarHBondContact O-CD1 3.3Å; L351-I355 VanDerWaalsContact O-CG1 3.27Å; L351-I355 WeakPolarHBondContact O-CG1 3.39Å; L351-I355 PolarHBondContact O-N 3.27Å; N352-I355 PolarHBondContact O-N 3.08Å; N352-I355 VanDerWaalsContact O-N 3.16Å; I355-I358 WeakPolarHBondContact O-CB 3.47Å; I355-I358 PolarHBondContact O-N 3.49Å; I355-I358 VanDerWaalsContact O-N 3.15Å; I355-I359 HydrophobicContact CG2-CD1 3.48Å; I355-I359 VanDerWaalsContact CG2-CD1 3.48Å; I355-I359 HydrophobicContact CG2-CG1 3.97Å; I355-I359 WeakPolarHBondContact O-CG1 3.34Å; I355-I359 PolarHBondContact O-N 2.93Å
356	N	91.9	Very high	89.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-54	-57.3	-177.5	-76.7	-21.9	0	0	0	113.6	D87 N352 L354 I358 I359 Y360	D87-N356 PolarHBondContact OD2-ND2 3.34Å; N352-N356 PolarHBondContact O-N 3.41Å; N352-N356 VanDerWaalsContact O-N 3.1Å; N352-N356 PolarHBondContact O-ND2 3.5Å; L354-N356 VanDerWaalsContact C-N 3.34Å; L354-N356 PolarHBondContact O-N 3.18Å; N356-I358 VanDerWaalsContact C-N 3.28Å; N356-I358 PolarHBondContact O-N 2.98Å; N356-I359 PolarHBondContact O-N 2.89Å; N356-I359 VanDerWaalsContact O-N 3.1Å; N356-Y360 HydrophobicContact CB-CE2 4.01Å; N356-Y360 WeakPolarHBondContact O-CD2 3.37Å; N356-Y360 PolarHBondContact O-N 3.33Å
357	P	91.4	Very high	88.8	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.019	18%	0.178	C	C	.	.	H	α-helix	trans	-53.7	-38.4	173.5	-31.2	36.6	0	0	0	115.2	N59 V62 S353 I359 Y360 T361	N59-P357 HydrophobicContact CB-CG 4.4Å; N59-P357 VanDerWaalsContact CG-CG 3.48Å; N59-P357 WeakPolarHBondContact OD1-CG 3.45Å; V62-P357 HydrophobicContact CG2-CB 3.84Å; V62-P357 HydrophobicContact CG2-CG 4.29Å; S353-P357 WeakPolarHBondContact O-CD 3.45Å; P357-I359 VanDerWaalsContact C-N 3.33Å; P357-Y360 PolarHBondContact O-N 2.9Å; P357-T361 WeakPolarHBondContact O-CB 3.27Å; P357-T361 WeakPolarHBondContact O-CG2 3.32Å; P357-T361 PolarHBondContact O-N 3.2Å; P357-T361 PolarHBondContact O-OG1 3.41Å
358	I	90.1	Very high	88.1	Confident	79 Å²	79	37.1 Å²	37.1	41%	0.405	19%	0.191	S	C	.	.	H	α-helix	trans	-64.1	-43.6	178.6	-60.4	171.5	0	0	0	109.3	L354 I355 N356 Y360 T361 M362	L354-I358 HydrophobicContact CG-CD1 4.39Å; I355-I358 WeakPolarHBondContact O-CB 3.47Å; I355-I358 PolarHBondContact O-N 3.49Å; I355-I358 VanDerWaalsContact O-N 3.15Å; N356-I358 VanDerWaalsContact C-N 3.28Å; N356-I358 PolarHBondContact O-N 2.98Å; I358-Y360 PolarHBondContact O-N 2.9Å; I358-T361 WeakPolarHBondContact CA-OG1 3.46Å; I358-T361 PolarHBondContact O-N 3.33Å; I358-T361 PolarHBondContact O-OG1 3.13Å; I358-M362 HydrophobicContact CG2-CG 4.39Å; I358-M362 HydrophobicContact CG2-SD 4.03Å; I358-M362 WeakPolarHBondContact O-CB 3.21Å; I358-M362 VanDerWaalsContact O-CG 3.27Å; I358-M362 WeakPolarHBondContact O-CG 3.23Å; I358-M362 PolarHBondContact O-N 2.93Å
359	I	89.6	Confident	87.4	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.092	20%	0.202	C	C	.	.	H	α-helix	trans	-65.2	-42.1	177.1	-61.4	166.4	0	0	0	111.1	T308 I311 I312 A315 I355 N356 P357 M362 S363	T308-I359 HydrophobicContact CG2-CG2 3.77Å; I311-I359 HydrophobicContact CG2-CD1 3.94Å; I311-I359 HydrophobicContact CG2-CG1 4.19Å; I311-I359 HydrophobicContact CG2-CG2 4.43Å; I312-I359 HydrophobicContact CB-CD1 4.49Å; I312-I359 HydrophobicContact CD1-CG2 4.06Å; I312-I359 HydrophobicContact CG1-CB 4.15Å; I312-I359 HydrophobicContact CG1-CD1 3.94Å; I312-I359 HydrophobicContact CG1-CG2 3.5Å; A315-I359 HydrophobicContact CB-CD1 4.16Å; I355-I359 HydrophobicContact CG2-CD1 3.48Å; I355-I359 VanDerWaalsContact CG2-CD1 3.48Å; I355-I359 HydrophobicContact CG2-CG1 3.97Å; I355-I359 WeakPolarHBondContact O-CG1 3.34Å; I355-I359 PolarHBondContact O-N 2.93Å; N356-I359 PolarHBondContact O-N 2.89Å; N356-I359 VanDerWaalsContact O-N 3.1Å; P357-I359 VanDerWaalsContact C-N 3.33Å; I359-M362 PolarHBondContact O-N 2.85Å; I359-S363 WeakPolarHBondContact O-CB 3.42Å; I359-S363 PolarHBondContact O-N 3.25Å; I359-S363 PolarHBondContact O-OG 2.87Å
360	Y	83.9	Confident	86.6	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.039	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-46.3	177.8	-62.2	-44.1	0	0	0	112.5	I80 L83 I312 N356 P357 I358 S363 N364	I80-Y360 HydrophobicContact CG1-CE1 4.4Å; I80-Y360 HydrophobicContact CG2-CD1 4.22Å; I80-Y360 HydrophobicContact CG2-CD2 3.89Å; I80-Y360 HydrophobicContact CG2-CE1 4.17Å; I80-Y360 HydrophobicContact CG2-CE2 3.83Å; I80-Y360 HydrophobicContact CG2-CG 4.13Å; L83-Y360 WeakPolarHBondContact CD2-OH 3.32Å; I312-Y360 HydrophobicContact CD1-CD1 4.26Å; I312-Y360 HydrophobicContact CD1-CE1 3.56Å; N356-Y360 HydrophobicContact CB-CE2 4.01Å; N356-Y360 WeakPolarHBondContact O-CD2 3.37Å; N356-Y360 PolarHBondContact O-N 3.33Å; P357-Y360 PolarHBondContact O-N 2.9Å; I358-Y360 PolarHBondContact O-N 2.9Å; Y360-S363 WeakPolarHBondContact CA-OG 3.43Å; Y360-S363 PolarHBondContact O-N 3.36Å; Y360-S363 PolarHBondContact O-OG 3.43Å; Y360-S363 VanDerWaalsContact O-OG 3.12Å; Y360-N364 WeakPolarHBondContact O-CB 3.29Å; Y360-N364 PolarHBondContact O-N 3.43Å; Y360-N364 VanDerWaalsContact O-N 3.11Å
361	T	83.8	Confident	85.8	Confident	28 Å²	28	45.3 Å²	45.3	17%	0.172	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-40.2	177.8	51.6	0	0	0	0	111.7	F61 P357 I358 S363 F367 Q368	F61-T361 HydrophobicContact CD1-CG2 4.41Å; F61-T361 HydrophobicContact CE1-CG2 3.9Å; P357-T361 WeakPolarHBondContact O-CB 3.27Å; P357-T361 WeakPolarHBondContact O-CG2 3.32Å; P357-T361 PolarHBondContact O-N 3.2Å; P357-T361 PolarHBondContact O-OG1 3.41Å; I358-T361 WeakPolarHBondContact CA-OG1 3.46Å; I358-T361 PolarHBondContact O-N 3.33Å; I358-T361 PolarHBondContact O-OG1 3.13Å; T361-S363 PolarHBondContact O-N 3.46Å; T361-F367 HydrophobicContact CG2-CB 4.38Å; T361-Q368 WeakPolarHBondContact O-CG 3.29Å; T361-Q368 PolarHBondContact O-NE2 3.49Å
362	M	81.8	Confident	85.1	Confident	137 Å²	137	48.6 Å²	48.6	68%	0.675	25%	0.245	S	C	*	.	H	α-helix	trans	-72.7	-27.8	178	-70.3	-172.3	77.2	0	0	113.9	I358 I359 Q368	I358-M362 HydrophobicContact CG2-CG 4.39Å; I358-M362 HydrophobicContact CG2-SD 4.03Å; I358-M362 WeakPolarHBondContact O-CB 3.21Å; I358-M362 VanDerWaalsContact O-CG 3.27Å; I358-M362 WeakPolarHBondContact O-CG 3.23Å; I358-M362 PolarHBondContact O-N 2.93Å; I359-M362 PolarHBondContact O-N 2.85Å; M362-Q368 PolarHBondContact O-NE2 3.32Å
363	S	75.8	Confident	84.4	Confident	24 Å²	24	55.6 Å²	55.6	17%	0.168	28%	0.275	C	S	.	.	H	α-helix	trans	-88.9	-29.7	-174.1	56.6	0	0	0	0	114.5	K304 T308 I359 Y360 T361	K304-S363 VanDerWaalsContact CE-O 3.31Å; K304-S363 WeakPolarHBondContact CE-O 3.23Å; T308-S363 VanDerWaalsContact CG2-OG 3.31Å; T308-S363 WeakPolarHBondContact CG2-OG 3.44Å; T308-S363 WeakPolarHBondContact OG1-CB 3.42Å; I359-S363 WeakPolarHBondContact O-CB 3.42Å; I359-S363 PolarHBondContact O-N 3.25Å; I359-S363 PolarHBondContact O-OG 2.87Å; Y360-S363 WeakPolarHBondContact CA-OG 3.43Å; Y360-S363 PolarHBondContact O-N 3.36Å; Y360-S363 PolarHBondContact O-OG 3.43Å; Y360-S363 VanDerWaalsContact O-OG 3.12Å; T361-S363 PolarHBondContact O-N 3.46Å
364	N	77	Confident	83.3	Confident	44 Å²	44	58.5 Å²	58.5	24%	0.235	29%	0.29	C	S	.	.			trans	-114.3	117.2	-172.2	-173.6	-21.5	0	0	0	111.7	Y360 D366 F367 Q368	Y360-N364 WeakPolarHBondContact O-CB 3.29Å; Y360-N364 PolarHBondContact O-N 3.43Å; Y360-N364 VanDerWaalsContact O-N 3.11Å; N364-D366 PolarHBondContact O-N 3.42Å; N364-D366 WeakPolarHBondContact OD1-CB 3.34Å; N364-D366 PolarHBondContact OD1-N 3.02Å; N364-F367 HydrophobicContact CB-CB 4.41Å; N364-F367 HydrophobicContact CB-CD2 3.71Å; N364-F367 WeakPolarHBondContact ND2-CD2 3.44Å; N364-F367 PolarHBondContact O-N 2.87Å; N364-F367 VanDerWaalsContact O-N 3.07Å; N364-Q368 PolarHBondContact O-N 3.1Å
365	E	77.2	Confident	82.3	Confident	95 Å²	95	61.3 Å²	61.3	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-32.6	-178.3	-74.3	162.9	-153	0	0	112.9	K304 F367 Q368 Q369	K304-E365 IonicContact NZ-OE1 2.76Å; K304-E365 PolarHBondContact NZ-OE1 3.22Å; E365-F367 VanDerWaalsContact C-N 3.34Å; E365-Q368 PolarHBondContact O-N 2.99Å; E365-Q369 VanDerWaalsContact O-CG 3.3Å; E365-Q369 WeakPolarHBondContact O-CG 3.22Å; E365-Q369 PolarHBondContact O-N 3.37Å
366	D	77.9	Confident	81.2	Confident	76 Å²	76	63.3 Å²	63.3	41%	0.406	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-37.7	177.3	-66.4	-41.8	0	0	0	111.3	L72 N364 A370	L72-D366 HydrophobicContact CD2-CB 3.8Å; N364-D366 PolarHBondContact O-N 3.42Å; N364-D366 WeakPolarHBondContact OD1-CB 3.34Å; N364-D366 PolarHBondContact OD1-N 3.02Å; D366-A370 WeakPolarHBondContact O-CB 3.33Å; D366-A370 PolarHBondContact O-N 2.75Å
367	F	79.4	Confident	80.3	Confident	1 Å²	1	72.4 Å²	72.4	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-70.8	-37.9	173.7	-78.3	-85.4	0	0	0	111.7	V62 T65 I66 L72 T361 N364 E365 Q369 A370 F371	V62-F367 HydrophobicContact CG1-CE1 4.06Å; V62-F367 HydrophobicContact CG1-CZ 4.44Å; T65-F367 HydrophobicContact CG2-CD1 3.71Å; T65-F367 HydrophobicContact CG2-CE1 3.84Å; I66-F367 HydrophobicContact CD1-CE1 4.35Å; I66-F367 HydrophobicContact CD1-CZ 3.87Å; I66-F367 HydrophobicContact CG1-CE1 3.93Å; I66-F367 HydrophobicContact CG1-CZ 3.58Å; L72-F367 HydrophobicContact CD1-CE2 4.45Å; L72-F367 HydrophobicContact CD1-CZ 4.33Å; T361-F367 HydrophobicContact CG2-CB 4.38Å; N364-F367 HydrophobicContact CB-CB 4.41Å; N364-F367 HydrophobicContact CB-CD2 3.71Å; N364-F367 WeakPolarHBondContact ND2-CD2 3.44Å; N364-F367 PolarHBondContact O-N 2.87Å; N364-F367 VanDerWaalsContact O-N 3.07Å; E365-F367 VanDerWaalsContact C-N 3.34Å; F367-Q369 VanDerWaalsContact C-N 3.35Å; F367-Q369 PolarHBondContact O-N 3.35Å; F367-A370 PolarHBondContact O-N 3.5Å; F367-F371 WeakPolarHBondContact O-CB 3.26Å; F367-F371 PolarHBondContact O-N 3.21Å
368	Q	81.6	Confident	79	Confident	72 Å²	72	78.7 Å²	78.7	34%	0.336	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-46.3	173.5	-65.9	-178.2	-18.7	0	0	111.5	T361 M362 N364 E365 F371 H372	T361-Q368 WeakPolarHBondContact O-CG 3.29Å; T361-Q368 PolarHBondContact O-NE2 3.49Å; M362-Q368 PolarHBondContact O-NE2 3.32Å; N364-Q368 PolarHBondContact O-N 3.1Å; E365-Q368 PolarHBondContact O-N 2.99Å; Q368-F371 PolarHBondContact O-N 2.88Å; Q368-H372 WeakPolarHBondContact O-CB 3.39Å; Q368-H372 PolarHBondContact O-CD2 3.17Å; Q368-H372 VanDerWaalsContact O-CD2 3.26Å; Q368-H372 PolarHBondContact O-N 2.9Å
369	Q	81.9	Confident	77.7	Confident	110 Å²	110	83.8 Å²	83.8	51%	0.514	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-41.1	178.4	-72.4	177.4	18	0	0	111.9	E365 F367 H372 K373	E365-Q369 VanDerWaalsContact O-CG 3.3Å; E365-Q369 WeakPolarHBondContact O-CG 3.22Å; E365-Q369 PolarHBondContact O-N 3.37Å; F367-Q369 VanDerWaalsContact C-N 3.35Å; F367-Q369 PolarHBondContact O-N 3.35Å; Q369-H372 PolarHBondContact O-N 3.45Å; Q369-K373 WeakPolarHBondContact O-CB 3.33Å; Q369-K373 WeakPolarHBondContact O-CG 3.4Å; Q369-K373 PolarHBondContact O-N 3.39Å
370	A	79.3	Confident	76.2	Confident	27 Å²	27	87.4 Å²	87.4	22%	0.223	42%	0.416	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.8	0	0	0	0	0	111.7	F61 T65 D366 F367 K373 L374	F61-A370 HydrophobicContact CZ-CB 4.47Å; T65-A370 HydrophobicContact CG2-CB 3.52Å; D366-A370 WeakPolarHBondContact O-CB 3.33Å; D366-A370 PolarHBondContact O-N 2.75Å; F367-A370 PolarHBondContact O-N 3.5Å; A370-K373 PolarHBondContact O-N 3.26Å; A370-L374 PolarHBondContact O-N 2.89Å
371	F	80	Confident	74.8	Confident	90 Å²	90	91.9 Å²	91.9	40%	0.395	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-45.5	177.1	-175.6	-99.9	0	0	0	111.8	F61 F367 Q368 K373 L374 M375	F61-F371 HydrophobicContact CE1-CB 4.16Å; F61-F371 AromaticContact CE1-CD2 3.97Å; F61-F371 HydrophobicContact CE1-CD2 3.97Å; F61-F371 HydrophobicContact CE2-CD2 4.36Å; F61-F371 HydrophobicContact CZ-CB 3.72Å; F61-F371 AromaticContact CZ-CD2 3.88Å; F61-F371 HydrophobicContact CZ-CD2 3.88Å; F61-F371 HydrophobicContact CZ-CG 4.32Å; F367-F371 WeakPolarHBondContact O-CB 3.26Å; F367-F371 PolarHBondContact O-N 3.21Å; Q368-F371 PolarHBondContact O-N 2.88Å; F371-K373 PolarHBondContact O-N 3.38Å; F371-L374 WeakPolarHBondContact O-CB 3.38Å; F371-L374 PolarHBondContact O-N 2.73Å; F371-M375 HydrophobicContact CD1-CG 4.06Å; F371-M375 HydrophobicContact CE1-CG 3.65Å; F371-M375 HydrophobicContact CE1-SD 4.41Å; F371-M375 HydrophobicContact CE2-CG 4.33Å; F371-M375 HydrophobicContact CZ-CG 3.8Å; F371-M375 HydrophobicContact CZ-SD 4.03Å; F371-M375 WeakPolarHBondContact O-CG 3.37Å; F371-M375 PolarHBondContact O-N 3.35Å
372	H	80.6	Confident	73.1	Confident	121 Å²	121	102 Å²	102	56%	0.56	48%	0.482	S	S	*	.	H	α-helix	trans	-60	-43.3	175	-87.4	-67.1	0	0	0	112.3	Q368 Q369 L374 M375 L376	Q368-H372 WeakPolarHBondContact O-CB 3.39Å; Q368-H372 PolarHBondContact O-CD2 3.17Å; Q368-H372 VanDerWaalsContact O-CD2 3.26Å; Q368-H372 PolarHBondContact O-N 2.9Å; Q369-H372 PolarHBondContact O-N 3.45Å; H372-L374 VanDerWaalsContact C-N 3.32Å; H372-L374 PolarHBondContact O-N 2.91Å; H372-M375 PolarHBondContact O-N 3.45Å; H372-L376 WeakPolarHBondContact O-CB 3.43Å; H372-L376 WeakPolarHBondContact O-CG 3.25Å; H372-L376 PolarHBondContact O-N 2.88Å
373	K	81.3	Confident	71.3	Confident	147 Å²	147	102 Å²	102	64%	0.639	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-41.3	175.5	-76.6	177.3	-178.6	-179.1	0	112	Q369 A370 F371 L376 R377	Q369-K373 WeakPolarHBondContact O-CB 3.33Å; Q369-K373 WeakPolarHBondContact O-CG 3.4Å; Q369-K373 PolarHBondContact O-N 3.39Å; A370-K373 PolarHBondContact O-N 3.26Å; F371-K373 PolarHBondContact O-N 3.38Å; K373-L376 PolarHBondContact O-N 3.33Å; K373-R377 WeakPolarHBondContact O-CB 3.21Å; K373-R377 PolarHBondContact O-N 3.47Å
374	L	73.3	Confident	71	Confident	65 Å²	65	105.9 Å²	105.9	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-48.9	176.5	-175.7	65.6	0	0	0	111.2	F61 A370 F371 H372 L376 R377 F378	F61-L374 HydrophobicContact CD2-CD2 3.43Å; F61-L374 VanDerWaalsContact CD2-CD2 3.43Å; F61-L374 HydrophobicContact CE2-CB 4.32Å; F61-L374 HydrophobicContact CE2-CD2 3.48Å; F61-L374 VanDerWaalsContact CE2-CD2 3.48Å; A370-L374 PolarHBondContact O-N 2.89Å; F371-L374 WeakPolarHBondContact O-CB 3.38Å; F371-L374 PolarHBondContact O-N 2.73Å; H372-L374 VanDerWaalsContact C-N 3.32Å; H372-L374 PolarHBondContact O-N 2.91Å; L374-L376 VanDerWaalsContact C-N 3.33Å; L374-L376 PolarHBondContact O-N 2.89Å; L374-R377 PolarHBondContact O-N 3.44Å; L374-F378 HydrophobicContact CD1-CD2 4.05Å; L374-F378 HydrophobicContact CD1-CE2 3.53Å; L374-F378 HydrophobicContact CD1-CZ 4.41Å; L374-F378 HydrophobicContact CD2-CE2 4.15Å; L374-F378 HydrophobicContact CG-CD2 3.89Å; L374-F378 HydrophobicContact CG-CE2 3.61Å; L374-F378 VanDerWaalsContact O-CD2 3.23Å; L374-F378 WeakPolarHBondContact O-CD2 3.46Å; L374-F378 PolarHBondContact O-N 3.39Å
375	M	74.7	Confident	70.7	Confident	89 Å²	89	109.1 Å²	109.1	44%	0.438	54%	0.536	S	S	.	.	H	α-helix	trans	-61.6	-39.1	177.9	-72.4	-64	-70.1	0	0	112.6	F371 H372 F378 R379	F371-M375 HydrophobicContact CD1-CG 4.06Å; F371-M375 HydrophobicContact CE1-CG 3.65Å; F371-M375 HydrophobicContact CE1-SD 4.41Å; F371-M375 HydrophobicContact CE2-CG 4.33Å; F371-M375 HydrophobicContact CZ-CG 3.8Å; F371-M375 HydrophobicContact CZ-SD 4.03Å; F371-M375 WeakPolarHBondContact O-CG 3.37Å; F371-M375 PolarHBondContact O-N 3.35Å; H372-M375 PolarHBondContact O-N 3.45Å; M375-F378 PolarHBondContact O-N 3.38Å; M375-R379 WeakPolarHBondContact O-CG 3.01Å; M375-R379 PolarHBondContact O-N 3.34Å
376	L	73.9	Confident	70.4	Confident	94 Å²	94	109.9 Å²	109.9	49%	0.492	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-41.1	174.9	-73.6	168.8	0	0	0	111.5	H372 K373 L374 F378 R379 C380	H372-L376 WeakPolarHBondContact O-CB 3.43Å; H372-L376 WeakPolarHBondContact O-CG 3.25Å; H372-L376 PolarHBondContact O-N 2.88Å; K373-L376 PolarHBondContact O-N 3.33Å; L374-L376 VanDerWaalsContact C-N 3.33Å; L374-L376 PolarHBondContact O-N 2.89Å; L376-F378 PolarHBondContact O-N 3.4Å; L376-R379 PolarHBondContact O-N 3.45Å; L376-C380 PolarHBondContact O-N 3.41Å; L376-C380 PolarHBondContact O-SG 3.46Å; L376-C380 VanDerWaalsContact O-SG 3.41Å
377	R	71	Confident	69.9	Low	190 Å²	190	111.9 Å²	111.9	72%	0.717	55%	0.549	S	S	*	.	H	α-helix	trans	-63.3	-41.3	176.4	-160.5	174.5	-171.9	178.5	1.2	111.8	K373 L374 R379 C380 C381	K373-R377 WeakPolarHBondContact O-CB 3.21Å; K373-R377 PolarHBondContact O-N 3.47Å; L374-R377 PolarHBondContact O-N 3.44Å; R377-R379 PolarHBondContact O-N 2.83Å; R377-C380 PolarHBondContact O-N 3.41Å; R377-C381 PolarHBondContact O-N 3.46Å; R377-C381 PolarHBondContact O-SG 3.42Å
378	F	64.3	Low	69.3	Low	136 Å²	136	118.8 Å²	118.8	60%	0.596	58%	0.583	S	S	*	*	H	α-helix	trans	-64.9	-35.5	173.3	-80.1	-66.7	0	0	0	113.2	L374 M375 L376 R382	L374-F378 HydrophobicContact CD1-CD2 4.05Å; L374-F378 HydrophobicContact CD1-CE2 3.53Å; L374-F378 HydrophobicContact CD1-CZ 4.41Å; L374-F378 HydrophobicContact CD2-CE2 4.15Å; L374-F378 HydrophobicContact CG-CD2 3.89Å; L374-F378 HydrophobicContact CG-CE2 3.61Å; L374-F378 VanDerWaalsContact O-CD2 3.23Å; L374-F378 WeakPolarHBondContact O-CD2 3.46Å; L374-F378 PolarHBondContact O-N 3.39Å; M375-F378 PolarHBondContact O-N 3.38Å; L376-F378 PolarHBondContact O-N 3.4Å; F378-R382 PolarHBondContact O-N 3.35Å
379	R	64.3	Low	68.5	Low	186 Å²	186	121.9 Å²	121.9	70%	0.702	60%	0.599	S	S	*	*	H	α-helix	trans	-69	-38.2	173.7	-73.7	175.5	78.4	176.2	4.3	112.3	M375 L376 R377 R382 A383	M375-R379 WeakPolarHBondContact O-CG 3.01Å; M375-R379 PolarHBondContact O-N 3.34Å; L376-R379 PolarHBondContact O-N 3.45Å; R377-R379 PolarHBondContact O-N 2.83Å; R379-R382 PolarHBondContact O-N 2.89Å; R379-A383 PolarHBondContact O-N 2.81Å
380	C	57	Low	67.5	Low	94 Å²	94	122.8 Å²	122.8	64%	0.635	61%	0.605	S	S	*	*	H	α-helix	trans	-75.2	-21.1	176.8	-69.1	0	0	0	0	114.3	L376 R377 R382	L376-C380 PolarHBondContact O-N 3.41Å; L376-C380 PolarHBondContact O-SG 3.46Å; L376-C380 VanDerWaalsContact O-SG 3.41Å; R377-C380 PolarHBondContact O-N 3.41Å; C380-R382 VanDerWaalsContact C-N 3.33Å
381	C	54	Low	66.6	Low	104 Å²	104	130.2 Å²	130.2	70%	0.703	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-7.1	172.1	-68.9	0	0	0	0	113.4	R377	R377-C381 PolarHBondContact O-N 3.46Å; R377-C381 PolarHBondContact O-SG 3.42Å
382	R	48.7	Very low	65.5	Low	239 Å²	239	133.5 Å²	133.5	90%	0.902	66%	0.655	S	S	*	*			trans	-107.8	-6	-179.9	-152.1	176.8	-174.8	-179.5	1.4	112.8	F378 R379 C380	F378-R382 PolarHBondContact O-N 3.35Å; R379-R382 PolarHBondContact O-N 2.89Å; C380-R382 VanDerWaalsContact C-N 3.33Å
383	A	43.3	Very low	64.2	Low	137 Å²	137	134.6 Å²	134.6	100%	1.132	66%	0.663	S	S	*	*			trans	-104.8	0	167.9	0	0	0	0	0	107.9	R379	R379-A383 PolarHBondContact O-N 2.81Å

Retrieved 383 of 383 residues in 139.8 ms (Link to these results)

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